data_1whf_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 1whf _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 ' 17' ' ' CYS . . . . . 0.468 ' HA ' ' HB1' ' A' ' 21' ' ' ALA . 84.9 m . . . . . 0 N--CA 1.494 1.755 0 CA-C-O 121.382 0.61 . . . . 0.0 109.758 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.517 HD13 ' CB ' ' A' ' 48' ' ' ASP . 0.2 OUTLIER . . . . . 0 C--N 1.299 -1.622 0 CA-C-O 121.795 0.807 . . . . 0.0 110.018 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.468 ' HB1' ' HA ' ' A' ' 17' ' ' CYS . . . . . . . . 0 N--CA 1.489 1.505 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.419 ' SG ' ' C ' ' A' ' 21' ' ' ALA . 0.5 OUTLIER -151.98 -170.35 3.62 Favored 'General case' 0 C--N 1.289 -2.024 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.936 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 35.5 p -175.96 -35.27 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.605 ' CD2' ' CE2' ' A' ' 41' ' ' TRP . 0.4 OUTLIER . . . . . 0 C--N 1.303 -1.448 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 179.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.706 0 CA-C-O 121.426 0.631 . . . . 0.0 110.602 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.558 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 24.6 ptt180 . . . . . 0 C--N 1.3 -1.559 0 N-CA-C 106.634 -1.617 . . . . 0.0 106.634 177.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.4 t . . . . . 0 N--CA 1.485 1.278 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.7 ' CD1' ' N ' ' A' ' 31' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.306 -1.295 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.629 ' HB2' ' CB ' ' A' ' 36' ' ' GLN . 50.7 p-10 . . . . . 0 N--CA 1.479 0.98 0 CA-C-O 121.211 0.529 . . . . 0.0 111.559 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.524 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 N--CA 1.49 1.537 0 O-C-N 121.272 -0.892 . . . . 0.0 109.056 178.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.744 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 2.0 mt-30 . . . . . 0 C--O 1.2 -1.522 0 N-CA-C 105.907 -1.886 . . . . 0.0 105.907 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.753 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 40.7 p -41.37 -59.46 1.55 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 120.045 -1.659 . . . . 0.0 106.763 177.037 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.485 ' O ' ' O ' ' A' ' 41' ' ' TRP . 0.4 OUTLIER . . . . . 0 C--N 1.287 -2.109 0 O-C-N 121.166 -0.959 . . . . 0.0 109.745 177.152 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.744 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 12.5 t80 . . . . . 0 N--CA 1.489 1.476 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.753 ' CD1' ' O ' ' A' ' 37' ' ' THR . 7.6 m95 -80.63 -171.0 2.88 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 177.239 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.599 ' O ' ' CB ' ' A' ' 43' ' ' LYS . 54.8 p 42.13 87.74 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.874 0 O-C-N 120.577 -1.327 . . . . 0.0 109.904 179.098 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.599 ' CB ' ' O ' ' A' ' 42' ' ' SER . 4.9 ptpt 115.19 5.55 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 -179.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.604 ' HA ' ' CG2' ' A' ' 65' ' ' ILE . 0.7 OUTLIER -80.7 -95.34 0.04 OUTLIER 'General case' 0 C--O 1.206 -1.212 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 179.489 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.599 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.0 OUTLIER 12.61 55.3 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.597 0 CA-C-O 121.326 0.584 . . . . 0.0 111.17 179.346 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.599 ' N ' ' O ' ' A' ' 44' ' ' TYR . 11.6 t0 -143.98 16.76 1.76 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.325 -0.859 . . . . 0.0 108.979 -178.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.523 ' O ' ' CB ' ' A' ' 48' ' ' ASP . . . 75.29 2.86 68.53 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 107.86 -2.096 . . . . 0.0 107.86 -177.477 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.588 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER 88.55 7.16 0.16 Allowed 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -179.358 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.717 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 1.6 mt-30 72.47 -23.44 0.2 Allowed 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 120.403 -0.519 . . . . 0.0 112.275 178.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . 0.45 ' O ' ' HD3' ' A' ' 54' ' ' PRO . 17.1 t -93.55 -21.24 19.56 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 120.632 -1.292 . . . . 0.0 107.727 178.311 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -55.99 139.65 45.86 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 179.105 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 101.65 -13.04 58.1 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.416 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 31.7 t60 65.85 63.33 0.99 Allowed Pre-proline 0 N--CA 1.489 1.486 0 O-C-N 121.333 -1.098 . . . . 0.0 109.968 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.45 ' HD3' ' O ' ' A' ' 50' ' ' CYS . 3.5 Cg_exo -60.77 -39.35 63.6 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 C-N-CA 122.25 1.966 . . . . 0.0 110.167 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.469 ' SG ' ' O ' ' A' ' 60' ' ' HIS . 1.9 m -78.42 162.24 26.55 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.56 -0.712 . . . . 0.0 109.372 -179.466 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.515 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 6.0 mt -145.57 -173.85 4.24 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.994 -1.066 . . . . 0.0 110.658 -179.299 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.603 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 0.9 OUTLIER 43.83 64.51 1.25 Allowed 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 121.831 0.824 . . . . 0.0 108.99 -179.486 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.445 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 5.2 mm-40 51.14 31.02 6.13 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.226 177.715 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . 0.416 ' HA2' ' O ' ' A' ' 71' ' ' THR . . . -83.05 141.61 20.9 Favored Glycine 0 N--CA 1.488 2.135 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.469 ' O ' ' SG ' ' A' ' 55' ' ' CYS . 97.8 m-70 -79.23 -164.04 0.57 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.219 -1.165 . . . . 0.0 108.059 179.16 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.465 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 12.5 t -160.77 120.03 2.64 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.553 -1.342 . . . . 0.0 110.922 -179.393 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.494 1.762 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 178.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.591 ' O ' ' O ' ' A' ' 65' ' ' ILE . . . . . . . . 0 N--CA 1.495 2.599 0 N-CA-C 111.459 -0.656 . . . . 0.0 111.459 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.604 ' CG2' ' HA ' ' A' ' 44' ' ' TYR . 2.4 pp 34.59 -165.22 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.511 2.585 0 CA-C-N 118.299 1.049 . . . . 0.0 109.964 -179.184 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . 0.549 ' N ' HD11 ' A' ' 65' ' ' ILE . . . 47.51 30.67 6.38 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 106.326 -2.71 . . . . 0.0 106.326 -178.248 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.602 ' OD1' ' N ' ' A' ' 68' ' ' TYR . 0.4 OUTLIER 85.58 -171.75 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.507 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 -176.287 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.717 ' CD1' ' HB3' ' A' ' 49' ' ' GLN . 1.0 OUTLIER -137.67 -162.14 1.26 Allowed 'General case' 0 C--N 1.285 -2.229 0 O-C-N 120.345 -1.472 . . . . 0.0 108.376 -178.218 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -148.76 165.22 32.07 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 178.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 61' ' ' CYS . 22.6 m -132.05 -165.57 1.61 Allowed 'General case' 0 C--N 1.293 -1.856 0 O-C-N 120.637 -1.29 . . . . 0.0 108.019 179.274 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.462 ' HB ' ' HB2' ' A' ' 60' ' ' HIS . 0.7 OUTLIER -160.15 118.41 2.65 Favored 'General case' 0 C--N 1.297 -1.705 0 O-C-N 121.1 -1.0 . . . . 0.0 109.618 179.516 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.505 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 59.3 m -96.76 139.56 32.64 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.137 -0.977 . . . . 0.0 109.33 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.605 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . . . -71.64 -176.05 1.5 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.114 -0.991 . . . . 0.0 110.467 -179.6 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -81.42 102.02 10.23 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-O 123.149 1.452 . . . . 0.0 108.152 178.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . 0.454 ' O ' ' OG1' ' A' ' 85' ' ' THR . . . 121.21 21.7 3.04 Favored Glycine 0 C--N 1.268 -3.236 0 CA-C-N 113.663 -1.608 . . . . 0.0 109.195 -179.122 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.605 ' CE1' ' HB2' ' A' ' 73' ' ' ALA . 4.7 m-85 -116.43 166.22 12.33 Favored 'General case' 0 C--N 1.295 -1.801 0 O-C-N 121.581 -0.952 . . . . 0.0 109.423 -178.225 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.478 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 3.6 mt-10 -159.95 170.76 20.69 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 120.775 -1.203 . . . . 0.0 110.458 -179.331 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.83 166.0 39.6 Favored Glycine 0 N--CA 1.489 2.2 0 N-CA-C 109.678 -1.369 . . . . 0.0 109.678 179.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.451 ' HD3' ' C ' ' A' ' 79' ' ' LYS . 2.3 tmtt? -55.77 -56.19 23.39 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.255 -1.144 . . . . 0.0 109.139 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.515 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.9 OUTLIER -94.06 30.19 1.95 Allowed 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 179.856 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . 0.485 ' O ' ' HB2' ' A' ' 57' ' ' ASN . 3.1 m 61.2 14.43 5.54 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.867 -1.146 . . . . 0.0 108.622 -179.527 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -44.5 -46.54 9.8 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.601 -0.687 . . . . 0.0 111.456 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.601 ' N ' ' CD1' ' A' ' 83' ' ' PHE . 0.5 OUTLIER -81.16 84.45 6.55 Favored 'General case' 0 C--N 1.297 -1.687 0 O-C-N 121.401 -0.812 . . . . 0.0 110.751 -178.406 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.518 ' N ' ' OD1' ' A' ' 57' ' ' ASN . 0.1 OUTLIER -66.73 94.42 0.3 Allowed 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 178.473 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.459 ' OG1' ' HG3' ' A' ' 86' ' ' ARG . 20.0 p -49.05 -29.62 5.28 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.185 -0.947 . . . . 0.0 110.239 -178.729 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.459 ' HG3' ' OG1' ' A' ' 85' ' ' THR . 9.4 mtp180 . . . . . 0 C--N 1.289 -2.055 0 CA-C-O 117.995 -1.003 . . . . 0.0 109.642 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.674 ' O ' ' HB2' ' A' ' 18' ' ' LEU . 9.9 p . . . . . 0 N--CA 1.501 2.112 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.674 ' HB2' ' O ' ' A' ' 17' ' ' CYS . 1.9 mm? . . . . . 0 N--CA 1.503 2.182 0 C-N-CA 124.059 0.943 . . . . 0.0 109.891 178.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.768 0 CA-C-O 121.912 0.863 . . . . 0.0 109.745 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 30.1 p -119.66 167.87 11.6 Favored 'General case' 0 C--N 1.292 -1.932 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.513 ' O ' ' CB ' ' A' ' 24' ' ' LEU . 42.3 t -87.76 1.33 54.14 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.214 -0.929 . . . . 0.0 109.082 179.201 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.513 ' CB ' ' O ' ' A' ' 23' ' ' SER . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.631 0 O-C-N 121.429 -0.794 . . . . 0.0 109.832 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.862 0 CA-C-O 120.774 0.321 . . . . 0.0 110.637 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.52 ' NH1' ' HG2' ' A' ' 28' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.423 0 O-C-N 120.766 -1.209 . . . . 0.0 111.571 -179.276 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.0 p . . . . . 0 N--CA 1.494 1.765 0 CA-C-O 121.36 0.6 . . . . 0.0 109.736 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 . . . . . 0 N--CA 1.492 1.632 0 O-C-N 121.351 -0.843 . . . . 0.0 109.944 -179.656 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.577 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 1.5 m-20 . . . . . 0 N--CA 1.485 1.325 0 CA-C-O 121.274 0.559 . . . . 0.0 110.752 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.515 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 N--CA 1.485 1.287 0 N-CA-C 107.494 -1.298 . . . . 0.0 107.494 178.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.635 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 13.2 mm100 . . . . . 0 C--O 1.206 -1.218 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.72 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -40.97 -58.43 1.72 Allowed 'General case' 0 N--CA 1.499 1.991 0 C-N-CA 117.743 -1.583 . . . . 0.0 107.33 178.569 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.465 ' O ' ' N ' ' A' ' 41' ' ' TRP . 0.6 OUTLIER . . . . . 0 C--N 1.298 -1.631 0 O-C-N 121.115 -0.99 . . . . 0.0 109.493 177.291 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.635 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 9.6 t80 . . . . . 0 C--O 1.205 -1.265 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.72 ' CD1' ' O ' ' A' ' 37' ' ' THR . 7.1 m95 -79.46 -179.79 7.01 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 120.83 -1.169 . . . . 0.0 108.593 177.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.665 ' O ' ' CB ' ' A' ' 43' ' ' LYS . 1.5 t 36.84 92.86 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.659 -0.651 . . . . 0.0 110.2 179.259 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.665 ' CB ' ' O ' ' A' ' 42' ' ' SER . 0.0 OUTLIER 123.14 -33.33 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 106.235 -1.765 . . . . 0.0 106.235 -178.789 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.632 ' HB2' ' O ' ' A' ' 40' ' ' PHE . 0.1 OUTLIER -55.05 -73.66 0.05 Allowed 'General case' 0 C--N 1.299 -1.614 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.58 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.593 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -0.69 68.96 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.662 0 CA-C-O 121.457 0.646 . . . . 0.0 111.137 179.435 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.602 ' N ' ' O ' ' A' ' 44' ' ' TYR . 8.2 t70 -160.45 28.0 0.16 Allowed 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.381 -0.825 . . . . 0.0 109.204 -178.476 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.534 ' O ' ' CD1' ' A' ' 18' ' ' LEU . . . 67.31 12.1 60.33 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 108.272 -1.931 . . . . 0.0 108.272 -178.5 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.574 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 33.7 t70 71.72 21.4 4.32 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.817 -0.813 . . . . 0.0 109.611 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.601 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 52.9 mm-40 70.53 -10.63 0.68 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.843 -0.536 . . . . 0.0 112.142 178.473 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . 0.427 ' O ' ' HD3' ' A' ' 54' ' ' PRO . 52.9 t -114.6 -10.11 12.55 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.446 -1.409 . . . . 0.0 109.986 179.555 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.492 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 12.1 tm-20 -62.1 152.26 33.3 Favored 'General case' 0 N--CA 1.482 1.169 0 O-C-N 120.819 -1.176 . . . . 0.0 108.851 179.525 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.441 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . 93.52 -12.77 68.95 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 110.173 -1.171 . . . . 0.0 110.173 179.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.443 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 6.1 t60 68.84 66.08 0.52 Allowed Pre-proline 0 N--CA 1.492 1.651 0 O-C-N 120.982 -1.305 . . . . 0.0 109.234 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.443 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 5.4 Cg_exo -60.86 -40.09 56.49 Favored 'Trans proline' 0 C--N 1.31 -1.494 0 C-N-CA 122.651 2.234 . . . . 0.0 111.302 -179.454 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.493 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 1.0 OUTLIER -83.61 174.05 10.87 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.118 -0.989 . . . . 0.0 109.947 -179.044 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.579 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.2 mt -147.07 -171.77 3.85 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.487 -0.758 . . . . 0.0 108.967 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.735 ' HB3' ' CD2' ' A' ' 76' ' ' PHE . 0.9 OUTLIER 48.71 57.14 6.66 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.419 -0.801 . . . . 0.0 110.055 179.727 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.456 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 0.7 OUTLIER 44.69 33.84 1.03 Allowed 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 178.17 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -83.3 153.7 30.76 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 -179.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.465 ' O ' ' SG ' ' A' ' 55' ' ' CYS . 0.1 OUTLIER -79.53 164.96 23.47 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.4 -1.059 . . . . 0.0 108.319 179.035 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.493 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 20.4 t -134.31 111.69 10.41 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.018 -1.051 . . . . 0.0 110.519 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.48 ' HB3' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.298 -1.656 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 177.46 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.427 ' O ' ' CG ' ' A' ' 49' ' ' GLN . . . . . . . . 0 N--CA 1.489 2.172 0 N-CA-C 107.618 -2.193 . . . . 0.0 107.618 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.526 ' CG2' ' HG3' ' A' ' 43' ' ' LYS . 10.2 mm -94.37 -67.42 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 120.619 -1.518 . . . . 0.0 110.014 179.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . 0.503 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . -43.47 -26.94 0.72 Allowed Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.189 -1.565 . . . . 0.0 109.189 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.503 ' HB3' ' O ' ' A' ' 66' ' ' GLY . 6.6 p-10 175.54 -149.47 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.635 -0.921 . . . . 0.0 109.592 179.275 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.626 ' N ' ' CD1' ' A' ' 68' ' ' TYR . 2.8 p90 -160.43 -165.1 1.36 Allowed 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 -179.399 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.48 ' OG1' ' HB3' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -147.82 179.26 7.85 Favored 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.535 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 3.8 m -141.23 -170.83 3.15 Favored 'General case' 0 C--N 1.297 -1.702 0 O-C-N 120.898 -1.126 . . . . 0.0 108.253 179.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 4.0 m -160.78 140.92 11.18 Favored 'General case' 0 C--N 1.292 -1.901 0 O-C-N 121.461 -0.775 . . . . 0.0 109.315 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 55.9 m -105.77 139.17 40.75 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.147 -0.971 . . . . 0.0 109.37 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.37 175.64 5.27 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.076 -1.015 . . . . 0.0 109.66 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -80.66 102.13 9.67 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 123.065 1.412 . . . . 0.0 107.668 178.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . 0.592 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 130.46 8.15 3.29 Favored Glycine 0 C--N 1.269 -3.17 0 CA-C-N 113.902 -1.499 . . . . 0.0 110.186 -179.352 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.735 ' CD2' ' HB3' ' A' ' 57' ' ' ASN . 13.8 m-85 -130.64 169.19 15.95 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 120.779 -1.424 . . . . 0.0 110.155 -178.547 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.507 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 2.3 mt-10 -160.56 174.52 13.92 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.104 -0.998 . . . . 0.0 110.046 -178.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 112.24 169.37 18.06 Favored Glycine 0 N--CA 1.493 2.47 0 N-CA-C 110.12 -1.192 . . . . 0.0 110.12 179.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.441 ' HD3' ' C ' ' A' ' 79' ' ' LYS . 3.1 tmtt? -56.98 -55.71 31.18 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.268 -1.137 . . . . 0.0 108.428 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.579 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.7 OUTLIER -99.75 26.97 5.73 Favored 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 178.183 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . 0.521 ' O ' ' HB2' ' A' ' 57' ' ' ASN . 1.8 m 55.84 71.7 0.54 Allowed 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 105.389 -2.078 . . . . 0.0 105.389 -177.088 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.426 ' O ' ' HG3' ' A' ' 82' ' ' GLU . 0.5 OUTLIER -108.24 -30.9 8.12 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.373 -0.829 . . . . 0.0 110.266 -176.894 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.66 ' N ' ' CD1' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -87.12 81.52 7.99 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.043 -1.035 . . . . 0.0 109.996 -179.792 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.22 108.88 0.46 Allowed 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 179.124 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.421 ' O ' ' OXT' ' A' ' 86' ' ' ARG . 5.0 p -85.89 -11.78 52.34 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.083 -1.011 . . . . 0.0 109.974 -179.29 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.543 ' HG3' ' NH1' ' A' ' 86' ' ' ARG . 0.3 OUTLIER . . . . . 0 C--N 1.297 -1.699 0 CA-C-O 118.104 -0.951 . . . . 0.0 109.467 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.555 ' HA ' ' CB ' ' A' ' 21' ' ' ALA . 42.1 m . . . . . 0 N--CA 1.49 1.536 0 CA-C-O 120.877 0.37 . . . . 0.0 110.435 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.411 HD11 ' O ' ' A' ' 18' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.479 0 O-C-N 120.802 -1.186 . . . . 0.0 108.569 179.018 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.555 ' CB ' ' HA ' ' A' ' 17' ' ' CYS . . . . . . . . 0 N--CA 1.493 1.684 0 CA-C-O 121.678 0.752 . . . . 0.0 109.928 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.419 ' C ' ' OG ' ' A' ' 23' ' ' SER . 2.4 m -143.33 -44.35 0.29 Allowed 'General case' 0 C--N 1.289 -2.031 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 179.268 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.419 ' OG ' ' C ' ' A' ' 22' ' ' CYS . 0.0 OUTLIER 61.28 -85.3 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.57 -0.706 . . . . 0.0 110.515 179.328 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.596 HD12 ' CE2' ' A' ' 41' ' ' TRP . 0.9 OUTLIER . . . . . 0 N--CA 1.493 1.711 0 O-C-N 120.964 -1.085 . . . . 0.0 110.139 -179.059 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.694 0 CA-C-O 121.061 0.458 . . . . 0.0 110.175 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 28.7 mtt180 . . . . . 0 N--CA 1.489 1.496 0 O-C-N 121.114 -0.992 . . . . 0.0 110.523 -179.766 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.516 HG13 ' CD1' ' A' ' 31' ' ' PHE . 1.0 OUTLIER . . . . . 0 N--CA 1.492 1.645 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.57 ' CD2' ' NE2' ' A' ' 36' ' ' GLN . 69.1 m-85 . . . . . 0 N--CA 1.489 1.495 0 O-C-N 121.131 -0.981 . . . . 0.0 111.413 -179.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.553 ' CB ' ' HG2' ' A' ' 36' ' ' GLN . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 121.085 0.469 . . . . 0.0 110.974 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.496 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 C--N 1.303 -1.424 0 N-CA-C 106.368 -1.716 . . . . 0.0 106.368 177.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.601 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.483 1.178 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.693 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -42.22 -59.6 1.74 Allowed 'General case' 0 N--CA 1.496 1.839 0 C-N-CA 117.63 -1.628 . . . . 0.0 106.694 178.46 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.575 ' O ' ' O ' ' A' ' 41' ' ' TRP . 0.7 OUTLIER . . . . . 0 C--N 1.297 -1.689 0 O-C-N 121.131 -0.981 . . . . 0.0 109.023 176.305 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.601 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 9.2 t80 . . . . . 0 N--CA 1.484 1.248 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.693 ' CD1' ' O ' ' A' ' 37' ' ' THR . 8.7 m95 -81.34 -177.56 6.54 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 176.355 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.475 ' OG ' ' N ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER 73.05 -71.62 0.13 Allowed 'General case' 0 N--CA 1.496 1.848 0 CA-C-O 121.934 0.873 . . . . 0.0 111.646 177.168 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.475 ' N ' ' OG ' ' A' ' 42' ' ' SER . 0.1 OUTLIER -87.48 18.75 3.67 Favored 'General case' 0 C--N 1.278 -2.543 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 -179.903 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.501 ' OH ' ' HB3' ' A' ' 48' ' ' ASP . 0.3 OUTLIER -81.03 31.78 0.32 Allowed 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 119.764 -0.775 . . . . 0.0 110.6 -179.977 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 8.0 pttm -91.0 19.57 5.56 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 120.993 -1.067 . . . . 0.0 108.474 179.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -103.7 3.82 34.67 Favored 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.51 ' O ' ' CB ' ' A' ' 48' ' ' ASP . . . 91.72 -71.98 1.72 Allowed Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.252 -1.539 . . . . 0.0 109.252 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.548 ' O ' ' N ' ' A' ' 50' ' ' CYS . 1.5 p-10 159.59 37.24 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.554 -0.968 . . . . 0.0 109.136 179.66 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.617 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 21.9 mp0 51.96 -86.87 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.449 -0.782 . . . . 0.0 110.043 178.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . 0.548 ' N ' ' O ' ' A' ' 48' ' ' ASP . 2.7 t -39.6 -26.24 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.342 -0.849 . . . . 0.0 109.867 179.717 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.507 ' N ' ' O ' ' A' ' 49' ' ' GLN . 1.1 tt0 -53.64 134.77 41.45 Favored 'General case' 0 N--CA 1.484 1.254 0 O-C-N 120.562 -1.336 . . . . 0.0 108.466 179.522 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.464 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . 103.28 -14.07 54.94 Favored Glycine 0 N--CA 1.495 2.614 0 O-C-N 120.732 -1.23 . . . . 0.0 110.12 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.564 ' CE1' ' O ' ' A' ' 55' ' ' CYS . 0.9 OUTLIER 70.55 61.58 0.48 Allowed Pre-proline 0 N--CA 1.493 1.717 0 O-C-N 121.123 -1.222 . . . . 0.0 109.825 179.912 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.545 ' CB ' ' CE2' ' A' ' 68' ' ' TYR . 3.4 Cg_exo -58.83 -44.9 32.27 Favored 'Trans proline' 0 C--N 1.309 -1.502 0 C-N-CA 122.544 2.162 . . . . 0.0 111.205 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.564 ' O ' ' CE1' ' A' ' 53' ' ' HIS . 0.8 OUTLIER -85.52 165.12 17.37 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.235 -0.916 . . . . 0.0 109.447 -179.114 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.492 ' O ' ' HB2' ' A' ' 81' ' ' CYS . 5.9 mt -149.66 -173.93 4.55 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 120.99 -1.069 . . . . 0.0 110.739 -179.369 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.61 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 1.1 m120 43.77 63.46 1.58 Allowed 'General case' 0 C--N 1.3 -1.561 0 CA-C-O 121.812 0.815 . . . . 0.0 109.414 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.44 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 0.2 OUTLIER 53.93 29.19 9.56 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.641 -0.662 . . . . 0.0 110.19 177.618 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -84.32 145.65 22.28 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.38 -1.488 . . . . 0.0 109.38 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.467 ' O ' ' SG ' ' A' ' 55' ' ' CYS . 1.7 t-160 -79.05 173.23 12.78 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.047 -1.266 . . . . 0.0 108.094 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.459 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 13.5 t -140.65 105.74 5.0 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.83 -1.169 . . . . 0.0 110.922 -179.137 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.511 ' O ' ' HB2' ' A' ' 68' ' ' TYR . 3.2 mtmm . . . . . 0 C--N 1.296 -1.73 0 N-CA-C 106.072 -1.825 . . . . 0.0 106.072 177.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.559 ' O ' ' O ' ' A' ' 65' ' ' ILE . . . . . . . . 0 N--CA 1.492 2.418 0 N-CA-C 110.444 -1.062 . . . . 0.0 110.444 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.565 ' CG2' ' N ' ' A' ' 66' ' ' GLY . 0.0 OUTLIER 45.36 173.9 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.128 0 O-C-N 121.532 -0.981 . . . . 0.0 110.673 179.742 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . 0.565 ' N ' ' CG2' ' A' ' 65' ' ' ILE . . . 58.96 -80.99 0.01 OUTLIER Glycine 0 N--CA 1.496 2.671 0 N-CA-C 108.98 -1.648 . . . . 0.0 108.98 -179.135 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.572 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 5.5 p-10 -135.29 -162.57 1.28 Allowed 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 178.378 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.688 ' N ' ' CD1' ' A' ' 68' ' ' TYR . 4.5 p90 -150.76 -159.15 0.99 Allowed 'General case' 0 C--N 1.292 -1.915 0 O-C-N 120.904 -1.122 . . . . 0.0 109.709 -177.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -149.7 171.04 17.34 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 178.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 52.8 m -140.48 -169.1 2.7 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 120.847 -1.158 . . . . 0.0 108.726 179.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -160.46 124.68 3.64 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.538 -0.726 . . . . 0.0 109.318 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.477 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 66.9 m -100.93 142.05 32.95 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.038 -1.038 . . . . 0.0 109.518 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.597 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . . . -73.49 -176.35 2.26 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.189 -0.945 . . . . 0.0 110.678 -179.639 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -81.23 102.44 10.35 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 123.139 1.447 . . . . 0.0 107.983 178.202 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . 0.462 ' HA2' ' OG1' ' A' ' 85' ' ' THR . . . 121.28 21.43 3.08 Favored Glycine 0 C--N 1.267 -3.293 0 N-CA-C 109.09 -1.604 . . . . 0.0 109.09 -179.048 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.61 ' CE2' ' O ' ' A' ' 57' ' ' ASN . 6.0 m-85 -119.58 163.77 16.84 Favored 'General case' 0 C--N 1.294 -1.806 0 O-C-N 121.447 -1.031 . . . . 0.0 109.586 -178.369 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.496 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 1.8 mm-40 -157.21 174.41 15.51 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.956 -1.09 . . . . 0.0 110.317 -179.599 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.39 163.6 38.66 Favored Glycine 0 N--CA 1.489 2.198 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.44 -34.04 73.4 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.299 -1.118 . . . . 0.0 109.532 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.503 ' HB3' ' O ' ' A' ' 54' ' ' PRO . 0.1 OUTLIER -112.34 26.92 10.1 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 179.929 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . 0.496 ' HA ' ' O ' ' A' ' 77' ' ' GLU . 3.0 m 63.22 12.06 5.82 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 120.804 -1.185 . . . . 0.0 108.516 -179.03 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -47.88 -43.57 28.69 Favored 'General case' 0 C--N 1.308 -1.198 0 O-C-N 121.585 -0.697 . . . . 0.0 111.462 -179.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.565 ' N ' ' CD1' ' A' ' 83' ' ' PHE . 0.8 OUTLIER -81.8 83.49 7.14 Favored 'General case' 0 C--N 1.297 -1.702 0 O-C-N 121.294 -0.879 . . . . 0.0 110.585 -178.838 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.474 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 89.7 p -65.0 94.62 0.14 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.152 -0.967 . . . . 0.0 108.586 178.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.462 ' OG1' ' HA2' ' A' ' 75' ' ' GLY . 12.0 p -58.84 -17.01 20.02 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.337 -0.852 . . . . 0.0 110.099 -179.163 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.498 ' NH1' ' HG2' ' A' ' 86' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.291 -1.969 0 CA-C-O 117.964 -1.017 . . . . 0.0 109.525 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.534 ' O ' ' SG ' ' A' ' 17' ' ' CYS . 28.7 t . . . . . 0 N--CA 1.494 1.773 0 CA-C-O 121.573 0.701 . . . . 0.0 109.51 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.517 ' CD1' ' OE1' ' A' ' 51' ' ' GLU . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.663 0 O-C-N 120.76 -1.212 . . . . 0.0 110.426 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 121.249 0.547 . . . . 0.0 109.606 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.563 ' O ' ' CB ' ' A' ' 23' ' ' SER . 12.8 t -111.4 -126.46 0.28 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.207 -0.933 . . . . 0.0 109.83 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.563 ' CB ' ' O ' ' A' ' 22' ' ' CYS . 1.9 t 153.86 -23.23 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.007 -1.058 . . . . 0.0 108.164 -179.682 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.519 ' CB ' ' O ' ' A' ' 23' ' ' SER . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.688 0 O-C-N 121.834 -0.541 . . . . 0.0 109.837 -179.801 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.695 ' O ' ' CE1' ' A' ' 31' ' ' PHE . . . . . . . . 0 N--CA 1.493 1.724 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.528 ' NH1' ' HG3' ' A' ' 28' ' ' ARG . 0.8 OUTLIER . . . . . 0 C--N 1.297 -1.681 0 O-C-N 120.575 -1.328 . . . . 0.0 110.85 -179.792 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.424 ' HB ' ' CD1' ' A' ' 31' ' ' PHE . 79.7 t . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 120.877 0.37 . . . . 0.0 110.072 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.695 ' CE1' ' O ' ' A' ' 27' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.494 1.773 0 O-C-N 120.792 -1.192 . . . . 0.0 111.516 -179.459 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.494 ' HB3' ' HG2' ' A' ' 36' ' ' GLN . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.488 0 CA-C-O 121.578 0.704 . . . . 0.0 111.234 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.523 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 N--CA 1.489 1.522 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 179.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.729 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.198 -1.634 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.684 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -38.91 -57.71 1.2 Allowed 'General case' 0 N--CA 1.502 2.129 0 O-C-N 119.656 -1.903 . . . . 0.0 107.79 178.414 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.489 ' O ' ' N ' ' A' ' 41' ' ' TRP . 1.8 t70 . . . . . 0 C--N 1.295 -1.784 0 O-C-N 121.154 -0.966 . . . . 0.0 109.898 176.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.729 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 21.5 t80 . . . . . 0 N--CA 1.491 1.587 0 N-CA-C 107.294 -1.372 . . . . 0.0 107.294 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.684 ' CD1' ' O ' ' A' ' 37' ' ' THR . 11.3 m95 -80.65 -177.03 6.09 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 177.36 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.631 ' O ' ' CB ' ' A' ' 43' ' ' LYS . 0.4 OUTLIER 35.22 81.83 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.125 0 O-C-N 121.46 -0.775 . . . . 0.0 110.055 179.213 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.631 ' CB ' ' O ' ' A' ' 42' ' ' SER . 18.2 tptt 133.86 -26.0 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 105.708 -1.96 . . . . 0.0 105.708 -178.365 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.635 ' O ' ' N ' ' A' ' 46' ' ' ASP . 0.9 OUTLIER -46.55 -71.01 0.08 Allowed 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 115.263 -0.881 . . . . 0.0 108.66 179.035 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.544 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.1 OUTLIER -1.11 64.73 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.68 0 CA-C-O 121.459 0.647 . . . . 0.0 112.054 179.663 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.635 ' N ' ' O ' ' A' ' 44' ' ' TYR . 5.3 t0 -161.38 23.48 0.13 Allowed 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 -179.613 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.59 ' O ' ' HB3' ' A' ' 48' ' ' ASP . . . 82.78 -74.56 2.5 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 107.714 -2.154 . . . . 0.0 107.714 -178.058 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.59 ' HB3' ' O ' ' A' ' 47' ' ' GLY . 0.0 OUTLIER 168.25 13.58 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.02 0 O-C-N 122.239 -0.565 . . . . 0.0 109.75 178.129 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.579 ' HB2' ' O ' ' A' ' 48' ' ' ASP . 22.8 mp0 73.31 -27.27 0.19 Allowed 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.558 -0.714 . . . . 0.0 111.845 178.723 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 10.8 t -124.35 2.97 8.46 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 120.522 -1.361 . . . . 0.0 109.691 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.522 ' N ' ' OD2' ' A' ' 48' ' ' ASP . 10.7 tt0 -57.62 -47.63 81.66 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.824 -1.172 . . . . 0.0 110.878 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -67.38 -0.34 10.94 Favored Glycine 0 N--CA 1.496 2.677 0 O-C-N 120.987 -1.07 . . . . 0.0 111.658 -178.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.527 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 2.2 t60 57.44 61.67 6.03 Favored Pre-proline 0 N--CA 1.492 1.657 0 O-C-N 120.656 -1.496 . . . . 0.0 109.105 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.527 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 1.3 Cg_endo -64.6 -45.77 8.3 Favored 'Trans proline' 0 C--N 1.31 -1.487 0 C-N-CA 122.561 2.174 . . . . 0.0 111.911 -178.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.47 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 2.1 m -63.73 161.12 15.7 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 120.901 -1.124 . . . . 0.0 109.378 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.477 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 4.9 mt -144.0 -174.94 4.41 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.141 -0.975 . . . . 0.0 109.927 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.61 ' O ' ' CD2' ' A' ' 76' ' ' PHE . 5.4 m-80 41.52 63.98 1.15 Allowed 'General case' 0 C--N 1.3 -1.551 0 CA-C-O 121.886 0.85 . . . . 0.0 109.56 -179.263 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.454 ' HG3' ' C ' ' A' ' 57' ' ' ASN . 4.3 mt-30 47.44 35.98 4.62 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.333 -0.854 . . . . 0.0 109.075 178.13 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -79.57 142.44 24.75 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.636 -1.386 . . . . 0.0 109.636 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.484 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 10.9 m170 -79.57 137.93 37.3 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.32 -1.106 . . . . 0.0 108.562 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.47 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 27.6 t -107.96 122.11 46.15 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.152 -0.967 . . . . 0.0 110.302 -179.026 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.48 ' HB2' ' OG1' ' A' ' 69' ' ' THR . 32.2 mmtt . . . . . 0 C--N 1.304 -1.382 0 N-CA-C 105.617 -1.994 . . . . 0.0 105.617 177.237 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.519 ' O ' ' OE1' ' A' ' 49' ' ' GLN . . . . . . . . 0 N--CA 1.488 2.134 0 N-CA-C 106.457 -2.657 . . . . 0.0 106.457 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.539 ' CG2' ' HG3' ' A' ' 43' ' ' LYS . 6.2 mm -98.6 -72.77 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 120.273 -1.722 . . . . 0.0 110.222 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . 0.464 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . -42.54 -26.56 0.41 Allowed Glycine 0 N--CA 1.491 2.339 0 C-N-CA 119.553 -1.308 . . . . 0.0 110.263 -178.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.464 ' HB3' ' O ' ' A' ' 66' ' ' GLY . 2.3 p-10 179.93 -154.11 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.021 -1.282 . . . . 0.0 110.44 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.664 ' N ' ' CD1' ' A' ' 68' ' ' TYR . 4.2 p90 -160.46 130.22 5.14 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 -178.328 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.48 ' OG1' ' HB2' ' A' ' 62' ' ' LYS . 43.5 p -98.79 117.15 32.61 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 120.71 -1.244 . . . . 0.0 109.333 -179.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 33.5 m -79.27 -169.24 1.79 Allowed 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.01 -1.056 . . . . 0.0 108.659 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.484 ' HB ' ' HB2' ' A' ' 60' ' ' HIS . 0.2 OUTLIER -160.48 149.82 17.34 Favored 'General case' 0 C--N 1.286 -2.159 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 179.94 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.528 ' HB3' ' CB ' ' A' ' 76' ' ' PHE . 92.8 m -114.06 118.39 33.94 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.146 -0.971 . . . . 0.0 108.945 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.603 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . . . -48.26 -176.57 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.023 -1.048 . . . . 0.0 110.812 -179.223 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -80.29 101.85 9.17 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 123.278 1.513 . . . . 0.0 107.555 178.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . 0.501 ' HA2' ' HG3' ' A' ' 86' ' ' ARG . . . 118.3 20.44 4.36 Favored Glycine 0 C--N 1.268 -3.232 0 N-CA-C 108.91 -1.676 . . . . 0.0 108.91 -178.533 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.61 ' CD2' ' O ' ' A' ' 57' ' ' ASN . 9.2 m-85 -119.55 156.04 31.06 Favored 'General case' 0 C--N 1.294 -1.827 0 O-C-N 121.621 -0.929 . . . . 0.0 109.462 -178.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.505 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 5.5 mm-40 -160.69 161.18 32.23 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.058 -1.026 . . . . 0.0 110.84 -179.33 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 109.97 169.7 19.96 Favored Glycine 0 N--CA 1.493 2.443 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.87 -58.87 5.2 Favored 'General case' 0 C--N 1.306 -1.324 0 O-C-N 121.094 -1.239 . . . . 0.0 109.033 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.477 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 19.2 m-20 -104.98 29.44 6.32 Favored 'General case' 0 C--N 1.289 -2.043 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 178.582 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 77' ' ' GLU . 6.4 m 68.51 16.6 9.13 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.141 -0.975 . . . . 0.0 108.716 -179.306 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.443 ' C ' ' O ' ' A' ' 81' ' ' CYS . 83.2 tt0 -34.9 -32.92 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.328 0 O-C-N 121.739 -0.601 . . . . 0.0 111.763 -179.393 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.52 ' N ' ' CD1' ' A' ' 83' ' ' PHE . 0.3 OUTLIER -104.35 -161.72 0.84 Allowed 'General case' 0 C--N 1.295 -1.786 0 CA-C-O 122.719 1.247 . . . . 0.0 109.379 -179.778 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.402 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 33.1 m -157.31 95.19 1.45 Allowed 'General case' 0 C--N 1.277 -2.583 0 CA-C-N 114.471 -1.241 . . . . 0.0 108.903 179.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.461 ' OG1' ' HA2' ' A' ' 75' ' ' GLY . 31.1 p -50.62 -35.7 31.67 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.321 -0.862 . . . . 0.0 110.234 -179.18 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.501 ' HG3' ' HA2' ' A' ' 75' ' ' GLY . 0.0 OUTLIER . . . . . 0 C--N 1.287 -2.144 0 CA-C-O 118.007 -0.996 . . . . 0.0 109.16 179.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 84.7 m . . . . . 0 N--CA 1.5 2.059 0 CA-C-O 121.718 0.77 . . . . 0.0 109.546 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.495 1.796 0 CA-C-O 121.491 0.662 . . . . 0.0 111.154 -178.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.419 ' C ' ' SG ' ' A' ' 22' ' ' CYS . . . . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 121.799 0.809 . . . . 0.0 109.544 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.419 ' SG ' ' C ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -152.22 -170.7 3.72 Favored 'General case' 0 C--N 1.29 -2.011 0 CA-C-O 121.52 0.676 . . . . 0.0 109.683 -179.816 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.555 ' O ' ' HB2' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -102.34 24.55 10.12 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.913 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.555 ' HB2' ' O ' ' A' ' 23' ' ' SER . 2.6 mm? . . . . . 0 N--CA 1.498 1.932 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.657 -179.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.404 ' HA ' HG13 ' A' ' 30' ' ' VAL . . . . . . . . 0 N--CA 1.494 1.758 0 CA-C-O 120.973 0.416 . . . . 0.0 110.605 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 8.5 mtt180 . . . . . 0 N--CA 1.489 1.497 0 O-C-N 120.735 -1.228 . . . . 0.0 109.589 179.592 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.621 HG11 ' CD1' ' A' ' 31' ' ' PHE . 2.8 p . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 121.404 0.621 . . . . 0.0 109.583 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.621 ' CD1' HG11 ' A' ' 30' ' ' VAL . 42.9 m-85 . . . . . 0 N--CA 1.493 1.684 0 O-C-N 121.38 -0.825 . . . . 0.0 109.491 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.502 ' HB2' ' HB2' ' A' ' 36' ' ' GLN . 23.0 m-20 . . . . . 0 C--O 1.191 -1.974 0 CA-C-O 120.422 0.154 . . . . 0.0 110.748 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.484 ' HA ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 N--CA 1.498 1.95 0 O-C-N 120.886 -1.134 . . . . 0.0 110.185 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.701 ' O ' ' HB3' ' A' ' 40' ' ' PHE . 42.6 mt-30 . . . . . 0 C--O 1.203 -1.359 0 N-CA-C 106.313 -1.736 . . . . 0.0 106.313 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.539 ' C ' ' O ' ' A' ' 36' ' ' GLN . 1.4 m -35.94 -59.9 0.57 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.309 -0.869 . . . . 0.0 108.814 178.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.423 ' O ' ' N ' ' A' ' 42' ' ' SER . 5.7 m-20 . . . . . 0 C--N 1.298 -1.664 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 177.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.701 ' HB3' ' O ' ' A' ' 36' ' ' GLN . 7.7 t80 . . . . . 0 C--O 1.202 -1.411 0 CA-C-O 121.412 0.625 . . . . 0.0 110.259 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.544 ' O ' ' HB3' ' A' ' 44' ' ' TYR . 26.4 t-105 -82.32 -72.59 0.43 Allowed 'General case' 0 C--N 1.294 -1.844 0 O-C-N 121.353 -0.842 . . . . 0.0 112.499 -176.911 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.482 ' O ' ' HG3' ' A' ' 45' ' ' LYS . 35.4 p -47.96 -63.53 1.04 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.64 -1.288 . . . . 0.0 110.632 -178.313 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.7 tttm -52.32 -21.71 3.81 Favored 'General case' 0 C--N 1.291 -1.973 0 O-C-N 121.384 -0.822 . . . . 0.0 108.925 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.687 ' HB2' ' O ' ' A' ' 40' ' ' PHE . 25.2 t80 -80.19 -96.16 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 178.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.536 ' HD3' ' CZ2' ' A' ' 41' ' ' TRP . 4.4 mtmt 33.37 34.56 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.13 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -179.433 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.57 ' N ' ' O ' ' A' ' 44' ' ' TYR . 1.4 t70 -131.39 -21.71 2.54 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.804 -176.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.511 ' HA2' ' OH ' ' A' ' 44' ' ' TYR . . . 49.06 60.12 6.36 Favored Glycine 0 N--CA 1.492 2.418 0 N-CA-C 105.845 -2.902 . . . . 0.0 105.845 -177.03 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.429 ' C ' ' OE1' ' A' ' 49' ' ' GLN . 27.1 t0 -126.41 -129.87 0.24 Allowed 'General case' 0 C--N 1.307 -1.268 0 O-C-N 121.546 -0.973 . . . . 0.0 110.658 -176.743 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.599 ' CD ' ' N ' ' A' ' 49' ' ' GLN . 8.4 mp0 57.3 -86.12 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.333 -0.854 . . . . 0.0 110.445 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . 0.549 ' HA ' ' CG ' ' A' ' 54' ' ' PRO . 4.6 t -98.2 -1.58 41.75 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.03 -1.044 . . . . 0.0 111.188 -178.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.459 ' O ' ' HG3' ' A' ' 51' ' ' GLU . 0.6 OUTLIER -55.47 -26.01 39.95 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 120.961 -1.087 . . . . 0.0 111.527 -179.078 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.434 ' O ' ' C ' ' A' ' 53' ' ' HIS . . . -86.13 28.22 5.22 Favored Glycine 0 N--CA 1.494 2.506 0 O-C-N 120.545 -1.347 . . . . 0.0 110.921 -178.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.582 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 3.4 t-160 41.68 53.2 7.24 Favored Pre-proline 0 N--CA 1.493 1.715 0 O-C-N 121.108 -1.231 . . . . 0.0 109.775 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.595 ' CB ' ' CE2' ' A' ' 68' ' ' TYR . 4.0 Cg_exo -56.77 -37.17 98.54 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 C-N-CA 122.562 2.175 . . . . 0.0 111.299 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.535 ' SG ' ' CB ' ' A' ' 61' ' ' CYS . 0.6 OUTLIER -89.43 168.29 12.32 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.371 -0.831 . . . . 0.0 110.19 -178.218 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.49 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.8 mt -146.13 -173.66 4.23 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 122.08 0.943 . . . . 0.0 110.562 -179.397 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.615 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 51.0 m-80 40.29 64.56 0.9 Allowed 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 122.038 0.923 . . . . 0.0 110.124 -179.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.441 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 2.2 mm-40 51.35 33.4 9.89 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-O 121.561 0.696 . . . . 0.0 109.835 177.393 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -81.41 127.3 7.84 Favored Glycine 0 N--CA 1.487 2.057 0 N-CA-C 109.174 -1.57 . . . . 0.0 109.174 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -78.97 168.01 20.3 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.115 -1.227 . . . . 0.0 107.951 179.402 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.54 ' HA ' ' HA ' ' A' ' 70' ' ' CYS . 0.5 OUTLIER -156.53 126.99 6.62 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 118.323 -1.351 . . . . 0.0 111.175 -178.878 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.8 mmtm . . . . . 0 N--CA 1.487 1.422 0 N-CA-C 106.944 -1.502 . . . . 0.0 106.944 177.638 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.538 ' O ' ' O ' ' A' ' 67' ' ' ASP . . . . . . . . 0 N--CA 1.489 2.232 0 N-CA-C 108.221 -1.952 . . . . 0.0 108.221 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.598 HG23 ' CA ' ' A' ' 44' ' ' TYR . 2.2 pp -38.0 160.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.504 2.253 0 CA-C-N 118.935 1.367 . . . . 0.0 110.13 -178.209 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . 0.53 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . 95.46 -47.55 1.92 Allowed Glycine 0 C--N 1.294 -1.759 0 N-CA-C 106.07 -2.812 . . . . 0.0 106.07 -177.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.538 ' O ' ' O ' ' A' ' 64' ' ' GLY . 14.7 p-10 169.69 -145.61 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 178.267 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.619 ' N ' ' CD1' ' A' ' 68' ' ' TYR . 4.1 p90 -160.53 -167.16 1.81 Allowed 'General case' 0 C--N 1.298 -1.646 0 O-C-N 120.691 -1.256 . . . . 0.0 108.926 -179.427 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.459 ' O ' ' HA ' ' A' ' 61' ' ' CYS . 0.1 OUTLIER -147.99 152.08 36.86 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 178.675 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 0.54 ' HA ' ' HA ' ' A' ' 61' ' ' CYS . 85.0 m -116.98 -170.16 1.78 Allowed 'General case' 0 C--N 1.302 -1.481 0 O-C-N 120.496 -1.378 . . . . 0.0 109.197 179.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 1.8 m -161.27 108.21 1.44 Allowed 'General case' 0 C--N 1.294 -1.829 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.486 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 89.2 m -80.16 138.29 36.86 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.96 -1.087 . . . . 0.0 109.213 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.593 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . . . -72.43 -174.4 1.34 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.074 -1.016 . . . . 0.0 111.25 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -81.57 102.36 10.57 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-O 123.035 1.398 . . . . 0.0 108.185 178.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 120.37 18.0 4.24 Favored Glycine 0 C--N 1.267 -3.294 0 N-CA-C 109.213 -1.555 . . . . 0.0 109.213 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.615 ' CE2' ' O ' ' A' ' 57' ' ' ASN . 4.2 m-85 -115.82 163.99 15.05 Favored 'General case' 0 C--N 1.294 -1.838 0 O-C-N 121.476 -1.014 . . . . 0.0 109.622 -178.38 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.467 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 1.9 tt0 -157.38 167.15 31.11 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.146 -0.971 . . . . 0.0 110.051 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 96.4 162.86 32.95 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.636 -1.386 . . . . 0.0 109.636 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 7.4 tptt -60.19 -33.74 72.64 Favored 'General case' 0 C--N 1.306 -1.306 0 O-C-N 121.249 -1.147 . . . . 0.0 109.727 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.49 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.2 OUTLIER -113.97 22.12 14.21 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.877 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . 0.532 ' O ' ' ND2' ' A' ' 57' ' ' ASN . 5.0 m 70.34 7.02 6.05 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.035 -1.041 . . . . 0.0 108.85 -179.236 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.525 ' HA ' ' ND2' ' A' ' 57' ' ' ASN . 56.3 tt0 -37.6 -47.19 0.92 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.573 -0.704 . . . . 0.0 111.305 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.579 ' N ' ' CD1' ' A' ' 83' ' ' PHE . 0.6 OUTLIER -82.96 83.63 7.74 Favored 'General case' 0 C--N 1.294 -1.811 0 O-C-N 121.136 -0.977 . . . . 0.0 110.55 -178.625 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.454 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 1.6 p -70.97 91.38 0.86 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.275 -0.891 . . . . 0.0 108.802 178.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 10.2 p -60.76 -14.97 24.72 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.311 -0.868 . . . . 0.0 110.014 -179.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.505 ' O ' ' CD ' ' A' ' 86' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.293 -1.852 0 CA-C-O 118.055 -0.974 . . . . 0.0 109.454 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.427 ' O ' ' N ' ' A' ' 23' ' ' SER . 7.6 p . . . . . 0 N--CA 1.505 2.278 0 CA-C-O 122.106 0.955 . . . . 0.0 111.108 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.439 HD22 ' OH ' ' A' ' 44' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.289 -2.05 0 CA-C-O 121.346 0.593 . . . . 0.0 109.552 -179.38 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.409 ' O ' ' CB ' ' A' ' 22' ' ' CYS . . . . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 121.375 0.607 . . . . 0.0 110.014 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.505 ' O ' ' CB ' ' A' ' 23' ' ' SER . 0.0 OUTLIER 172.11 -29.4 0.0 OUTLIER 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.402 -0.811 . . . . 0.0 109.442 179.884 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.505 ' CB ' ' O ' ' A' ' 22' ' ' CYS . 1.7 m 77.11 -76.26 0.05 Allowed 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 -178.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.484 ' CD1' ' O ' ' A' ' 24' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.586 0 O-C-N 121.216 -0.927 . . . . 0.0 108.829 179.189 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.465 ' HA ' HG13 ' A' ' 30' ' ' VAL . . . . . . . . 0 N--CA 1.5 2.041 0 CA-C-O 121.42 0.628 . . . . 0.0 109.565 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.423 ' NH1' ' CG ' ' A' ' 28' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.303 -1.442 0 CA-C-O 121.968 0.889 . . . . 0.0 110.831 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.586 HG11 ' CD2' ' A' ' 31' ' ' PHE . 0.4 OUTLIER . . . . . 0 N--CA 1.493 1.687 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.691 ' CZ ' ' CZ ' ' A' ' 40' ' ' PHE . 88.6 m-85 . . . . . 0 N--CA 1.494 1.765 0 O-C-N 121.227 -0.921 . . . . 0.0 110.243 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.556 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 121.334 0.588 . . . . 0.0 111.078 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.548 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 N--CA 1.491 1.605 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 179.062 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.616 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 55.2 mt-30 . . . . . 0 C--O 1.204 -1.323 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.704 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -42.19 -60.61 1.4 Allowed 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 117.759 -1.577 . . . . 0.0 107.172 178.499 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.521 ' O ' ' N ' ' A' ' 41' ' ' TRP . 0.3 OUTLIER . . . . . 0 C--N 1.296 -1.753 0 O-C-N 120.844 -1.16 . . . . 0.0 109.693 177.357 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.691 ' CZ ' ' CZ ' ' A' ' 31' ' ' PHE . 7.3 t80 . . . . . 0 N--CA 1.487 1.391 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.704 ' CD1' ' O ' ' A' ' 37' ' ' THR . 9.1 m95 -77.36 -63.73 1.31 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.309 -0.869 . . . . 0.0 112.185 -179.504 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.523 ' OG ' ' N ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -42.43 -70.06 0.12 Allowed 'General case' 0 N--CA 1.499 2.008 0 O-C-N 120.843 -1.161 . . . . 0.0 112.517 -177.556 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.523 ' N ' ' OG ' ' A' ' 42' ' ' SER . 0.1 OUTLIER -79.15 32.36 0.22 Allowed 'General case' 0 C--N 1.288 -2.081 0 O-C-N 121.482 -0.761 . . . . 0.0 110.543 -178.55 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.614 ' O ' ' CD1' ' A' ' 44' ' ' TYR . 1.0 OUTLIER -80.91 33.9 0.34 Allowed 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.126 -0.984 . . . . 0.0 110.414 179.7 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.14 37.99 1.21 Allowed 'General case' 0 C--N 1.302 -1.459 0 O-C-N 120.557 -1.339 . . . . 0.0 107.702 178.569 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -126.58 -1.1 6.81 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.724 -0.61 . . . . 0.0 109.912 -178.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.543 ' O ' ' CB ' ' A' ' 48' ' ' ASP . . . 71.64 6.71 63.36 Favored Glycine 0 N--CA 1.495 2.579 0 N-CA-C 109.179 -1.569 . . . . 0.0 109.179 -179.195 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.627 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER 85.62 5.32 0.48 Allowed 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.743 -0.857 . . . . 0.0 109.907 179.746 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.707 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 36.3 mm-40 82.37 -47.52 0.18 Allowed 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.819 -0.55 . . . . 0.0 111.723 178.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 11.2 t -83.04 -0.44 48.96 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.946 -1.096 . . . . 0.0 109.757 -179.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.493 ' OE1' ' CA ' ' A' ' 47' ' ' GLY . 47.3 tt0 -74.81 148.2 40.53 Favored 'General case' 0 N--CA 1.484 1.257 0 O-C-N 121.09 -1.007 . . . . 0.0 108.425 179.339 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 91.65 0.07 73.07 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.38 -1.488 . . . . 0.0 109.38 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.439 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 0.8 OUTLIER 54.41 63.3 7.5 Favored Pre-proline 0 C--N 1.307 -1.263 0 O-C-N 121.225 -1.162 . . . . 0.0 109.762 179.39 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.439 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 4.6 Cg_exo -56.88 -38.48 95.8 Favored 'Trans proline' 0 C--N 1.309 -1.506 0 C-N-CA 122.448 2.099 . . . . 0.0 110.325 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.483 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 0.3 OUTLIER -86.37 169.59 12.78 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.365 -0.835 . . . . 0.0 109.59 -179.714 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.497 ' O ' ' HB2' ' A' ' 81' ' ' CYS . 4.8 mt -147.13 -174.52 4.53 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.31 -0.869 . . . . 0.0 109.594 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.598 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 1.4 m-80 41.56 63.2 1.33 Allowed 'General case' 0 C--N 1.301 -1.531 0 CA-C-O 121.778 0.799 . . . . 0.0 109.824 -179.633 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.449 ' HG3' ' C ' ' A' ' 57' ' ' ASN . 1.8 mt-30 45.84 35.92 2.56 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.372 -0.83 . . . . 0.0 109.374 177.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -80.38 151.78 33.3 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -79.36 166.03 22.5 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.276 -1.132 . . . . 0.0 108.895 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.483 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 37.7 t -139.36 128.03 23.22 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.06 -1.025 . . . . 0.0 110.212 -179.515 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.49 ' HB2' ' OG1' ' A' ' 69' ' ' THR . 9.1 mmmt . . . . . 0 C--N 1.304 -1.373 0 N-CA-C 106.332 -1.729 . . . . 0.0 106.332 177.693 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.512 ' O ' ' O ' ' A' ' 67' ' ' ASP . . . . . . . . 0 N--CA 1.488 2.119 0 N-CA-C 107.688 -2.165 . . . . 0.0 107.688 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.521 HG21 ' N ' ' A' ' 66' ' ' GLY . 0.5 OUTLIER -46.15 -59.43 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.555 0 O-C-N 120.578 -1.542 . . . . 0.0 109.164 -179.128 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . 0.521 ' N ' HG21 ' A' ' 65' ' ' ILE . . . -44.64 -38.2 5.4 Favored Glycine 0 N--CA 1.493 2.448 0 N-CA-C 110.552 -1.019 . . . . 0.0 110.552 -178.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.512 ' O ' ' O ' ' A' ' 64' ' ' GLY . 9.0 p-10 177.59 -147.7 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.172 -1.193 . . . . 0.0 110.555 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.707 ' CD1' ' HB3' ' A' ' 49' ' ' GLN . 1.7 p90 -156.86 -170.89 3.45 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.924 -1.11 . . . . 0.0 109.741 -179.424 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.49 ' OG1' ' HB2' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -160.62 112.9 1.96 Allowed 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.296 -0.877 . . . . 0.0 109.815 -179.739 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 35.6 m -80.42 -171.09 2.86 Favored 'General case' 0 C--N 1.296 -1.758 0 O-C-N 120.976 -1.077 . . . . 0.0 110.107 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.444 ' O ' ' SG ' ' A' ' 81' ' ' CYS . 0.2 OUTLIER -160.67 166.97 27.91 Favored 'General case' 0 C--N 1.288 -2.086 0 CA-C-N 115.362 -0.836 . . . . 0.0 108.779 179.927 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.487 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 90.4 m -128.96 125.59 37.78 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.025 -1.047 . . . . 0.0 109.269 179.589 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.598 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . . . -51.0 179.95 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.017 -1.052 . . . . 0.0 110.552 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -80.95 102.27 10.02 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 123.119 1.437 . . . . 0.0 107.735 178.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . 0.485 ' CA ' ' OG1' ' A' ' 85' ' ' THR . . . 118.68 23.04 3.49 Favored Glycine 0 C--N 1.268 -3.218 0 N-CA-C 108.756 -1.738 . . . . 0.0 108.756 -178.516 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.598 ' CE1' ' HB2' ' A' ' 73' ' ' ALA . 8.7 m-85 -119.14 159.35 24.14 Favored 'General case' 0 C--N 1.294 -1.817 0 O-C-N 121.67 -0.9 . . . . 0.0 109.451 -178.167 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.469 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 0.2 OUTLIER -156.16 165.7 35.63 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 120.879 -1.138 . . . . 0.0 110.59 -179.06 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 101.77 165.52 27.12 Favored Glycine 0 N--CA 1.493 2.47 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -58.01 -39.51 78.48 Favored 'General case' 0 C--N 1.307 -1.263 0 O-C-N 121.13 -1.218 . . . . 0.0 109.404 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.478 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 3.8 m-20 -113.56 24.42 12.2 Favored 'General case' 0 C--N 1.291 -1.946 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 179.577 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . 0.497 ' HB2' ' O ' ' A' ' 56' ' ' LEU . 4.6 m 71.14 6.1 5.71 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 120.985 -1.072 . . . . 0.0 109.305 -179.848 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.462 ' C ' ' O ' ' A' ' 81' ' ' CYS . 15.0 tt0 -33.15 -46.81 0.17 Allowed 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.341 0.591 . . . . 0.0 111.579 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.613 ' N ' ' CD1' ' A' ' 83' ' ' PHE . 0.2 OUTLIER -88.16 89.63 8.07 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.472 -0.767 . . . . 0.0 110.576 -178.517 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.486 ' N ' ' OD1' ' A' ' 57' ' ' ASN . 3.8 p -70.58 92.64 0.86 Allowed 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 178.588 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.485 ' OG1' ' CA ' ' A' ' 75' ' ' GLY . 16.6 p -42.87 -28.87 0.28 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.246 -0.909 . . . . 0.0 110.242 -178.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.593 ' CB ' ' CZ ' ' A' ' 86' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.289 -2.025 0 CA-C-O 118.029 -0.986 . . . . 0.0 109.526 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.488 ' O ' ' HB2' ' A' ' 18' ' ' LEU . 5.7 m . . . . . 0 N--CA 1.497 1.877 0 CA-C-O 121.155 0.503 . . . . 0.0 109.822 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.538 HD12 ' CZ ' ' A' ' 40' ' ' PHE . 2.5 mm? . . . . . 0 N--CA 1.489 1.508 0 CA-C-O 121.873 0.844 . . . . 0.0 110.254 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.434 ' O ' ' CB ' ' A' ' 22' ' ' CYS . . . . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 121.587 0.708 . . . . 0.0 109.351 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.434 ' CB ' ' O ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER 172.63 -22.76 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.705 0 O-C-N 121.612 -0.68 . . . . 0.0 109.465 179.703 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.455 ' O ' ' HB1' ' A' ' 27' ' ' ALA . 5.9 p 53.81 -147.04 0.51 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.004 -1.06 . . . . 0.0 110.23 179.052 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.614 ' HG ' ' CZ2' ' A' ' 41' ' ' TRP . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.546 0 O-C-N 121.389 -0.82 . . . . 0.0 110.063 -179.669 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.58 ' O ' ' CD1' ' A' ' 31' ' ' PHE . . . . . . . . 0 N--CA 1.493 1.709 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.496 1.862 0 O-C-N 120.672 -1.268 . . . . 0.0 111.008 -179.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.577 HG11 ' CD1' ' A' ' 31' ' ' PHE . 1.2 t . . . . . 0 N--CA 1.494 1.775 0 CA-C-O 121.262 0.554 . . . . 0.0 109.678 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.58 ' CD1' ' O ' ' A' ' 27' ' ' ALA . 7.4 m-85 . . . . . 0 C--N 1.295 -1.771 0 O-C-N 121.1 -1.0 . . . . 0.0 113.32 -177.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.495 ' O ' ' OG1' ' A' ' 37' ' ' THR . 69.7 m-20 . . . . . 0 N--CA 1.483 1.215 0 CA-C-O 121.093 0.473 . . . . 0.0 111.325 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.513 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 C--N 1.305 -1.357 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 177.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.672 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 22.4 mm-40 . . . . . 0 C--O 1.202 -1.427 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.66 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -47.14 -60.23 2.61 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 119.506 -1.996 . . . . 0.0 107.082 177.76 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.43 ' O ' ' N ' ' A' ' 41' ' ' TRP . 0.5 OUTLIER . . . . . 0 N--CA 1.493 1.693 0 O-C-N 121.331 -0.856 . . . . 0.0 109.655 177.336 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.672 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 19.8 t80 . . . . . 0 N--CA 1.493 1.714 0 N-CA-C 107.259 -1.386 . . . . 0.0 107.259 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.66 ' CD1' ' O ' ' A' ' 37' ' ' THR . 7.9 m95 -80.73 178.61 8.26 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 177.419 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.523 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 23.2 t 63.63 105.31 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.821 -1.175 . . . . 0.0 110.757 179.092 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.528 ' HG3' ' CG2' ' A' ' 65' ' ' ILE . 0.0 OUTLIER 79.21 14.17 1.1 Allowed 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.667 0.746 . . . . 0.0 108.988 179.514 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.545 ' CG ' HD13 ' A' ' 65' ' ' ILE . 1.1 t80 -81.38 34.14 0.37 Allowed 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.417 -0.802 . . . . 0.0 110.208 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 2.1 mmmt -92.72 32.81 1.19 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 120.932 -1.105 . . . . 0.0 109.217 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -116.33 3.39 13.34 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.329 -0.857 . . . . 0.0 109.539 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.575 ' O ' ' CB ' ' A' ' 48' ' ' ASP . . . 88.4 -40.04 3.09 Favored Glycine 0 N--CA 1.494 2.547 0 N-CA-C 108.937 -1.665 . . . . 0.0 108.937 -179.418 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.575 ' CB ' ' O ' ' A' ' 47' ' ' GLY . 5.5 p30 152.04 15.83 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.036 0 O-C-N 122.11 -0.641 . . . . 0.0 110.027 179.184 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.565 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 68.2 mm-40 69.72 -11.39 0.53 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.229 -0.919 . . . . 0.0 111.1 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . 0.456 ' SG ' ' HD2' ' A' ' 54' ' ' PRO . 49.3 t -135.26 10.69 3.52 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 120.749 -1.22 . . . . 0.0 109.729 179.123 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.484 ' HB2' ' OD1' ' A' ' 48' ' ' ASP . 3.2 tt0 -58.58 -53.14 61.69 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.834 -1.166 . . . . 0.0 110.199 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.468 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . -68.37 -3.81 34.09 Favored Glycine 0 N--CA 1.492 2.426 0 C-N-CA 120.257 -0.973 . . . . 0.0 110.776 -179.043 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.468 ' HB3' ' O ' ' A' ' 52' ' ' GLY . 5.2 t-160 68.32 70.18 0.43 Allowed Pre-proline 0 N--CA 1.492 1.657 0 O-C-N 120.942 -1.328 . . . . 0.0 109.363 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.495 ' CB ' ' CE2' ' A' ' 68' ' ' TYR . 5.8 Cg_exo -60.29 -38.25 76.74 Favored 'Trans proline' 0 C--N 1.308 -1.568 0 C-N-CA 122.599 2.199 . . . . 0.0 111.35 -179.701 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.495 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 1.8 m -78.07 172.52 13.39 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.217 -0.927 . . . . 0.0 109.891 -178.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.504 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.5 mt -149.47 -173.41 4.39 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.061 -1.024 . . . . 0.0 110.373 -179.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.597 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 2.1 m-80 41.79 63.55 1.28 Allowed 'General case' 0 C--N 1.303 -1.452 0 CA-C-O 121.855 0.836 . . . . 0.0 110.132 -179.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 47.98 33.53 3.49 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.376 -0.828 . . . . 0.0 109.856 177.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -78.74 143.67 26.95 Favored Glycine 0 N--CA 1.488 2.105 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.477 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 68.6 m80 -78.84 123.33 27.11 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 179.037 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.495 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 41.2 t -101.12 113.46 26.51 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.187 -0.946 . . . . 0.0 111.507 -177.635 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.48 ' HB3' ' OG1' ' A' ' 69' ' ' THR . 0.1 OUTLIER . . . . . 0 C--N 1.301 -1.534 0 N-CA-C 105.955 -1.869 . . . . 0.0 105.955 176.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.528 ' O ' ' CG ' ' A' ' 49' ' ' GLN . . . . . . . . 0 N--CA 1.488 2.103 0 N-CA-C 107.479 -2.249 . . . . 0.0 107.479 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.574 ' CG1' ' HA ' ' A' ' 40' ' ' PHE . 19.3 mm -93.63 -61.6 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 120.609 -1.524 . . . . 0.0 109.8 -179.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . 0.492 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . -47.63 -25.0 3.08 Favored Glycine 0 N--CA 1.488 2.111 0 N-CA-C 108.645 -1.782 . . . . 0.0 108.645 179.446 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.492 ' HB3' ' O ' ' A' ' 66' ' ' GLY . 3.3 p-10 176.78 -149.36 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.645 -0.915 . . . . 0.0 109.69 179.255 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.641 ' N ' ' CD1' ' A' ' 68' ' ' TYR . 4.3 p90 -160.31 -167.09 1.82 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.37 -0.831 . . . . 0.0 109.248 -179.065 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.48 ' OG1' ' HB3' ' A' ' 62' ' ' LYS . 0.1 OUTLIER -144.96 171.63 14.18 Favored 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 178.651 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 20.6 m -136.27 -174.5 3.7 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 120.843 -1.161 . . . . 0.0 108.313 179.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.477 ' HB ' ' HB2' ' A' ' 60' ' ' HIS . 0.2 OUTLIER -160.54 150.85 18.1 Favored 'General case' 0 C--N 1.292 -1.909 0 O-C-N 121.518 -0.739 . . . . 0.0 109.249 179.478 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.497 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 88.3 m -120.95 124.86 45.94 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.114 -0.991 . . . . 0.0 109.133 179.712 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.595 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . . . -57.13 -179.81 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.019 -1.051 . . . . 0.0 111.103 -179.27 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.26 100.97 6.04 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 123.425 1.583 . . . . 0.0 108.702 178.633 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . 0.478 ' HA2' ' OG1' ' A' ' 85' ' ' THR . . . 119.5 20.42 3.91 Favored Glycine 0 C--N 1.266 -3.309 0 CA-C-N 113.21 -1.814 . . . . 0.0 108.834 -178.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.597 ' CE2' ' O ' ' A' ' 57' ' ' ASN . 6.5 m-85 -117.51 158.03 25.26 Favored 'General case' 0 C--N 1.296 -1.749 0 O-C-N 121.61 -0.935 . . . . 0.0 109.89 -178.036 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.54 ' CG ' HG21 ' A' ' 85' ' ' THR . 0.9 OUTLIER -160.08 163.33 33.97 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.18 -0.95 . . . . 0.0 110.487 -179.505 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 108.23 166.33 21.24 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.14 -39.42 72.24 Favored 'General case' 0 C--N 1.308 -1.216 0 O-C-N 121.167 -1.196 . . . . 0.0 109.17 179.716 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.504 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 70.8 m-20 -119.03 29.5 7.66 Favored 'General case' 0 C--N 1.292 -1.933 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 179.315 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . 0.504 ' O ' ' HB2' ' A' ' 57' ' ' ASN . 6.8 m 68.41 10.73 8.03 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.035 -1.041 . . . . 0.0 108.575 -179.13 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.461 ' C ' ' O ' ' A' ' 81' ' ' CYS . 22.1 tt0 -29.47 -45.45 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 121.186 0.517 . . . . 0.0 112.232 -179.543 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.474 ' HB2' ' HG3' ' A' ' 77' ' ' GLU . 0.4 OUTLIER -101.41 -161.06 0.83 Allowed 'General case' 0 C--N 1.294 -1.832 0 CA-C-O 122.84 1.305 . . . . 0.0 109.834 -178.895 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 1.5 p -147.94 115.04 6.16 Favored 'General case' 0 C--N 1.278 -2.518 0 CA-C-N 114.23 -1.35 . . . . 0.0 108.877 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.54 HG21 ' CG ' ' A' ' 77' ' ' GLU . 18.2 p -63.44 -18.24 63.54 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.128 -0.983 . . . . 0.0 109.729 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.1 ptt180 . . . . . 0 C--N 1.293 -1.87 0 CA-C-O 118.01 -0.995 . . . . 0.0 109.504 -179.987 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.538 ' CB ' ' O ' ' A' ' 23' ' ' SER . 1.7 m . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 121.375 0.607 . . . . 0.0 110.194 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.54 ' CD1' ' O ' ' A' ' 18' ' ' LEU . 2.8 tm? . . . . . 0 C--N 1.298 -1.667 0 CA-C-O 121.943 0.878 . . . . 0.0 108.709 178.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 121.059 0.457 . . . . 0.0 109.918 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.533 ' HB3' ' HA ' ' A' ' 17' ' ' CYS . 7.0 t 179.33 158.87 0.64 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.116 -0.99 . . . . 0.0 109.259 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.538 ' O ' ' CB ' ' A' ' 17' ' ' CYS . 3.1 m -99.62 -161.5 0.88 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.964 -1.085 . . . . 0.0 110.721 -178.461 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.583 HD11 ' CH2' ' A' ' 41' ' ' TRP . 3.9 mm? . . . . . 0 N--CA 1.488 1.463 0 O-C-N 121.541 -0.724 . . . . 0.0 109.5 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.652 ' O ' ' CE1' ' A' ' 31' ' ' PHE . . . . . . . . 0 N--CA 1.492 1.657 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.439 ' NH1' ' HG3' ' A' ' 28' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.691 0 O-C-N 120.658 -1.277 . . . . 0.0 109.752 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 53.3 t . . . . . 0 N--CA 1.488 1.434 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.652 ' CE1' ' O ' ' A' ' 27' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.57 0 O-C-N 120.848 -1.158 . . . . 0.0 110.38 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.544 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 0.8 OUTLIER . . . . . 0 N--CA 1.482 1.159 0 CA-C-O 121.067 0.46 . . . . 0.0 110.442 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.536 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 N--CA 1.491 1.603 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.683 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 3.4 mm100 . . . . . 0 C--O 1.203 -1.37 0 N-CA-C 107.834 -1.173 . . . . 0.0 107.834 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.688 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -40.28 -59.82 1.21 Allowed 'General case' 0 N--CA 1.502 2.133 0 O-C-N 120.203 -1.561 . . . . 0.0 107.787 178.812 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.453 ' O ' ' N ' ' A' ' 41' ' ' TRP . 0.5 OUTLIER . . . . . 0 C--N 1.297 -1.714 0 O-C-N 120.969 -1.082 . . . . 0.0 109.46 177.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.683 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 14.9 t80 . . . . . 0 C--O 1.203 -1.386 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.688 ' CD1' ' O ' ' A' ' 37' ' ' THR . 10.2 m95 -81.22 -68.78 0.66 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.933 -1.104 . . . . 0.0 112.427 -179.156 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.527 ' O ' ' CG ' ' A' ' 45' ' ' LYS . 0.3 OUTLIER -49.16 -53.25 21.94 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.65 -1.281 . . . . 0.0 111.476 -177.377 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.506 ' HG2' ' HB ' ' A' ' 65' ' ' ILE . 0.4 OUTLIER -62.74 -27.35 69.21 Favored 'General case' 0 C--N 1.283 -2.3 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 179.793 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.601 ' CA ' HG22 ' A' ' 65' ' ' ILE . 25.4 t80 -81.35 -95.63 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.381 0 O-C-N 121.425 -0.797 . . . . 0.0 108.857 179.368 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.556 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.0 OUTLIER 29.32 38.2 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.365 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 -178.782 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.601 ' N ' ' O ' ' A' ' 44' ' ' TYR . 19.7 t0 -127.91 -18.89 4.13 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.672 -176.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.472 ' HA2' ' OH ' ' A' ' 44' ' ' TYR . . . 49.73 49.36 34.52 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 105.897 -2.881 . . . . 0.0 105.897 -177.338 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.502 ' O ' ' C ' ' A' ' 49' ' ' GLN . 15.1 t0 -117.31 -138.18 0.36 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 122.089 -0.653 . . . . 0.0 110.625 -177.245 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.64 ' O ' ' CB ' ' A' ' 50' ' ' CYS . 7.3 mt-30 24.0 80.15 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.893 0 CA-C-O 121.617 0.722 . . . . 0.0 111.487 -179.654 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . 0.64 ' CB ' ' O ' ' A' ' 49' ' ' GLN . 50.5 t 112.8 -30.59 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 115.279 -0.873 . . . . 0.0 108.863 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.457 ' CB ' ' O ' ' A' ' 47' ' ' GLY . 1.4 tm-20 -61.47 -53.17 59.95 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.359 -0.838 . . . . 0.0 109.985 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.56 ' O ' ' CB ' ' A' ' 53' ' ' HIS . . . -61.28 -9.61 17.25 Favored Glycine 0 N--CA 1.493 2.474 0 N-CA-C 110.035 -1.226 . . . . 0.0 110.035 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.577 ' CE1' HD22 ' A' ' 56' ' ' LEU . 1.0 OUTLIER 80.74 53.73 0.1 Allowed Pre-proline 0 N--CA 1.486 1.355 0 O-C-N 121.372 -1.076 . . . . 0.0 110.193 179.563 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.548 ' CD ' ' N ' ' A' ' 53' ' ' HIS . 3.4 Cg_exo -57.91 -38.16 93.41 Favored 'Trans proline' 0 C--N 1.312 -1.377 0 C-N-CA 122.457 2.105 . . . . 0.0 109.731 178.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.45 ' O ' ' ND1' ' A' ' 53' ' ' HIS . 1.6 m -96.1 174.29 6.99 Favored 'General case' 0 C--N 1.298 -1.657 0 CA-C-O 121.157 0.503 . . . . 0.0 109.844 -178.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.577 HD22 ' CE1' ' A' ' 53' ' ' HIS . 5.1 mt -149.6 -174.78 4.78 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.114 -0.991 . . . . 0.0 110.309 -179.568 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.624 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 1.0 OUTLIER 45.54 62.18 2.29 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-O 121.769 0.795 . . . . 0.0 109.929 -179.578 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.455 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 1.8 mm100 49.94 28.04 2.68 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.55 -0.719 . . . . 0.0 110.653 177.193 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -65.57 132.77 35.2 Favored Glycine 0 N--CA 1.489 2.201 0 N-CA-C 109.012 -1.635 . . . . 0.0 109.012 179.555 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 57.7 t60 -79.07 136.28 37.12 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.106 -1.232 . . . . 0.0 108.288 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.518 ' HA ' ' SG ' ' A' ' 70' ' ' CYS . 1.1 p -120.52 150.85 40.19 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 120.969 -1.082 . . . . 0.0 111.344 -178.373 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.492 ' HB2' ' OG1' ' A' ' 69' ' ' THR . 8.3 mttp . . . . . 0 C--N 1.299 -1.614 0 N-CA-C 105.364 -2.087 . . . . 0.0 105.364 177.037 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.521 ' O ' ' O ' ' A' ' 65' ' ' ILE . . . . . . . . 0 N--CA 1.483 1.797 0 N-CA-C 107.031 -2.428 . . . . 0.0 107.031 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.601 HG22 ' CA ' ' A' ' 44' ' ' TYR . 2.4 pp -35.63 154.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 CA-C-N 118.322 1.061 . . . . 0.0 110.016 -177.819 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . 0.499 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . 103.47 -44.42 1.49 Allowed Glycine 0 N--CA 1.483 1.812 0 N-CA-C 104.432 -3.467 . . . . 0.0 104.432 -176.104 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.499 ' HB3' ' O ' ' A' ' 66' ' ' GLY . 5.2 p-10 171.81 -152.35 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 176.508 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.61 ' N ' ' CD1' ' A' ' 68' ' ' TYR . 6.4 p90 -158.43 115.05 2.79 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 -179.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.492 ' OG1' ' HB2' ' A' ' 62' ' ' LYS . 76.8 p -79.67 115.11 19.1 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 120.659 -1.275 . . . . 0.0 109.438 -178.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 0.518 ' SG ' ' HA ' ' A' ' 61' ' ' CYS . 0.0 OUTLIER -103.12 -172.54 2.13 Favored 'General case' 0 C--N 1.304 -1.384 0 O-C-N 121.195 -0.94 . . . . 0.0 109.303 179.814 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 7.8 m -162.03 131.4 4.49 Favored 'General case' 0 C--N 1.291 -1.976 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 179.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.533 ' HB3' ' CB ' ' A' ' 76' ' ' PHE . 94.1 m -82.05 116.49 21.67 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.832 -1.167 . . . . 0.0 108.569 179.152 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.612 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . . . -43.67 172.56 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.014 -1.054 . . . . 0.0 111.319 -179.075 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.02 100.41 3.57 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-O 123.583 1.659 . . . . 0.0 108.586 178.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . 0.552 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 118.96 28.96 1.92 Allowed Glycine 0 C--N 1.264 -3.47 0 N-CA-C 108.066 -2.013 . . . . 0.0 108.066 -178.284 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.624 ' CE2' ' O ' ' A' ' 57' ' ' ASN . 17.7 m-85 -128.0 148.78 50.54 Favored 'General case' 0 C--N 1.296 -1.759 0 O-C-N 121.833 -0.804 . . . . 0.0 110.367 -178.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.516 ' HB2' HG22 ' A' ' 85' ' ' THR . 0.7 OUTLIER -152.58 166.55 31.69 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.252 -0.905 . . . . 0.0 110.514 -179.73 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 109.24 163.97 20.15 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.476 -1.45 . . . . 0.0 109.476 179.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.6 tptt -57.84 -33.61 68.83 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.113 -1.228 . . . . 0.0 109.106 179.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.492 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.4 OUTLIER -121.9 27.76 7.93 Favored 'General case' 0 C--N 1.291 -1.963 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 179.644 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . 0.51 ' O ' ' HB2' ' A' ' 57' ' ' ASN . 4.7 m 62.53 14.24 6.87 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 -178.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.448 ' C ' ' O ' ' A' ' 81' ' ' CYS . 45.9 tt0 -33.54 -36.94 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.323 0 O-C-N 121.666 -0.646 . . . . 0.0 111.923 -179.101 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.475 ' O ' ' OD1' ' A' ' 57' ' ' ASN . 1.3 m-85 -106.19 -166.49 1.2 Allowed 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 122.809 1.29 . . . . 0.0 109.492 -179.309 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.492 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 0.7 OUTLIER -138.82 107.27 5.83 Favored 'General case' 0 C--N 1.275 -2.659 0 CA-C-N 114.415 -1.266 . . . . 0.0 109.113 -179.871 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.516 HG22 ' HB2' ' A' ' 77' ' ' GLU . 2.4 p -62.36 96.49 0.08 Allowed 'General case' 0 C--N 1.302 -1.464 0 O-C-N 120.913 -1.117 . . . . 0.0 110.032 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.521 ' NH1' ' HG2' ' A' ' 86' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.294 -1.829 0 CA-C-O 118.052 -0.975 . . . . 0.0 110.099 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.441 ' HB2' ' HB3' ' A' ' 22' ' ' CYS . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.691 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.457 ' O ' ' CZ ' ' A' ' 44' ' ' TYR . 0.3 OUTLIER . . . . . 0 C--N 1.301 -1.539 0 O-C-N 121.394 -0.816 . . . . 0.0 109.998 179.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.395 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.441 ' HB3' ' HB2' ' A' ' 17' ' ' CYS . 1.0 OUTLIER -113.37 173.98 6.14 Favored 'General case' 0 N--CA 1.496 1.827 0 C-N-CA 119.656 -0.818 . . . . 0.0 109.412 179.281 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.606 ' O ' ' HB2' ' A' ' 24' ' ' LEU . 29.7 t -121.84 14.33 10.8 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.227 -0.92 . . . . 0.0 109.461 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.606 ' HB2' ' O ' ' A' ' 23' ' ' SER . 3.5 mm? . . . . . 0 N--CA 1.503 2.195 0 O-C-N 122.162 -0.336 . . . . 0.0 110.61 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.593 ' O ' ' CE1' ' A' ' 31' ' ' PHE . . . . . . . . 0 N--CA 1.49 1.573 0 CA-C-O 121.216 0.531 . . . . 0.0 109.626 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.435 ' CG ' ' NH1' ' A' ' 28' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 122.309 1.052 . . . . 0.0 110.105 -179.568 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.593 HG11 ' CD1' ' A' ' 31' ' ' PHE . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 120.49 0.186 . . . . 0.0 110.763 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.648 ' CE2' ' CE2' ' A' ' 40' ' ' PHE . 0.1 OUTLIER . . . . . 0 N--CA 1.495 1.808 0 O-C-N 120.474 -1.391 . . . . 0.0 111.626 -179.784 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.553 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 6.8 m-20 . . . . . 0 N--CA 1.482 1.134 0 CA-C-O 121.433 0.635 . . . . 0.0 111.417 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.507 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 N--CA 1.487 1.413 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 178.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.662 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 11.1 mm100 . . . . . 0 C--O 1.203 -1.37 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.64 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.1 OUTLIER -40.88 -59.1 1.51 Allowed 'General case' 0 N--CA 1.498 1.943 0 C-N-CA 118.23 -1.388 . . . . 0.0 108.631 179.31 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.4 ' O ' ' N ' ' A' ' 41' ' ' TRP . 0.8 OUTLIER . . . . . 0 N--CA 1.493 1.718 0 O-C-N 121.043 -1.036 . . . . 0.0 110.196 178.796 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.662 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 10.0 t80 . . . . . 0 N--CA 1.485 1.284 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.64 ' CD1' ' O ' ' A' ' 37' ' ' THR . 9.4 m95 -81.3 -69.32 0.62 Allowed 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.522 -0.736 . . . . 0.0 112.802 -178.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.489 ' OG ' ' N ' ' A' ' 43' ' ' LYS . 0.1 OUTLIER -42.89 -73.74 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.026 0 O-C-N 120.831 -1.168 . . . . 0.0 112.646 -176.906 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.531 ' HD2' ' CG2' ' A' ' 65' ' ' ILE . 1.4 ptpt -78.2 31.88 0.18 Allowed 'General case' 0 C--N 1.287 -2.113 0 O-C-N 121.649 -0.657 . . . . 0.0 110.57 -178.509 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.59 ' HB2' ' O ' ' A' ' 40' ' ' PHE . 0.8 OUTLIER -80.26 23.37 0.49 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.014 -1.054 . . . . 0.0 110.693 179.747 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -90.21 31.92 0.97 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 120.776 -1.202 . . . . 0.0 108.619 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.52 ' OD2' ' NE2' ' A' ' 49' ' ' GLN . 1.6 t0 -111.12 4.12 19.09 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.464 -0.773 . . . . 0.0 109.827 -179.235 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.546 ' O ' ' CB ' ' A' ' 48' ' ' ASP . . . 69.42 16.13 71.17 Favored Glycine 0 N--CA 1.492 2.395 0 N-CA-C 108.577 -1.809 . . . . 0.0 108.577 -179.086 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.577 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER 83.58 7.96 0.64 Allowed 'General case' 0 N--CA 1.501 2.106 0 O-C-N 121.779 -0.836 . . . . 0.0 109.527 -179.815 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.632 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 33.7 mm-40 72.33 -21.91 0.22 Allowed 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.462 -0.774 . . . . 0.0 111.838 179.273 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . 0.463 ' O ' ' HD3' ' A' ' 54' ' ' PRO . 25.1 t -105.97 -20.05 13.55 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.426 -1.421 . . . . 0.0 109.436 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' A' ' 47' ' ' GLY . 72.5 tt0 -49.83 136.45 17.97 Favored 'General case' 0 N--CA 1.485 1.281 0 O-C-N 121.088 -1.007 . . . . 0.0 109.073 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 100.0 -11.9 60.59 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 110.094 -1.203 . . . . 0.0 110.094 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.452 ' CD2' ' O ' ' A' ' 55' ' ' CYS . 3.8 t-160 60.82 65.74 1.96 Allowed Pre-proline 0 N--CA 1.491 1.582 0 O-C-N 121.088 -1.242 . . . . 0.0 109.436 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.463 ' HD3' ' O ' ' A' ' 50' ' ' CYS . 5.7 Cg_exo -58.86 -38.57 87.78 Favored 'Trans proline' 0 C--N 1.308 -1.558 0 C-N-CA 122.415 2.077 . . . . 0.0 110.751 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.476 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 1.8 m -72.4 172.45 10.39 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.353 -0.842 . . . . 0.0 109.233 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.476 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 4.7 mt -144.88 -174.99 4.5 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.238 -0.914 . . . . 0.0 109.934 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.614 ' O ' ' CD2' ' A' ' 76' ' ' PHE . 1.0 OUTLIER 44.76 61.9 2.29 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-O 121.666 0.746 . . . . 0.0 109.538 -179.857 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.451 ' HG3' ' C ' ' A' ' 57' ' ' ASN . 1.4 mt-30 45.18 33.84 1.24 Allowed 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.232 -0.917 . . . . 0.0 109.387 177.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -80.27 152.28 34.12 Favored Glycine 0 N--CA 1.489 2.182 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.461 ' O ' ' SG ' ' A' ' 55' ' ' CYS . 0.0 OUTLIER -79.85 169.31 18.1 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.337 -1.096 . . . . 0.0 108.631 179.502 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.476 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 19.2 t -140.72 125.87 18.51 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.024 -1.047 . . . . 0.0 110.125 -179.389 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.508 ' O ' ' HB2' ' A' ' 68' ' ' TYR . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.375 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 178.148 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.557 ' O ' ' N ' ' A' ' 66' ' ' GLY . . . . . . . . 0 N--CA 1.49 2.262 0 N-CA-C 110.026 -1.23 . . . . 0.0 110.026 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.531 ' CG2' ' HD2' ' A' ' 43' ' ' LYS . 2.2 mm 47.67 -86.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 121.432 -1.04 . . . . 0.0 110.081 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . 0.557 ' N ' ' O ' ' A' ' 64' ' ' GLY . . . -31.26 -38.24 0.03 OUTLIER Glycine 0 N--CA 1.5 2.938 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.517 ' N ' ' O ' ' A' ' 65' ' ' ILE . 5.0 p-10 -175.29 -150.42 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.393 -1.063 . . . . 0.0 109.549 178.722 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.644 ' N ' ' CD1' ' A' ' 68' ' ' TYR . 1.8 p90 -160.38 139.16 10.43 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.198 -0.939 . . . . 0.0 109.606 -178.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.48 ' OG1' ' HD3' ' A' ' 62' ' ' LYS . 50.1 p -104.64 120.14 40.63 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.11 -0.994 . . . . 0.0 109.341 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 6.9 m -79.33 -166.64 0.99 Allowed 'General case' 0 C--N 1.303 -1.419 0 O-C-N 120.663 -1.273 . . . . 0.0 108.82 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.459 ' O ' ' SG ' ' A' ' 81' ' ' CYS . 4.7 m -160.37 159.3 30.97 Favored 'General case' 0 C--N 1.288 -2.084 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.531 ' HB3' ' CB ' ' A' ' 76' ' ' PHE . 87.2 m -125.65 123.04 38.1 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.026 -1.046 . . . . 0.0 109.484 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.574 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . . . -50.34 -176.15 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.073 -1.017 . . . . 0.0 110.757 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -81.03 102.11 9.98 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-O 123.067 1.413 . . . . 0.0 107.869 178.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . 0.491 ' HA2' ' OG1' ' A' ' 85' ' ' THR . . . 117.37 21.21 4.47 Favored Glycine 0 C--N 1.267 -3.283 0 N-CA-C 108.583 -1.807 . . . . 0.0 108.583 -178.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.614 ' CD2' ' O ' ' A' ' 57' ' ' ASN . 8.3 m-85 -119.8 157.32 28.88 Favored 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.632 -0.922 . . . . 0.0 110.156 -177.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.54 ' HG2' ' N ' ' A' ' 85' ' ' THR . 0.6 OUTLIER -160.17 163.03 33.98 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.048 -1.032 . . . . 0.0 110.955 -179.25 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 109.84 166.03 19.83 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.352 -1.499 . . . . 0.0 109.352 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.64 -34.82 69.74 Favored 'General case' 0 C--N 1.306 -1.313 0 O-C-N 121.155 -1.203 . . . . 0.0 109.12 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.476 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.7 OUTLIER -121.84 27.07 8.32 Favored 'General case' 0 C--N 1.291 -1.962 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 179.363 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . 0.504 ' HA ' ' O ' ' A' ' 77' ' ' GLU . 7.1 m 65.99 10.63 7.13 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.23 -0.919 . . . . 0.0 109.198 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.542 ' HB3' ' CE1' ' A' ' 83' ' ' PHE . 28.5 tt0 -32.78 -43.03 0.09 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.868 -0.52 . . . . 0.0 111.821 -179.499 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.562 ' N ' ' CD1' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -99.6 -160.3 0.79 Allowed 'General case' 0 C--N 1.296 -1.742 0 CA-C-O 122.864 1.316 . . . . 0.0 109.738 -179.043 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.483 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 1.0 OUTLIER -148.43 123.02 9.8 Favored 'General case' 0 C--N 1.278 -2.53 0 CA-C-N 114.314 -1.312 . . . . 0.0 109.051 179.603 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.54 ' N ' ' HG2' ' A' ' 77' ' ' GLU . 14.2 p -69.38 -16.23 63.47 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.205 -0.934 . . . . 0.0 109.656 -179.56 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.406 ' OXT' ' O ' ' A' ' 85' ' ' THR . 1.5 mtt180 . . . . . 0 C--N 1.295 -1.798 0 CA-C-O 118.03 -0.986 . . . . 0.0 109.588 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.539 ' HA ' ' HB3' ' A' ' 22' ' ' CYS . 1.6 t . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 121.717 0.77 . . . . 0.0 109.52 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.564 ' HG ' ' CB ' ' A' ' 48' ' ' ASP . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 O-C-N 120.526 -1.359 . . . . 0.0 110.197 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.475 0 CA-C-O 120.71 0.29 . . . . 0.0 110.804 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.539 ' HB3' ' HA ' ' A' ' 17' ' ' CYS . 11.9 p -139.68 -150.62 0.33 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.704 -1.247 . . . . 0.0 110.803 -179.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.504 ' N ' ' SG ' ' A' ' 22' ' ' CYS . 47.1 t -166.52 -70.5 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.646 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.5 ' CD2' ' O ' ' A' ' 23' ' ' SER . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.544 0 O-C-N 121.276 -0.89 . . . . 0.0 109.726 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.595 ' O ' ' CE1' ' A' ' 31' ' ' PHE . . . . . . . . 0 N--CA 1.492 1.668 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.453 ' CG ' HH11 ' A' ' 28' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.907 0 O-C-N 120.59 -1.318 . . . . 0.0 110.396 179.569 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 58.8 t . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 120.703 0.287 . . . . 0.0 110.833 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.595 ' CE1' ' O ' ' A' ' 27' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.874 0 O-C-N 120.713 -1.242 . . . . 0.0 112.233 -178.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.515 ' OD2' ' CE1' ' A' ' 31' ' ' PHE . 51.3 p-10 . . . . . 0 N--CA 1.476 0.829 0 CA-C-O 121.759 0.79 . . . . 0.0 111.795 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.563 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 N--CA 1.489 1.479 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 178.143 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.647 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 81.1 mt-30 . . . . . 0 C--O 1.203 -1.393 0 N-CA-C 108.299 -1.001 . . . . 0.0 108.299 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.676 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 1.0 OUTLIER -42.26 -57.46 2.54 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.292 -1.505 . . . . 0.0 107.774 179.061 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.441 ' O ' ' N ' ' A' ' 41' ' ' TRP . 1.9 t70 . . . . . 0 N--CA 1.494 1.743 0 O-C-N 120.875 -1.141 . . . . 0.0 108.666 176.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.647 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 14.2 t80 . . . . . 0 N--CA 1.488 1.454 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.676 ' CD1' ' O ' ' A' ' 37' ' ' THR . 7.7 m95 -77.64 -66.0 0.89 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.563 -0.71 . . . . 0.0 112.648 -178.58 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.496 ' OG ' ' N ' ' A' ' 43' ' ' LYS . 0.1 OUTLIER -42.55 -73.4 0.05 OUTLIER 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.738 -1.226 . . . . 0.0 112.223 -177.344 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.564 ' HD2' ' CG2' ' A' ' 65' ' ' ILE . 0.0 OUTLIER -81.32 35.9 0.4 Allowed 'General case' 0 C--N 1.286 -2.162 0 O-C-N 121.544 -0.723 . . . . 0.0 109.814 -178.874 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.578 ' CE1' ' OD1' ' A' ' 48' ' ' ASP . 0.6 OUTLIER -80.03 12.9 2.5 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.135 -0.978 . . . . 0.0 110.695 -179.709 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 4.6 mttm -86.77 55.01 3.37 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 120.964 -1.085 . . . . 0.0 108.377 179.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -131.64 4.5 4.25 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.501 -0.749 . . . . 0.0 110.128 -178.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.558 ' O ' ' CB ' ' A' ' 51' ' ' GLU . . . 72.49 29.23 66.21 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 108.606 -1.798 . . . . 0.0 108.606 -179.308 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.578 ' OD1' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER 46.58 21.57 0.14 Allowed 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.482 -1.01 . . . . 0.0 110.329 -179.868 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.637 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 33.2 mm-40 59.06 -92.29 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.453 0 O-C-N 120.973 -1.079 . . . . 0.0 111.157 178.036 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . 0.461 ' O ' ' HD3' ' A' ' 54' ' ' PRO . 36.5 t -45.87 -25.64 0.56 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.183 -0.948 . . . . 0.0 110.862 -178.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.558 ' CB ' ' O ' ' A' ' 47' ' ' GLY . 20.1 tt0 -49.43 148.55 2.67 Favored 'General case' 0 N--CA 1.485 1.312 0 O-C-N 120.577 -1.327 . . . . 0.0 108.708 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.459 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . 90.8 -15.92 59.47 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 110.078 -1.209 . . . . 0.0 110.078 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.46 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 30.7 t60 65.03 64.26 1.06 Allowed Pre-proline 0 N--CA 1.493 1.72 0 O-C-N 121.144 -1.209 . . . . 0.0 109.599 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.461 ' HD3' ' O ' ' A' ' 50' ' ' CYS . 4.9 Cg_exo -61.19 -39.5 58.08 Favored 'Trans proline' 0 C--N 1.31 -1.5 0 C-N-CA 122.604 2.203 . . . . 0.0 110.604 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.482 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 1.8 m -71.51 173.05 8.48 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.381 -0.824 . . . . 0.0 109.304 -179.576 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.547 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.6 mt -146.6 -176.84 5.34 Favored 'General case' 0 N--CA 1.492 1.635 0 CA-C-O 122.231 1.015 . . . . 0.0 109.906 179.466 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.615 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 1.6 m120 45.84 61.33 2.7 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.513 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.415 ' HG3' ' C ' ' A' ' 57' ' ' ASN . 3.4 mt-30 46.54 33.36 1.96 Allowed 'General case' 0 C--N 1.299 -1.591 0 C-N-CA 119.468 -0.893 . . . . 0.0 109.384 177.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -73.93 145.71 35.53 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.669 -1.373 . . . . 0.0 109.669 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.437 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 1.3 t60 -79.91 115.8 19.7 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.208 -1.172 . . . . 0.0 109.021 179.701 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.482 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 44.5 t -91.92 134.37 34.85 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.102 -0.999 . . . . 0.0 110.092 -179.438 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.49 ' HB2' ' O ' ' A' ' 69' ' ' THR . 2.1 tttp . . . . . 0 N--CA 1.486 1.342 0 N-CA-C 106.919 -1.511 . . . . 0.0 106.919 178.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.513 ' O ' ' O ' ' A' ' 67' ' ' ASP . . . . . . . . 0 N--CA 1.488 2.161 0 N-CA-C 107.71 -2.156 . . . . 0.0 107.71 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.564 ' CG2' ' HD2' ' A' ' 43' ' ' LYS . 0.4 OUTLIER -53.31 -61.98 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 O-C-N 120.461 -1.611 . . . . 0.0 109.216 -179.088 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . 0.496 ' N ' HG23 ' A' ' 65' ' ' ILE . . . -43.68 -38.46 4.26 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 110.029 -1.228 . . . . 0.0 110.029 -179.469 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.523 ' OD1' ' N ' ' A' ' 68' ' ' TYR . 1.6 p30 179.29 -157.16 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.255 -1.144 . . . . 0.0 110.094 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.647 ' N ' ' CD1' ' A' ' 68' ' ' TYR . 3.1 p90 -150.66 124.84 9.39 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.121 -0.987 . . . . 0.0 108.919 -178.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.49 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 70.3 p -95.34 119.33 33.67 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 120.898 -1.126 . . . . 0.0 109.201 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 9.5 m -79.11 -171.46 2.67 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.664 -1.273 . . . . 0.0 108.382 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.437 ' HB ' ' HB3' ' A' ' 60' ' ' HIS . 5.1 m -161.19 145.1 13.21 Favored 'General case' 0 C--N 1.285 -2.198 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 179.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.479 ' O ' ' O ' ' A' ' 73' ' ' ALA . 73.8 m -109.06 118.34 36.53 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.176 -0.953 . . . . 0.0 108.974 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.611 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . . . -47.89 -178.02 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.066 -1.021 . . . . 0.0 110.42 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -80.51 100.67 8.67 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-O 123.2 1.476 . . . . 0.0 108.065 178.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . 0.46 ' O ' ' OG1' ' A' ' 85' ' ' THR . . . 119.17 18.5 4.58 Favored Glycine 0 C--N 1.269 -3.148 0 CA-C-N 113.575 -1.648 . . . . 0.0 108.994 -179.208 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.615 ' CE2' ' O ' ' A' ' 57' ' ' ASN . 4.8 m-85 -115.58 160.07 20.46 Favored 'General case' 0 C--N 1.294 -1.813 0 O-C-N 121.372 -1.076 . . . . 0.0 109.726 -178.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.591 ' HG3' ' CD2' ' A' ' 83' ' ' PHE . 19.3 pt-20 -160.72 167.26 27.26 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.158 -0.964 . . . . 0.0 110.304 -179.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 108.28 166.68 21.22 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 110.105 -1.198 . . . . 0.0 110.105 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.39 -47.49 72.66 Favored 'General case' 0 C--N 1.307 -1.251 0 O-C-N 121.371 -1.076 . . . . 0.0 109.638 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.547 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 2.9 m-20 -111.79 32.57 5.36 Favored 'General case' 0 C--N 1.287 -2.129 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 179.272 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . 0.497 ' HA ' ' O ' ' A' ' 77' ' ' GLU . 3.3 m 52.27 67.82 0.92 Allowed 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 105.67 -1.974 . . . . 0.0 105.67 -177.215 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.433 ' C ' ' OD1' ' A' ' 57' ' ' ASN . 37.9 tt0 -103.52 -25.2 13.31 Favored 'General case' 0 C--N 1.306 -1.29 0 O-C-N 121.589 -0.694 . . . . 0.0 111.067 -176.558 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.632 ' N ' ' CD1' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -99.53 74.84 1.91 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.898 -1.126 . . . . 0.0 109.212 -179.827 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.444 ' C ' ' O ' ' A' ' 83' ' ' PHE . 0.3 OUTLIER -43.66 94.97 0.01 OUTLIER 'General case' 0 C--N 1.293 -1.862 0 C-N-CA 119.697 -0.801 . . . . 0.0 109.521 -179.82 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.563 ' CG2' ' HG2' ' A' ' 77' ' ' GLU . 5.8 p -68.38 -11.69 59.98 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.339 -0.851 . . . . 0.0 109.822 -179.639 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.439 ' OXT' ' O ' ' A' ' 85' ' ' THR . 3.5 mtp180 . . . . . 0 C--N 1.299 -1.605 0 CA-C-O 118.034 -0.984 . . . . 0.0 109.936 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.504 ' O ' ' HB2' ' A' ' 22' ' ' CYS . 0.6 OUTLIER . . . . . 0 N--CA 1.489 1.514 0 N-CA-C 108.091 -1.078 . . . . 0.0 108.091 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.525 ' CD1' ' OH ' ' A' ' 44' ' ' TYR . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.568 0 O-C-N 121.873 -0.517 . . . . 0.0 110.011 -179.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.403 ' O ' ' HA ' ' A' ' 17' ' ' CYS . . . . . . . . 0 N--CA 1.488 1.472 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.504 ' HB2' ' O ' ' A' ' 17' ' ' CYS . 1.7 t -130.67 173.24 11.1 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.397 -0.814 . . . . 0.0 109.379 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.525 ' O ' ' CB ' ' A' ' 24' ' ' LEU . 30.4 t -135.91 -0.74 2.52 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.217 -0.927 . . . . 0.0 109.934 179.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.525 ' CB ' ' O ' ' A' ' 23' ' ' SER . 0.1 OUTLIER . . . . . 0 N--CA 1.495 1.811 0 O-C-N 121.212 -0.93 . . . . 0.0 110.465 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.432 ' HB3' ' SG ' ' A' ' 22' ' ' CYS . . . . . . . . 0 N--CA 1.494 1.735 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.489 1.479 0 CA-C-O 122.19 0.995 . . . . 0.0 110.394 -179.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.3 t . . . . . 0 N--CA 1.492 1.667 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.584 ' CE2' ' CE2' ' A' ' 40' ' ' PHE . 1.9 m-85 . . . . . 0 N--CA 1.488 1.45 0 O-C-N 120.885 -1.134 . . . . 0.0 109.831 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.577 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 22.6 m-20 . . . . . 0 N--CA 1.482 1.164 0 CA-C-O 121.255 0.55 . . . . 0.0 110.69 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.522 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 N--CA 1.487 1.375 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 178.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.661 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 5.8 mm100 . . . . . 0 C--O 1.203 -1.376 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.614 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -41.55 -60.09 1.42 Allowed 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.164 -1.585 . . . . 0.0 107.926 179.056 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.432 ' O ' ' N ' ' A' ' 41' ' ' TRP . 1.8 t70 . . . . . 0 N--CA 1.494 1.731 0 O-C-N 121.337 -0.852 . . . . 0.0 109.263 177.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.661 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 20.6 t80 . . . . . 0 N--CA 1.489 1.521 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.614 ' CD1' ' O ' ' A' ' 37' ' ' THR . 9.5 m95 -80.94 -71.85 0.45 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.778 -0.576 . . . . 0.0 112.101 -179.176 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.52 ' OG ' ' N ' ' A' ' 43' ' ' LYS . 1.1 p -53.77 -60.34 3.45 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.435 -1.416 . . . . 0.0 110.711 -178.113 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.52 ' N ' ' OG ' ' A' ' 42' ' ' SER . 0.3 OUTLIER -62.38 -13.71 32.21 Favored 'General case' 0 C--N 1.284 -2.246 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 -179.738 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.707 ' O ' ' N ' ' A' ' 46' ' ' ASP . 0.9 OUTLIER -43.23 -65.72 0.46 Allowed 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.31 -0.869 . . . . 0.0 109.0 -179.769 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.543 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.2 OUTLIER -15.58 73.34 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.719 0 CA-C-O 121.203 0.525 . . . . 0.0 111.272 -179.938 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.707 ' N ' ' O ' ' A' ' 44' ' ' TYR . 2.6 t0 -161.71 -30.26 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.215 -0.928 . . . . 0.0 110.414 -178.602 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.491 ' O ' ' OD2' ' A' ' 48' ' ' ASP . . . 105.34 16.15 17.19 Favored Glycine 0 N--CA 1.486 1.999 0 N-CA-C 108.15 -1.98 . . . . 0.0 108.15 -178.199 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.652 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER 72.21 9.23 5.93 Favored 'General case' 0 N--CA 1.504 2.244 0 O-C-N 121.777 -0.837 . . . . 0.0 109.988 -179.704 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.652 ' HB2' ' O ' ' A' ' 48' ' ' ASP . 32.5 mm-40 79.42 -25.13 0.19 Allowed 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.77 -0.581 . . . . 0.0 111.807 178.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 19.2 t -111.8 -14.49 13.55 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.676 -1.265 . . . . 0.0 110.349 -179.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.487 ' CB ' ' O ' ' A' ' 47' ' ' GLY . 13.9 tt0 -54.98 -20.39 9.0 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 120.943 -1.098 . . . . 0.0 111.514 -179.34 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.415 ' O ' ' C ' ' A' ' 53' ' ' HIS . . . -95.94 21.74 43.31 Favored Glycine 0 N--CA 1.497 2.708 0 O-C-N 120.701 -1.25 . . . . 0.0 111.244 -178.518 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.557 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 13.2 t60 42.94 54.66 10.27 Favored Pre-proline 0 N--CA 1.493 1.717 0 O-C-N 120.956 -1.32 . . . . 0.0 109.721 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.557 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 6.3 Cg_exo -57.89 -39.43 86.71 Favored 'Trans proline' 0 C--N 1.309 -1.542 0 C-N-CA 122.537 2.158 . . . . 0.0 111.846 -179.633 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.479 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 1.0 OUTLIER -83.84 158.84 21.52 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.083 -1.011 . . . . 0.0 110.348 -178.405 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.518 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.4 mt -144.69 -172.84 3.9 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.434 -0.791 . . . . 0.0 109.516 -179.83 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.641 ' HB3' ' CD2' ' A' ' 76' ' ' PHE . 8.1 m-80 46.78 58.81 4.38 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-O 121.827 0.822 . . . . 0.0 110.363 178.662 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.566 ' OE1' ' CZ ' ' A' ' 76' ' ' PHE . 8.4 mt-30 52.64 30.16 8.31 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-O 121.489 0.662 . . . . 0.0 109.54 177.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . 0.423 ' HA2' ' O ' ' A' ' 71' ' ' THR . . . -82.31 141.32 21.29 Favored Glycine 0 N--CA 1.489 2.217 0 N-CA-C 109.728 -1.349 . . . . 0.0 109.728 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -79.39 149.71 31.57 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.193 -1.18 . . . . 0.0 108.036 179.137 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.479 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 41.0 t -119.55 113.79 21.26 Favored 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 119.027 -1.069 . . . . 0.0 111.254 -178.529 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.404 ' HB3' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.299 -1.589 0 N-CA-C 105.454 -2.054 . . . . 0.0 105.454 176.595 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.503 ' O ' ' O ' ' A' ' 67' ' ' ASP . . . . . . . . 0 N--CA 1.488 2.142 0 N-CA-C 107.438 -2.265 . . . . 0.0 107.438 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.522 HG23 ' N ' ' A' ' 66' ' ' GLY . 0.0 OUTLIER -45.53 -56.21 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 120.662 -1.493 . . . . 0.0 109.132 -178.826 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . 0.522 ' N ' HG23 ' A' ' 65' ' ' ILE . . . -44.04 -43.58 7.09 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.503 ' O ' ' O ' ' A' ' 64' ' ' GLY . 2.1 p-10 178.44 -154.87 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.408 -1.054 . . . . 0.0 109.686 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.648 ' N ' ' CD1' ' A' ' 68' ' ' TYR . 1.9 p90 -144.82 157.73 44.06 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 120.859 -1.151 . . . . 0.0 109.962 -179.211 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.404 ' OG1' ' HB3' ' A' ' 62' ' ' LYS . 73.7 p -122.52 115.15 21.69 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.429 -0.795 . . . . 0.0 109.181 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 65.8 m -84.63 -167.61 1.87 Allowed 'General case' 0 C--N 1.298 -1.643 0 O-C-N 120.889 -1.132 . . . . 0.0 108.937 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.423 ' O ' ' HA2' ' A' ' 59' ' ' GLY . 1.3 m -160.85 120.93 2.74 Favored 'General case' 0 C--N 1.29 -2.011 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.442 ' O ' ' O ' ' A' ' 73' ' ' ALA . 91.4 m -89.56 115.88 27.29 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.126 -0.983 . . . . 0.0 109.437 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.442 ' O ' ' O ' ' A' ' 72' ' ' CYS . . . -49.51 -179.42 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.481 0 O-C-N 120.915 -1.116 . . . . 0.0 110.162 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -81.03 101.3 9.47 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-O 122.97 1.367 . . . . 0.0 107.799 178.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . 0.583 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 130.99 5.11 3.97 Favored Glycine 0 C--N 1.269 -3.149 0 CA-C-N 114.003 -1.453 . . . . 0.0 110.003 -179.315 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.641 ' CD2' ' HB3' ' A' ' 57' ' ' ASN . 45.4 m-85 -133.45 154.16 51.02 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.111 -1.229 . . . . 0.0 110.606 -177.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.468 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 0.0 OUTLIER -155.92 168.22 27.91 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.247 -0.908 . . . . 0.0 110.206 -179.233 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 116.79 171.99 16.11 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 109.452 -1.459 . . . . 0.0 109.452 179.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.451 ' HD3' ' C ' ' A' ' 79' ' ' LYS . 0.4 OUTLIER -50.98 -56.26 13.32 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.152 -1.205 . . . . 0.0 108.65 179.687 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.518 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 1.3 m-20 -108.39 26.87 9.95 Favored 'General case' 0 C--N 1.287 -2.122 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . 0.538 ' O ' ' ND2' ' A' ' 57' ' ' ASN . 4.1 m 63.87 14.63 8.49 Favored 'General case' 0 C--N 1.305 -1.342 0 O-C-N 121.083 -1.01 . . . . 0.0 108.372 -178.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 36.8 tt0 -38.24 -25.5 0.01 OUTLIER 'General case' 0 C--N 1.309 -1.179 0 O-C-N 121.861 -0.525 . . . . 0.0 111.71 -179.53 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.551 ' N ' ' CD1' ' A' ' 83' ' ' PHE . 0.4 OUTLIER -97.43 -161.44 0.87 Allowed 'General case' 0 C--N 1.299 -1.599 0 CA-C-O 122.836 1.303 . . . . 0.0 109.597 -179.743 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.468 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 54.7 m -161.44 93.1 0.92 Allowed 'General case' 0 C--N 1.277 -2.555 0 CA-C-N 114.302 -1.317 . . . . 0.0 109.098 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.437 ' C ' ' HG3' ' A' ' 86' ' ' ARG . 82.7 p -51.92 -58.81 5.4 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.191 -0.943 . . . . 0.0 109.885 -179.519 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.437 ' HG3' ' C ' ' A' ' 85' ' ' THR . 2.5 ppt_? . . . . . 0 C--N 1.285 -2.225 0 CA-C-O 117.997 -1.002 . . . . 0.0 109.445 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.682 ' HA ' ' HB3' ' A' ' 22' ' ' CYS . 44.6 t . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 122.227 1.013 . . . . 0.0 109.287 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.538 ' CD1' ' O ' ' A' ' 48' ' ' ASP . 0.1 OUTLIER . . . . . 0 C--N 1.298 -1.636 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.146 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.694 0 CA-C-O 120.827 0.346 . . . . 0.0 110.801 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.682 ' HB3' ' HA ' ' A' ' 17' ' ' CYS . 18.1 p -134.5 -163.59 1.39 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.842 -1.161 . . . . 0.0 110.491 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.427 ' O ' ' C ' ' A' ' 24' ' ' LEU . 84.4 p -170.62 137.8 1.38 Allowed 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 179.317 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.57 HD11 ' N ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.616 0 O-C-N 121.227 -0.92 . . . . 0.0 111.042 -179.278 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.471 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.535 ' CG ' ' O ' ' A' ' 24' ' ' LEU . 4.1 mtp180 . . . . . 0 N--CA 1.491 1.578 0 O-C-N 121.252 -0.905 . . . . 0.0 110.801 -179.345 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.9 t . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.632 ' CZ ' ' NE2' ' A' ' 36' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.611 0 C-N-CA 119.138 -1.025 . . . . 0.0 110.014 178.265 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.565 ' HB2' ' CG ' ' A' ' 36' ' ' GLN . 4.8 m-20 . . . . . 0 N--CA 1.484 1.229 0 CA-C-O 121.561 0.696 . . . . 0.0 111.44 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.54 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 C--N 1.305 -1.364 0 N-CA-C 106.12 -1.808 . . . . 0.0 106.12 177.078 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.691 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.202 -1.417 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.604 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -41.89 -61.89 1.03 Allowed 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 117.548 -1.661 . . . . 0.0 106.969 178.698 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.554 ' O ' ' N ' ' A' ' 41' ' ' TRP . 0.4 OUTLIER . . . . . 0 N--CA 1.493 1.679 0 O-C-N 121.358 -0.839 . . . . 0.0 109.544 176.397 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.738 ' O ' ' HB2' ' A' ' 44' ' ' TYR . 21.0 t80 . . . . . 0 C--O 1.189 -2.103 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.604 ' CD1' ' O ' ' A' ' 37' ' ' THR . 16.2 m95 -80.94 -66.06 0.93 Allowed 'General case' 0 C--N 1.294 -1.817 0 O-C-N 120.656 -1.278 . . . . 0.0 112.019 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.55 ' O ' ' CB ' ' A' ' 43' ' ' LYS . 0.6 OUTLIER -71.85 79.62 0.88 Allowed 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 122.334 1.064 . . . . 0.0 109.565 -178.81 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.55 ' CB ' ' O ' ' A' ' 42' ' ' SER . 0.0 OUTLIER 153.68 -26.69 0.0 OUTLIER 'General case' 0 C--N 1.283 -2.324 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 -179.46 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.738 ' HB2' ' O ' ' A' ' 40' ' ' PHE . 22.1 t80 -80.38 -97.55 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 179.034 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.551 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.1 OUTLIER 35.84 33.41 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 -179.057 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.556 ' HB2' ' O ' ' A' ' 44' ' ' TYR . 7.4 t0 -134.21 -17.59 2.08 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.712 -176.308 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.537 ' HA2' ' CE1' ' A' ' 44' ' ' TYR . . . 45.06 60.88 3.75 Favored Glycine 0 N--CA 1.496 2.685 0 N-CA-C 106.328 -2.709 . . . . 0.0 106.328 -177.31 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.538 ' O ' ' CD1' ' A' ' 18' ' ' LEU . 13.0 t70 -129.18 -129.22 0.21 Allowed 'General case' 0 C--N 1.308 -1.228 0 O-C-N 121.445 -1.032 . . . . 0.0 111.434 -176.166 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.529 ' HG3' ' N ' ' A' ' 67' ' ' ASP . 0.1 OUTLIER 52.04 -86.0 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.425 -0.797 . . . . 0.0 111.343 -179.385 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . 0.496 ' HA ' ' CG ' ' A' ' 54' ' ' PRO . 46.1 t -101.33 12.63 37.1 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.948 -1.095 . . . . 0.0 111.221 -178.542 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -70.19 146.05 51.02 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 120.714 -1.241 . . . . 0.0 109.008 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 90.94 -1.85 78.62 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 110.107 -1.197 . . . . 0.0 110.107 179.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.42 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 10.2 t60 62.59 66.52 1.3 Allowed Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.114 -1.227 . . . . 0.0 109.411 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.496 ' CG ' ' HA ' ' A' ' 50' ' ' CYS . 3.0 Cg_exo -61.97 -52.93 2.4 Favored 'Trans proline' 0 C--N 1.309 -1.502 0 C-N-CA 122.42 2.08 . . . . 0.0 111.259 -179.666 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.494 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 1.8 m -65.76 160.72 22.35 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.093 -1.005 . . . . 0.0 109.178 -179.349 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.475 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.3 mt -145.21 -173.83 4.21 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.195 -0.941 . . . . 0.0 110.026 -179.573 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.651 ' HB3' ' CD2' ' A' ' 76' ' ' PHE . 8.2 m-80 45.68 59.7 3.51 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-O 121.995 0.902 . . . . 0.0 110.281 178.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.447 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 2.2 mm-40 53.66 30.18 10.58 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-O 121.521 0.677 . . . . 0.0 109.709 177.678 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . 0.479 ' HA2' ' O ' ' A' ' 71' ' ' THR . . . -81.58 131.13 10.17 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.435 -1.466 . . . . 0.0 109.435 179.752 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -79.63 123.48 27.67 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.116 -1.226 . . . . 0.0 109.019 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.494 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 39.0 t -91.96 148.98 21.79 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.383 -0.823 . . . . 0.0 110.397 -179.046 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 69' ' ' THR . 0.9 OUTLIER . . . . . 0 C--N 1.305 -1.369 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 178.446 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.556 ' O ' ' O ' ' A' ' 65' ' ' ILE . . . . . . . . 0 N--CA 1.488 2.106 0 N-CA-C 110.95 -0.86 . . . . 0.0 110.95 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.558 ' CD1' ' HA ' ' A' ' 44' ' ' TYR . 0.1 OUTLIER 54.97 143.34 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.258 -1.142 . . . . 0.0 109.975 179.776 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 85.07 -43.47 3.26 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 108.223 -1.951 . . . . 0.0 108.223 -178.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.529 ' N ' ' HG3' ' A' ' 49' ' ' GLN . 1.8 p-10 -176.15 -157.46 0.05 Allowed 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.488 -1.007 . . . . 0.0 109.162 178.51 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.704 ' N ' ' CD1' ' A' ' 68' ' ' TYR . 4.0 p90 -160.71 125.46 3.69 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.303 -0.873 . . . . 0.0 108.759 -177.724 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.473 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 73.3 p -85.48 128.21 34.66 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 120.492 -1.38 . . . . 0.0 109.66 179.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 31.0 m -92.89 -170.91 2.56 Favored 'General case' 0 C--N 1.306 -1.287 0 O-C-N 120.972 -1.08 . . . . 0.0 108.422 179.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.479 ' O ' ' HA2' ' A' ' 59' ' ' GLY . 9.0 m -161.34 112.65 1.76 Allowed 'General case' 0 C--N 1.289 -2.06 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.571 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 99.6 m -79.74 121.19 25.03 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 120.96 -1.088 . . . . 0.0 108.766 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -52.05 175.34 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.403 0 O-C-N 120.937 -1.102 . . . . 0.0 109.732 -179.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -80.75 101.33 9.25 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-O 123.022 1.391 . . . . 0.0 107.788 178.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . 0.553 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 131.45 5.99 3.53 Favored Glycine 0 C--N 1.27 -3.126 0 CA-C-N 113.905 -1.498 . . . . 0.0 110.184 -179.374 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.651 ' CD2' ' HB3' ' A' ' 57' ' ' ASN . 27.1 m-85 -130.64 160.78 33.22 Favored 'General case' 0 C--N 1.299 -1.626 0 O-C-N 121.041 -1.27 . . . . 0.0 110.6 -178.238 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.473 ' C ' ' HA ' ' A' ' 81' ' ' CYS . 0.8 OUTLIER -159.44 169.23 24.37 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.119 -0.988 . . . . 0.0 110.494 -179.387 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 115.83 173.49 17.35 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 109.322 -1.511 . . . . 0.0 109.322 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.55 -57.47 7.02 Favored 'General case' 0 C--N 1.306 -1.301 0 O-C-N 121.088 -1.242 . . . . 0.0 109.018 179.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.488 ' O ' ' CB ' ' A' ' 81' ' ' CYS . 2.7 m-20 -108.51 23.94 13.78 Favored 'General case' 0 C--N 1.29 -2.013 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 178.762 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . 0.545 ' O ' ' ND2' ' A' ' 57' ' ' ASN . 3.3 m 72.05 15.47 5.55 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.078 -1.014 . . . . 0.0 108.566 -179.451 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 34.8 tt0 -39.42 -25.13 0.02 OUTLIER 'General case' 0 C--N 1.308 -1.239 0 O-C-N 121.772 -0.58 . . . . 0.0 112.348 -179.266 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.52 ' N ' ' CD1' ' A' ' 83' ' ' PHE . 0.4 OUTLIER -101.96 -161.84 0.88 Allowed 'General case' 0 C--N 1.299 -1.608 0 CA-C-O 122.91 1.338 . . . . 0.0 110.092 -179.079 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.497 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 8.0 m -156.36 99.07 1.89 Allowed 'General case' 0 C--N 1.278 -2.515 0 CA-C-N 114.13 -1.396 . . . . 0.0 109.069 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 77.9 p -58.29 -55.48 34.46 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.085 -1.009 . . . . 0.0 109.764 -179.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.473 ' HG2' ' HA2' ' A' ' 75' ' ' GLY . 0.0 OUTLIER . . . . . 0 C--N 1.285 -2.208 0 CA-C-O 117.984 -1.008 . . . . 0.0 109.411 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.758 ' HB3' ' C ' ' A' ' 21' ' ' ALA . 3.6 m . . . . . 0 N--CA 1.481 1.118 0 CA-C-O 123.024 1.392 . . . . 0.0 107.891 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.564 ' CD1' ' HB2' ' A' ' 48' ' ' ASP . 0.4 OUTLIER . . . . . 0 C--N 1.286 -2.176 0 CA-C-N 114.43 -1.259 . . . . 0.0 107.62 177.488 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.758 ' C ' ' HB3' ' A' ' 17' ' ' CYS . . . . . . . . 0 C--O 1.215 -0.761 0 CA-C-O 122.746 1.26 . . . . 0.0 108.698 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.483 ' C ' ' O ' ' A' ' 21' ' ' ALA . 17.0 p 20.14 -142.2 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 CA-C-N 113.342 -1.754 . . . . 0.0 112.397 177.599 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 32.2 t -127.21 58.47 1.45 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.849 -1.157 . . . . 0.0 111.168 -178.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.578 ' HA ' ' CH2' ' A' ' 41' ' ' TRP . 0.2 OUTLIER . . . . . 0 N--CA 1.493 1.688 0 O-C-N 121.234 -0.916 . . . . 0.0 111.229 178.372 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.595 ' O ' ' CE1' ' A' ' 31' ' ' PHE . . . . . . . . 0 N--CA 1.493 1.689 0 CA-C-O 121.011 0.434 . . . . 0.0 110.427 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.3 ptm180 . . . . . 0 N--CA 1.494 1.763 0 O-C-N 120.929 -1.107 . . . . 0.0 110.077 -179.305 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.49 HG13 ' O ' ' A' ' 27' ' ' ALA . 1.7 p . . . . . 0 N--CA 1.491 1.625 0 CA-C-O 120.932 0.396 . . . . 0.0 109.954 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.595 ' CE1' ' O ' ' A' ' 27' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.494 1.729 0 O-C-N 120.922 -1.111 . . . . 0.0 111.025 -179.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.573 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 0.8 OUTLIER . . . . . 0 N--CA 1.48 1.06 0 CA-C-O 121.472 0.653 . . . . 0.0 111.583 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.489 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 C--N 1.306 -1.296 0 N-CA-C 106.477 -1.675 . . . . 0.0 106.477 177.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.632 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 23.1 mt-30 . . . . . 0 C--O 1.205 -1.289 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.67 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -43.11 -59.35 2.08 Favored 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 117.709 -1.596 . . . . 0.0 107.317 178.502 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.481 ' O ' ' N ' ' A' ' 41' ' ' TRP . 1.0 OUTLIER . . . . . 0 N--CA 1.493 1.715 0 O-C-N 121.277 -0.89 . . . . 0.0 109.405 177.195 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.632 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 10.9 t80 . . . . . 0 N--CA 1.486 1.364 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.67 ' CD1' ' O ' ' A' ' 37' ' ' THR . 9.9 m95 -77.07 177.35 7.88 Favored 'General case' 0 C--N 1.306 -1.304 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 176.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' SER . . . . . 0.567 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 0.1 OUTLIER 62.65 110.97 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.345 0 O-C-N 120.506 -1.371 . . . . 0.0 108.625 -179.992 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.567 ' CG ' ' O ' ' A' ' 42' ' ' SER . 0.0 OUTLIER 84.59 -25.48 0.13 Allowed 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 -178.617 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.714 ' O ' ' N ' ' A' ' 46' ' ' ASP . 1.0 OUTLIER -40.6 -63.72 0.61 Allowed 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.545 -179.948 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.513 ' C ' ' O ' ' A' ' 44' ' ' TYR . 5.6 ptmt -20.84 74.35 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.557 0 CA-C-O 121.238 0.542 . . . . 0.0 111.185 -179.469 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.714 ' N ' ' O ' ' A' ' 44' ' ' TYR . 3.8 t70 -161.82 18.46 0.1 Allowed 'General case' 0 N--CA 1.486 1.341 0 O-C-N 121.238 -0.914 . . . . 0.0 109.709 -178.382 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.509 ' O ' ' CD1' ' A' ' 18' ' ' LEU . . . 67.35 11.44 59.31 Favored Glycine 0 N--CA 1.492 2.403 0 N-CA-C 107.906 -2.078 . . . . 0.0 107.906 -177.685 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.564 ' HB2' ' CD1' ' A' ' 18' ' ' LEU . 0.3 OUTLIER 71.61 5.89 5.53 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.612 -0.934 . . . . 0.0 109.785 -179.644 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.554 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 2.9 mm100 78.09 -18.38 0.51 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.312 -0.867 . . . . 0.0 111.255 178.254 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . 0.468 ' SG ' ' O ' ' A' ' 62' ' ' LYS . 0.1 OUTLIER -108.38 -18.27 13.79 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 120.756 -1.215 . . . . 0.0 110.157 -179.683 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.427 ' O ' ' HG3' ' A' ' 51' ' ' GLU . 1.9 tt0 -50.62 -20.07 1.1 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.173 -0.954 . . . . 0.0 111.238 -179.247 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.416 ' O ' ' C ' ' A' ' 53' ' ' HIS . . . -85.63 19.94 21.58 Favored Glycine 0 N--CA 1.495 2.585 0 O-C-N 120.813 -1.179 . . . . 0.0 110.867 -178.848 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.545 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 20.3 t-160 45.03 59.55 14.02 Favored Pre-proline 0 N--CA 1.492 1.647 0 O-C-N 120.892 -1.358 . . . . 0.0 109.086 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.545 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 5.5 Cg_exo -57.74 -53.11 4.88 Favored 'Trans proline' 0 C--N 1.309 -1.541 0 C-N-CA 122.658 2.239 . . . . 0.0 111.869 -179.568 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.559 ' SG ' ' CB ' ' A' ' 61' ' ' CYS . 3.6 m -60.32 175.41 0.43 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 120.836 -1.165 . . . . 0.0 110.046 -178.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.497 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 4.9 mt -148.87 -174.98 4.77 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-O 121.647 0.737 . . . . 0.0 109.121 179.198 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.634 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 54.5 m-80 39.14 64.01 0.87 Allowed 'General case' 0 C--N 1.299 -1.591 0 CA-C-O 121.886 0.851 . . . . 0.0 109.662 -179.664 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.443 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 0.2 OUTLIER 51.75 35.74 16.02 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 121.667 0.746 . . . . 0.0 109.328 178.148 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -86.99 131.12 10.38 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.775 -1.33 . . . . 0.0 109.775 -179.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.467 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 88.9 m-70 -79.43 142.26 36.07 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.309 -1.112 . . . . 0.0 108.561 179.499 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.561 ' HA ' ' HA ' ' A' ' 70' ' ' CYS . 0.1 OUTLIER -116.13 127.23 54.66 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.075 -1.016 . . . . 0.0 110.137 -179.039 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.519 ' HB3' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.36 0 N-CA-C 106.595 -1.632 . . . . 0.0 106.595 177.569 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.523 0 N-CA-C 108.389 -1.884 . . . . 0.0 108.389 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.513 HD11 ' HA ' ' A' ' 44' ' ' TYR . 35.9 mm -86.68 -66.59 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 120.744 -1.444 . . . . 0.0 110.341 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . 0.427 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . -61.19 -12.57 31.55 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 -179.544 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.45 ' HA ' HE21 ' A' ' 49' ' ' GLN . 1.5 p-10 -178.1 -157.3 0.04 OUTLIER 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.201 -1.176 . . . . 0.0 110.357 179.378 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.697 ' N ' ' CD1' ' A' ' 68' ' ' TYR . 2.0 p90 -156.15 -160.37 1.0 Allowed 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -178.632 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.519 ' OG1' ' HB3' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -151.04 177.67 9.94 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 177.955 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . 0.561 ' HA ' ' HA ' ' A' ' 61' ' ' CYS . 1.3 m -137.09 -174.47 3.75 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 120.674 -1.266 . . . . 0.0 109.4 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.467 ' HB ' ' HB2' ' A' ' 60' ' ' HIS . 0.7 OUTLIER -161.09 123.63 3.14 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 179.362 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.479 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 84.7 m -97.84 140.34 32.36 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.93 -1.106 . . . . 0.0 109.571 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.583 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . . . -73.76 -176.39 2.39 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.073 -1.017 . . . . 0.0 110.659 -179.621 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -81.45 102.31 10.45 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-O 123.119 1.438 . . . . 0.0 108.265 178.362 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . 0.464 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 123.31 17.57 3.24 Favored Glycine 0 C--N 1.268 -3.238 0 CA-C-N 113.765 -1.561 . . . . 0.0 109.459 -179.332 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.634 ' CE2' ' O ' ' A' ' 57' ' ' ASN . 4.8 m-85 -119.92 167.79 11.79 Favored 'General case' 0 C--N 1.294 -1.805 0 O-C-N 121.44 -1.035 . . . . 0.0 109.578 -178.316 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.502 ' CB ' ' HB2' ' A' ' 83' ' ' PHE . 3.7 mt-10 -160.41 171.01 19.83 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.038 -1.039 . . . . 0.0 110.355 -179.658 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.33 169.01 40.41 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 179.573 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.435 ' HD3' ' C ' ' A' ' 79' ' ' LYS . 1.0 OUTLIER -57.89 -55.81 30.1 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.303 -1.116 . . . . 0.0 109.318 179.897 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.497 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.2 OUTLIER -95.56 25.46 4.5 Favored 'General case' 0 C--N 1.287 -2.119 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.585 179.999 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . 0.507 ' O ' ' ND2' ' A' ' 57' ' ' ASN . 6.6 m 69.7 11.6 7.9 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.84 -1.163 . . . . 0.0 109.021 -179.619 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.475 ' HA ' ' ND2' ' A' ' 57' ' ' ASN . 26.7 tt0 -42.06 -47.4 4.49 Favored 'General case' 0 N--CA 1.489 1.517 0 CA-C-O 121.446 0.641 . . . . 0.0 111.39 -179.71 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.619 ' N ' ' CD1' ' A' ' 83' ' ' PHE . 0.6 OUTLIER -79.77 84.63 5.54 Favored 'General case' 0 C--N 1.295 -1.794 0 O-C-N 121.223 -0.923 . . . . 0.0 110.66 -178.328 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.453 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 3.9 p -67.42 94.5 0.4 Allowed 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.583 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.446 ' OG1' ' HA2' ' A' ' 75' ' ' GLY . 18.5 p -54.92 -21.38 11.44 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.172 -0.955 . . . . 0.0 109.924 -179.041 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 . . . . . 0 C--N 1.289 -2.044 0 CA-C-O 118.033 -0.985 . . . . 0.0 109.556 -179.899 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.499 ' HA ' ' HB2' ' A' ' 21' ' ' ALA . 28.2 m . . . . . 0 N--CA 1.493 1.697 0 CA-C-O 120.499 0.19 . . . . 0.0 111.199 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.475 HD23 ' OD2' ' A' ' 48' ' ' ASP . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.505 0 C-N-CA 118.641 -1.224 . . . . 0.0 108.061 179.252 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.499 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . . . . . . . . 0 N--CA 1.496 1.865 0 CA-C-O 121.503 0.668 . . . . 0.0 110.07 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.488 ' HB2' ' HB3' ' A' ' 17' ' ' CYS . 1.4 m -149.57 168.59 23.11 Favored 'General case' 0 C--N 1.292 -1.909 0 O-C-N 121.549 -0.719 . . . . 0.0 109.178 178.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.548 ' O ' ' CB ' ' A' ' 24' ' ' LEU . 0.7 OUTLIER -85.29 31.62 0.57 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.158 -0.964 . . . . 0.0 110.502 -178.986 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.548 ' CB ' ' O ' ' A' ' 23' ' ' SER . 0.1 OUTLIER . . . . . 0 N--CA 1.495 1.809 0 O-C-N 121.409 -0.807 . . . . 0.0 110.31 179.665 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 121.311 0.577 . . . . 0.0 110.213 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.516 ' O ' ' CG ' ' A' ' 28' ' ' ARG . 26.3 ptt180 . . . . . 0 C--N 1.3 -1.577 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 178.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.1 t . . . . . 0 N--CA 1.485 1.292 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.693 ' CD1' ' N ' ' A' ' 31' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.304 -1.397 0 O-C-N 121.381 -0.825 . . . . 0.0 109.772 -179.695 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.617 ' HB2' ' CD2' ' A' ' 31' ' ' PHE . 0.9 OUTLIER . . . . . 0 N--CA 1.488 1.442 0 CA-C-O 121.379 0.609 . . . . 0.0 110.57 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.475 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 N--CA 1.486 1.361 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 179.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.68 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 65.8 mt-30 . . . . . 0 C--O 1.202 -1.41 0 N-CA-C 108.261 -1.015 . . . . 0.0 108.261 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.647 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -42.54 -59.3 1.94 Allowed 'General case' 0 N--CA 1.499 2.014 0 O-C-N 119.797 -1.814 . . . . 0.0 107.571 178.4 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . 0.477 ' O ' ' O ' ' A' ' 41' ' ' TRP . 2.0 t70 . . . . . 0 N--CA 1.491 1.619 0 O-C-N 121.43 -0.794 . . . . 0.0 109.305 177.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.68 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 18.5 t80 . . . . . 0 N--CA 1.493 1.685 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.647 ' CD1' ' O ' ' A' ' 37' ' ' THR . 9.1 m95 -80.99 172.02 14.26 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.878 -0.514 . . . . 0.0 109.857 178.505 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 76.47 -59.8 0.49 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.532 -0.73 . . . . 0.0 112.254 177.632 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.74 11.05 39.43 Favored 'General case' 0 C--N 1.28 -2.432 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 178.489 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.607 ' O ' ' N ' ' A' ' 46' ' ' ASP . 0.8 OUTLIER -56.9 -76.22 0.04 OUTLIER 'General case' 0 C--N 1.307 -1.248 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 179.589 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.549 ' C ' ' O ' ' A' ' 44' ' ' TYR . 7.1 mttt 9.85 55.55 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.419 0 CA-C-O 121.172 0.511 . . . . 0.0 112.144 179.095 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.607 ' N ' ' O ' ' A' ' 44' ' ' TYR . 0.9 OUTLIER -156.35 8.55 0.22 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.131 -0.981 . . . . 0.0 110.056 -179.667 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.571 ' O ' ' CB ' ' A' ' 48' ' ' ASP . . . 86.03 -48.46 3.95 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 108.636 -1.785 . . . . 0.0 108.636 -179.147 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.571 ' CB ' ' O ' ' A' ' 47' ' ' GLY . 16.1 p-10 140.42 -10.04 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.247 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 179.561 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.594 ' NE2' ' O ' ' A' ' 65' ' ' ILE . 0.0 OUTLIER 77.78 -15.99 0.7 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.754 -0.591 . . . . 0.0 110.858 -179.547 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . 0.476 ' HB3' ' OD2' ' A' ' 48' ' ' ASP . 20.2 t -99.23 -21.09 16.26 Favored 'General case' 0 N--CA 1.487 1.403 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 176.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.469 ' HB2' ' OD1' ' A' ' 48' ' ' ASP . 21.9 tt0 -58.93 148.89 28.74 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 121.319 -0.863 . . . . 0.0 108.899 179.248 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.457 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . 102.2 -22.25 38.57 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 109.357 -1.497 . . . . 0.0 109.357 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.538 ' CE1' ' O ' ' A' ' 55' ' ' CYS . 0.6 OUTLIER 68.8 58.24 0.64 Allowed Pre-proline 0 N--CA 1.49 1.56 0 O-C-N 121.456 -1.026 . . . . 0.0 109.847 -179.954 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.529 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 3.2 Cg_exo -57.05 -35.09 98.8 Favored 'Trans proline' 0 C--N 1.31 -1.494 0 C-N-CA 122.36 2.04 . . . . 0.0 110.317 179.327 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.538 ' O ' ' CE1' ' A' ' 53' ' ' HIS . 0.2 OUTLIER -75.28 164.2 26.69 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.576 -0.703 . . . . 0.0 109.197 -179.617 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.495 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.8 mt -145.0 -175.34 4.65 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.241 -0.912 . . . . 0.0 110.037 179.724 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.602 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 0.9 OUTLIER 42.59 63.63 1.38 Allowed 'General case' 0 C--N 1.299 -1.605 0 CA-C-O 121.931 0.872 . . . . 0.0 109.143 -179.965 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.427 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 0.2 OUTLIER 51.61 32.66 9.45 Favored 'General case' 0 C--N 1.301 -1.532 0 C-N-CA 119.934 -0.706 . . . . 0.0 109.771 177.938 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -82.2 139.35 19.66 Favored Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.367 -1.493 . . . . 0.0 109.367 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -79.76 149.69 31.03 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.264 -1.139 . . . . 0.0 109.095 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.463 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 44.3 t -116.12 124.78 51.21 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.106 -0.996 . . . . 0.0 110.144 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.517 ' HB2' ' OG1' ' A' ' 69' ' ' THR . 80.5 mttt . . . . . 0 C--N 1.302 -1.482 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 177.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.651 ' O ' ' N ' ' A' ' 66' ' ' GLY . . . . . . . . 0 N--CA 1.492 2.385 0 N-CA-C 109.121 -1.592 . . . . 0.0 109.121 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.594 ' O ' ' NE2' ' A' ' 49' ' ' GLN . 0.6 OUTLIER 19.74 -71.01 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.511 2.611 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -178.726 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . 0.651 ' N ' ' O ' ' A' ' 64' ' ' GLY . . . -32.7 -36.33 0.04 OUTLIER Glycine 0 N--CA 1.502 3.05 0 N-CA-C 109.222 -1.551 . . . . 0.0 109.222 -179.295 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.555 ' N ' ' O ' ' A' ' 65' ' ' ILE . 3.1 p-10 175.84 -162.87 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 177.584 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.644 ' N ' ' CD1' ' A' ' 68' ' ' TYR . 1.0 OUTLIER -131.18 -176.48 4.03 Favored 'General case' 0 C--N 1.291 -1.971 0 O-C-N 121.01 -1.056 . . . . 0.0 108.341 179.934 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.517 ' OG1' ' HB2' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -148.5 109.83 4.39 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 120.821 -1.174 . . . . 0.0 109.537 179.342 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 66.8 m -84.47 -174.15 5.12 Favored 'General case' 0 C--N 1.292 -1.904 0 CA-C-O 122.149 0.976 . . . . 0.0 109.608 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 10.3 m -161.35 144.21 12.41 Favored 'General case' 0 C--N 1.286 -2.195 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.31 179.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . 0.503 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 99.1 m -106.81 134.31 50.15 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.144 -0.973 . . . . 0.0 108.991 179.522 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.613 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . . . -64.92 -175.12 0.17 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.943 -1.098 . . . . 0.0 111.076 -179.092 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -81.5 101.56 10.0 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-O 123.114 1.435 . . . . 0.0 108.307 178.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . 0.484 ' O ' ' OG1' ' A' ' 85' ' ' THR . . . 120.3 16.54 4.71 Favored Glycine 0 C--N 1.269 -3.192 0 N-CA-C 109.146 -1.581 . . . . 0.0 109.146 -179.23 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.613 ' CE1' ' HB2' ' A' ' 73' ' ' ALA . 4.2 m-85 -113.31 164.38 13.64 Favored 'General case' 0 C--N 1.293 -1.856 0 O-C-N 121.443 -1.034 . . . . 0.0 109.23 -178.434 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.481 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 0.0 OUTLIER -160.52 170.11 21.59 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.004 -1.06 . . . . 0.0 110.335 -179.372 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 97.2 173.36 34.19 Favored Glycine 0 N--CA 1.488 2.14 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 179.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.3 tmtt? -60.2 -57.8 11.24 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.343 -1.092 . . . . 0.0 109.234 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.495 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 1.0 OUTLIER -98.59 27.47 4.81 Favored 'General case' 0 C--N 1.287 -2.113 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 179.428 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . 0.481 ' HA ' ' O ' ' A' ' 77' ' ' GLU . 4.6 m 71.71 7.83 6.0 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.99 -1.069 . . . . 0.0 109.422 -179.898 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.424 ' C ' ' O ' ' A' ' 81' ' ' CYS . 41.1 tt0 -36.34 -44.62 0.43 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.542 -0.724 . . . . 0.0 111.489 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.607 ' N ' ' CD1' ' A' ' 83' ' ' PHE . 0.9 OUTLIER -80.47 86.82 5.73 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.269 -0.894 . . . . 0.0 110.424 -178.607 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.544 ' CB ' ' OD1' ' A' ' 57' ' ' ASN . 0.2 OUTLIER -74.66 92.2 2.42 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.416 -0.802 . . . . 0.0 109.164 179.345 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.484 ' OG1' ' O ' ' A' ' 75' ' ' GLY . 10.5 p -72.61 -14.4 61.6 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.22 -0.925 . . . . 0.0 109.694 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.451 ' HD3' ' CZ ' ' A' ' 76' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.78 0 CA-C-O 117.995 -1.002 . . . . 0.0 109.633 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.677 ' O ' ' SG ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 124.013 1.863 . . . . 0.0 107.991 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.483 HD11 ' O ' ' A' ' 18' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--N 1.29 -1.987 0 O-C-N 120.857 -1.152 . . . . 0.0 109.319 178.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.44 0 CA-C-O 121.205 0.526 . . . . 0.0 109.766 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' CYS . . . . . 0.526 ' O ' ' CB ' ' A' ' 23' ' ' SER . 11.5 t -150.82 -47.67 0.12 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.334 -0.854 . . . . 0.0 110.341 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.558 ' O ' ' CB ' ' A' ' 24' ' ' LEU . 7.8 t 84.26 -2.46 1.03 Allowed 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 -178.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.558 ' CB ' ' O ' ' A' ' 23' ' ' SER . 0.4 OUTLIER . . . . . 0 N--CA 1.495 1.806 0 O-C-N 121.614 -0.679 . . . . 0.0 110.436 179.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.59 ' O ' ' CD1' ' A' ' 31' ' ' PHE . . . . . . . . 0 N--CA 1.493 1.703 0 CA-C-O 121.11 0.481 . . . . 0.0 109.814 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 . . . . . 0 N--CA 1.494 1.738 0 O-C-N 120.934 -1.104 . . . . 0.0 110.654 -179.27 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.464 ' CG1' ' O ' ' A' ' 30' ' ' VAL . 0.9 OUTLIER . . . . . 0 N--CA 1.495 1.824 0 CA-C-O 120.881 0.372 . . . . 0.0 110.125 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.59 ' CD1' ' O ' ' A' ' 27' ' ' ALA . 25.7 m-85 . . . . . 0 C--N 1.301 -1.535 0 O-C-N 120.893 -1.129 . . . . 0.0 111.055 -178.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.527 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 3.9 m-20 . . . . . 0 N--CA 1.482 1.157 0 CA-C-O 121.151 0.501 . . . . 0.0 110.325 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.521 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 N--CA 1.488 1.426 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 178.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . 0.639 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 2.3 mm100 . . . . . 0 C--O 1.205 -1.278 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.671 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.2 OUTLIER -46.12 -59.0 3.14 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.259 -1.526 . . . . 0.0 107.797 178.952 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.0 t70 . . . . . 0 C--N 1.298 -1.665 0 O-C-N 121.17 -0.956 . . . . 0.0 109.91 178.733 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.639 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 6.4 t80 . . . . . 0 N--CA 1.485 1.325 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.671 ' CD1' ' O ' ' A' ' 37' ' ' THR . 6.8 m95 -80.35 -67.5 0.76 Allowed 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.452 -0.78 . . . . 0.0 112.304 -178.611 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -57.34 -50.08 74.08 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.516 -1.365 . . . . 0.0 110.356 -177.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LYS . . . . . 0.505 ' HD3' HG21 ' A' ' 65' ' ' ILE . 0.7 OUTLIER -81.87 2.14 31.75 Favored 'General case' 0 C--N 1.287 -2.136 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 179.624 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . 0.687 ' O ' ' N ' ' A' ' 46' ' ' ASP . 1.0 OUTLIER -46.43 -70.39 0.1 Allowed 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.379 -0.826 . . . . 0.0 109.182 -179.913 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.542 ' C ' ' O ' ' A' ' 44' ' ' TYR . 3.1 ptmt -9.75 69.05 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.647 0 CA-C-O 121.366 0.603 . . . . 0.0 111.797 -179.481 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.687 ' N ' ' O ' ' A' ' 44' ' ' TYR . 2.4 t0 -162.13 -30.44 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.4 -0.813 . . . . 0.0 110.077 -179.109 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.48 ' O ' ' OD2' ' A' ' 48' ' ' ASP . . . 98.61 13.97 39.23 Favored Glycine 0 N--CA 1.486 2.003 0 N-CA-C 107.83 -2.108 . . . . 0.0 107.83 -177.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.609 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER 74.6 11.35 3.94 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.784 -0.833 . . . . 0.0 109.358 -179.628 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.655 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 34.5 mm-40 73.85 -10.79 1.04 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.807 -0.558 . . . . 0.0 111.125 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 15.0 t -114.83 -11.45 12.24 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.665 -1.272 . . . . 0.0 110.088 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.44 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 53.5 tt0 -74.12 152.73 39.81 Favored 'General case' 0 N--CA 1.483 1.223 0 O-C-N 120.888 -1.132 . . . . 0.0 109.135 179.884 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.454 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . 94.27 -14.07 66.05 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . 0.454 ' HB3' ' O ' ' A' ' 52' ' ' GLY . 1.2 t60 68.42 69.6 0.44 Allowed Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.336 -1.096 . . . . 0.0 109.343 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' PRO . . . . . 0.439 ' HG2' ' SG ' ' A' ' 61' ' ' CYS . 5.7 Cg_exo -59.67 -39.83 70.35 Favored 'Trans proline' 0 C--N 1.31 -1.479 0 C-N-CA 122.45 2.1 . . . . 0.0 110.61 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.492 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 0.6 OUTLIER -84.77 177.89 7.85 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.338 -0.851 . . . . 0.0 109.302 -179.863 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.507 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.5 mt -140.08 -175.37 4.22 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 179.199 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ASN . . . . . 0.576 ' HB3' ' CD2' ' A' ' 76' ' ' PHE . 4.9 m-80 48.49 56.43 7.53 Favored 'General case' 0 C--N 1.296 -1.729 0 CA-C-O 121.718 0.771 . . . . 0.0 110.943 178.013 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 47.06 30.15 1.25 Allowed 'General case' 0 C--N 1.301 -1.507 0 CA-C-O 121.439 0.638 . . . . 0.0 109.873 177.455 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -79.08 150.92 34.49 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.198 -1.561 . . . . 0.0 109.198 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.482 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 3.1 t60 -79.64 156.47 27.6 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.98 -1.306 . . . . 0.0 108.772 179.585 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' CYS . . . . . 0.492 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 0.6 OUTLIER -124.56 116.98 23.32 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.18 -0.95 . . . . 0.0 109.948 -179.082 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.472 ' HB3' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.301 -1.523 0 N-CA-C 106.91 -1.515 . . . . 0.0 106.91 177.755 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLY . . . . . 0.574 ' O ' ' O ' ' A' ' 67' ' ' ASP . . . . . . . . 0 N--CA 1.493 2.479 0 N-CA-C 108.079 -2.008 . . . . 0.0 108.079 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ILE . . . . . 0.568 ' CG2' ' N ' ' A' ' 66' ' ' GLY . 0.0 OUTLIER -51.76 -61.94 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 119.881 -1.952 . . . . 0.0 109.316 -179.136 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . 0.568 ' N ' ' CG2' ' A' ' 65' ' ' ILE . . . -43.19 -50.1 6.47 Favored Glycine 0 N--CA 1.493 2.482 0 N-CA-C 109.964 -1.254 . . . . 0.0 109.964 -179.34 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ASP . . . . . 0.574 ' O ' ' O ' ' A' ' 64' ' ' GLY . 6.4 p-10 -164.89 -147.8 0.1 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.41 -1.053 . . . . 0.0 109.278 179.71 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.655 ' CD1' ' HB3' ' A' ' 49' ' ' GLN . 2.5 p90 -159.8 -165.15 1.45 Allowed 'General case' 0 C--N 1.296 -1.751 0 O-C-N 120.501 -1.374 . . . . 0.0 109.352 -179.45 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.472 ' OG1' ' HB3' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -149.43 -177.48 5.88 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 107.324 -1.362 . . . . 0.0 107.324 178.989 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.7 m -139.61 -173.29 3.58 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 120.601 -1.312 . . . . 0.0 108.563 179.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.482 ' HB ' ' HB3' ' A' ' 60' ' ' HIS . 1.5 m -161.08 139.92 10.08 Favored 'General case' 0 C--N 1.292 -1.931 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 179.334 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 95.0 m -104.15 141.99 35.28 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.952 -1.093 . . . . 0.0 109.365 179.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.408 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . . . -77.16 177.66 7.67 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.222 -0.924 . . . . 0.0 109.8 -179.756 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -80.56 102.34 9.71 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-O 123.399 1.571 . . . . 0.0 107.839 178.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . 0.632 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 127.27 25.58 1.17 Allowed Glycine 0 C--N 1.267 -3.302 0 CA-C-N 113.299 -1.773 . . . . 0.0 109.896 -179.556 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.632 ' CD1' ' C ' ' A' ' 75' ' ' GLY . 58.2 m-85 -141.37 159.88 41.28 Favored 'General case' 0 C--N 1.287 -2.115 0 O-C-N 121.174 -1.192 . . . . 0.0 110.05 -177.815 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . 0.498 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 2.5 mt-10 -150.36 175.21 12.04 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.172 -0.955 . . . . 0.0 110.239 -178.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 95.47 168.02 35.48 Favored Glycine 0 N--CA 1.491 2.327 0 N-CA-C 110.191 -1.164 . . . . 0.0 110.191 179.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.455 ' HD3' ' C ' ' A' ' 79' ' ' LYS . 4.6 tmtt? -55.86 -57.77 10.65 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.466 -1.02 . . . . 0.0 109.158 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ASN . . . . . 0.507 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 1.1 m-20 -94.43 25.86 3.69 Favored 'General case' 0 C--N 1.287 -2.113 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 179.418 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . 0.527 ' HB2' ' HB2' ' A' ' 57' ' ' ASN . 4.1 m 66.36 14.85 9.89 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 120.818 -1.176 . . . . 0.0 108.41 -179.211 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -46.53 -42.44 15.77 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.769 -0.582 . . . . 0.0 112.122 -179.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.607 ' N ' ' CD1' ' A' ' 83' ' ' PHE . 0.8 OUTLIER -79.32 85.09 5.18 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.169 -0.957 . . . . 0.0 111.135 -178.035 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' SER . . . . . 0.546 ' CB ' ' OD1' ' A' ' 57' ' ' ASN . 0.4 OUTLIER -68.64 109.27 3.7 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 178.232 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.46 ' O ' ' C ' ' A' ' 86' ' ' ARG . 33.3 p -92.02 -32.91 15.03 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.997 -1.064 . . . . 0.0 109.807 -179.334 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ARG . . . . . 0.46 ' C ' ' O ' ' A' ' 85' ' ' THR . 0.1 OUTLIER . . . . . 0 C--N 1.289 -2.05 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.202 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.456 ' O ' ' OG ' ' A' ' 3' ' ' SER . 40.6 m-20 -108.8 115.07 29.38 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.223 -0.923 . . . . 0.0 109.384 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.456 ' OG ' ' O ' ' A' ' 2' ' ' ASN . 2.2 m -167.06 -135.35 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.258 -0.901 . . . . 0.0 109.458 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.46 ' CE2' ' O ' ' A' ' 21' ' ' ALA . 50.3 p90 -55.52 -16.92 4.39 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.927 -1.108 . . . . 0.0 109.49 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.528 ' O ' ' C ' ' A' ' 6' ' ' CGU . 0.0 OUTLIER -76.56 -42.09 44.1 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.187 -0.946 . . . . 0.0 109.791 -179.912 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' CGU . . . . . 0.528 ' C ' ' O ' ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' CGU . . . . . 0.513 ' O ' ' N ' ' A' ' 9' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.54 ' CG2' ' O ' ' A' ' 8' ' ' VAL . 20.6 m -39.93 96.06 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.307 -1.255 0 CA-C-O 122.166 0.984 . . . . 0.0 109.895 -178.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.513 ' N ' ' O ' ' A' ' 7' ' ' CGU . 1.0 OUTLIER -44.73 -28.37 0.61 Allowed 'General case' 0 C--N 1.284 -2.257 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 179.123 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.486 ' HB2' ' O ' ' A' ' 9' ' ' LYS . 0.3 OUTLIER 168.03 130.98 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 179.441 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -108.39 122.4 6.65 Favored Glycine 0 N--CA 1.491 2.348 0 C-N-CA 119.84 -1.171 . . . . 0.0 110.186 -179.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.549 ' HB3' ' CB ' ' A' ' 16' ' ' CGU . 15.7 t30 -109.93 -172.63 2.08 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.225 -1.162 . . . . 0.0 108.847 179.469 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.521 HD22 ' N ' ' A' ' 13' ' ' LEU . 0.9 OUTLIER -77.18 -125.69 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.211 0 O-C-N 120.836 -1.165 . . . . 0.0 109.4 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' CGU . . . . . 0.66 ' CD2' ' CE1' ' A' ' 44' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 65.7 mtm180 -76.73 -45.62 28.57 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.108 -0.995 . . . . 0.0 110.229 -179.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' CGU . . . . . 0.589 ' C ' ' CD1' ' A' ' 16' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.468 ' HA ' ' HB1' ' A' ' 21' ' ' ALA . 84.9 m -84.56 42.51 0.91 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.103 -0.998 . . . . 0.0 109.758 -179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.517 HD13 ' CB ' ' A' ' 48' ' ' ASP . 0.2 OUTLIER -81.75 -19.07 42.13 Favored 'General case' 0 C--N 1.299 -1.622 0 CA-C-O 121.795 0.807 . . . . 0.0 110.018 -179.677 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.468 ' HB1' ' HA ' ' A' ' 17' ' ' CYS . . . -48.82 -54.11 16.51 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 179.207 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.487 ' HB3' ' HB2' ' A' ' 26' ' ' CGU . 0.5 OUTLIER -151.98 -170.35 3.62 Favored 'General case' 0 C--N 1.289 -2.024 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.936 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 35.5 p -175.96 -35.27 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.605 ' CD2' ' CE2' ' A' ' 41' ' ' TRP . 0.4 OUTLIER -165.21 -36.99 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 179.591 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' CGU . . . . . 0.494 ' O ' ' HG2' ' A' ' 28' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' CGU . . . . . 0.527 OE11 ' CG1' ' A' ' 8' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.31 55.18 2.79 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.977 -1.077 . . . . 0.0 110.602 -179.3 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.558 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 24.6 ptt180 -153.21 121.44 6.21 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 106.634 -1.617 . . . . 0.0 106.634 177.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' CGU . . . . . 0.535 ' HB3' ' O ' ' A' ' 28' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.4 t -78.96 -22.28 12.76 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 179.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.7 ' CD1' ' N ' ' A' ' 31' ' ' PHE . 0.0 OUTLIER -123.92 154.94 39.02 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' CGU . . . . . 0.541 ' O ' ' N ' ' A' ' 34' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.629 ' HB2' ' CB ' ' A' ' 36' ' ' GLN . 50.7 p-10 -37.71 88.45 0.0 OUTLIER 'General case' 0 C--N 1.299 -1.613 0 CA-C-O 121.211 0.529 . . . . 0.0 111.559 -178.553 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.541 ' N ' ' O ' ' A' ' 32' ' ' CGU . . . -81.05 -54.92 5.13 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.272 -0.892 . . . . 0.0 109.056 178.671 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' CGU . . . . . 0.454 ' C ' ' N ' ' A' ' 37' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.744 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 2.0 mt-30 -51.19 -28.12 10.53 Favored 'General case' 0 C--O 1.2 -1.522 0 N-CA-C 105.907 -1.886 . . . . 0.0 105.907 177.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.753 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 40.7 p -41.37 -59.46 1.55 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 120.045 -1.659 . . . . 0.0 106.763 177.037 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.582 ' O ' ' C ' ' A' ' 39' ' ' CGU . 0.4 OUTLIER -82.22 -65.06 1.06 Allowed 'General case' 0 C--N 1.287 -2.109 0 O-C-N 121.166 -0.959 . . . . 0.0 109.745 177.152 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' CGU . . . . . 0.582 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.744 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 12.5 t80 -41.51 -57.55 2.19 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 177.731 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.753 ' CD1' ' O ' ' A' ' 37' ' ' THR . 7.6 m95 -80.63 -171.0 2.88 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 177.239 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.599 ' O ' ' CB ' ' A' ' 43' ' ' LYS . 54.8 p 42.13 87.74 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.874 0 O-C-N 120.577 -1.327 . . . . 0.0 109.904 179.098 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.599 ' CB ' ' O ' ' A' ' 42' ' ' SER . 4.9 ptpt 115.19 5.55 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 -179.27 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.66 ' CE1' ' CD2' ' A' ' 14' ' ' CGU . 0.7 OUTLIER -80.7 -95.34 0.04 OUTLIER 'General case' 0 C--O 1.206 -1.212 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 179.489 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.599 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.0 OUTLIER 12.61 55.3 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.597 0 CA-C-O 121.326 0.584 . . . . 0.0 111.17 179.346 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.599 ' N ' ' O ' ' A' ' 44' ' ' TYR . 11.6 t0 -143.98 16.76 1.76 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.325 -0.859 . . . . 0.0 108.979 -178.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.523 ' O ' ' CB ' ' A' ' 48' ' ' ASP . . . 75.29 2.86 68.53 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 107.86 -2.096 . . . . 0.0 107.86 -177.477 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.588 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER 88.55 7.16 0.16 Allowed 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -179.358 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.717 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 1.6 mt-30 72.47 -23.44 0.2 Allowed 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 120.403 -0.519 . . . . 0.0 112.275 178.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . 0.495 ' HB2' ' OB ' ' A' ' 63' ' ' BHD . 17.1 t -93.55 -21.24 19.56 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 120.632 -1.292 . . . . 0.0 107.727 178.311 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -55.99 139.65 45.86 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 179.105 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 101.65 -13.04 58.1 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.416 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 31.7 t60 65.85 63.33 0.99 Allowed Pre-proline 0 N--CA 1.489 1.486 0 O-C-N 121.333 -1.098 . . . . 0.0 109.968 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.45 ' HD3' ' O ' ' A' ' 50' ' ' CYS . 3.5 Cg_exo -60.77 -39.35 63.6 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 C-N-CA 122.25 1.966 . . . . 0.0 110.167 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.469 ' SG ' ' O ' ' A' ' 60' ' ' HIS . 1.9 m -78.42 162.24 26.55 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.56 -0.712 . . . . 0.0 109.372 -179.466 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.515 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 6.0 mt -145.57 -173.85 4.24 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.994 -1.066 . . . . 0.0 110.658 -179.299 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.603 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 0.9 OUTLIER 43.83 64.51 1.25 Allowed 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 121.831 0.824 . . . . 0.0 108.99 -179.486 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.445 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 5.2 mm-40 51.14 31.02 6.13 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.226 177.715 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . 0.416 ' HA2' ' O ' ' A' ' 71' ' ' THR . . . -83.05 141.61 20.9 Favored Glycine 0 N--CA 1.488 2.135 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.469 ' O ' ' SG ' ' A' ' 55' ' ' CYS . 97.8 m-70 -79.23 -164.04 0.57 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.219 -1.165 . . . . 0.0 108.059 179.16 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.465 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 12.5 t -160.77 120.03 2.64 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.553 -1.342 . . . . 0.0 110.922 -179.393 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.29 102.49 11.79 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 178.132 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' BHD . . . . . 0.495 ' OB ' ' HB2' ' A' ' 50' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.591 ' O ' ' O ' ' A' ' 65' ' ' ILE . . . 132.04 43.84 0.16 Allowed Glycine 0 N--CA 1.495 2.599 0 C-N-CA 120.404 -0.903 . . . . 0.0 111.459 179.314 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.604 ' CG2' ' HA ' ' A' ' 44' ' ' TYR . 2.4 pp 34.59 -165.22 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.511 2.585 0 CA-C-N 118.299 1.049 . . . . 0.0 109.964 -179.184 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . 0.549 ' N ' HD11 ' A' ' 65' ' ' ILE . . . 47.51 30.67 6.38 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 106.326 -2.71 . . . . 0.0 106.326 -178.248 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.602 ' OD1' ' N ' ' A' ' 68' ' ' TYR . 0.4 OUTLIER 85.58 -171.75 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.507 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 -176.287 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.717 ' CD1' ' HB3' ' A' ' 49' ' ' GLN . 1.0 OUTLIER -137.67 -162.14 1.26 Allowed 'General case' 0 C--N 1.285 -2.229 0 O-C-N 120.345 -1.472 . . . . 0.0 108.376 -178.218 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -148.76 165.22 32.07 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 178.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 61' ' ' CYS . 22.6 m -132.05 -165.57 1.61 Allowed 'General case' 0 C--N 1.293 -1.856 0 O-C-N 120.637 -1.29 . . . . 0.0 108.019 179.274 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.462 ' HB ' ' HB2' ' A' ' 60' ' ' HIS . 0.7 OUTLIER -160.15 118.41 2.65 Favored 'General case' 0 C--N 1.297 -1.705 0 O-C-N 121.1 -1.0 . . . . 0.0 109.618 179.516 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.505 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 59.3 m -96.76 139.56 32.64 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.137 -0.977 . . . . 0.0 109.33 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.605 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . . . -71.64 -176.05 1.5 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.114 -0.991 . . . . 0.0 110.467 -179.6 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -81.42 102.02 10.23 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-O 123.149 1.452 . . . . 0.0 108.152 178.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . 0.454 ' O ' ' OG1' ' A' ' 85' ' ' THR . . . 121.21 21.7 3.04 Favored Glycine 0 C--N 1.268 -3.236 0 CA-C-N 113.663 -1.608 . . . . 0.0 109.195 -179.122 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.605 ' CE1' ' HB2' ' A' ' 73' ' ' ALA . 4.7 m-85 -116.43 166.22 12.33 Favored 'General case' 0 C--N 1.295 -1.801 0 O-C-N 121.581 -0.952 . . . . 0.0 109.423 -178.225 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.478 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 3.6 mt-10 -159.95 170.76 20.69 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 120.775 -1.203 . . . . 0.0 110.458 -179.331 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.83 166.0 39.6 Favored Glycine 0 N--CA 1.489 2.2 0 N-CA-C 109.678 -1.369 . . . . 0.0 109.678 179.608 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.451 ' HD3' ' C ' ' A' ' 79' ' ' LYS . 2.3 tmtt? -55.77 -56.19 23.39 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.255 -1.144 . . . . 0.0 109.139 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.515 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.9 OUTLIER -94.06 30.19 1.95 Allowed 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 179.856 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.485 ' O ' ' HB2' ' A' ' 57' ' ' ASN . 3.1 m 61.2 14.43 5.54 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.867 -1.146 . . . . 0.0 108.622 -179.527 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -44.5 -46.54 9.8 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.601 -0.687 . . . . 0.0 111.456 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.601 ' N ' ' CD1' ' A' ' 83' ' ' PHE . 0.5 OUTLIER -81.16 84.45 6.55 Favored 'General case' 0 C--N 1.297 -1.687 0 O-C-N 121.401 -0.812 . . . . 0.0 110.751 -178.406 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.518 ' N ' ' OD1' ' A' ' 57' ' ' ASN . 0.1 OUTLIER -66.73 94.42 0.3 Allowed 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 178.473 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.459 ' OG1' ' HG3' ' A' ' 86' ' ' ARG . 20.0 p -49.05 -29.62 5.28 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.185 -0.947 . . . . 0.0 110.239 -178.729 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.459 ' HG3' ' OG1' ' A' ' 85' ' ' THR . 9.4 mtp180 . . . . . 0 C--N 1.289 -2.055 0 CA-C-O 117.995 -1.003 . . . . 0.0 109.642 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -102.38 -29.46 11.63 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.277 -0.889 . . . . 0.0 109.419 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -47.74 133.27 13.97 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.229 -0.92 . . . . 0.0 109.538 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.485 ' C ' ' CD1' ' A' ' 4' ' ' PHE . 0.1 OUTLIER -80.3 9.34 5.88 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.156 -0.965 . . . . 0.0 110.212 -179.752 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.507 ' O ' ' C ' ' A' ' 6' ' ' CGU . 0.4 OUTLIER -61.16 -40.36 93.59 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 120.946 -1.096 . . . . 0.0 109.568 -179.761 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' CGU . . . . . 0.507 ' C ' ' O ' ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' CGU . . . . . 0.461 ' O ' ' C ' ' A' ' 8' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.554 ' CG2' ' O ' ' A' ' 8' ' ' VAL . 11.7 m -39.59 99.12 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.309 -1.177 0 CA-C-O 122.516 1.15 . . . . 0.0 109.634 -178.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.59 ' O ' ' CB ' ' A' ' 10' ' ' GLN . 2.3 tttp -50.3 -18.85 0.68 Allowed 'General case' 0 C--N 1.286 -2.166 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.57 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.59 ' CB ' ' O ' ' A' ' 9' ' ' LYS . 30.6 tt0 89.76 58.26 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.863 0 CA-C-O 121.247 0.546 . . . . 0.0 109.569 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -142.02 17.74 2.55 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.589 -1.405 . . . . 0.0 109.589 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.567 ' O ' ' CE1' ' A' ' 31' ' ' PHE . 5.0 m-80 -88.87 51.99 2.3 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.247 -1.149 . . . . 0.0 109.622 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.53 ' C ' ' CE2' ' A' ' 31' ' ' PHE . 0.1 OUTLIER -125.1 8.27 7.96 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-O 121.769 0.795 . . . . 0.0 109.373 179.915 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.627 ' C ' ' H ' ' A' ' 17' ' ' CYS . 50.1 mtm180 -82.31 99.12 9.15 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 177.121 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' CGU . . . . . 0.613 ' O ' ' CB ' ' A' ' 17' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.674 ' O ' ' HB2' ' A' ' 18' ' ' LEU . 9.9 p 115.9 -45.41 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.112 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 -178.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.674 ' HB2' ' O ' ' A' ' 17' ' ' CYS . 1.9 mm? 113.67 -103.43 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.182 0 C-N-CA 124.059 0.943 . . . . 0.0 109.891 178.581 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' CGU . . . . . 0.642 ' N ' ' CD1' ' A' ' 19' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' CGU . . . . . 0.535 ' C ' ' N ' ' A' ' 22' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.457 ' C ' ' O ' ' A' ' 20' ' ' CGU . . . -35.22 -32.18 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.768 0 CA-C-O 121.912 0.863 . . . . 0.0 109.745 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.535 ' N ' ' C ' ' A' ' 20' ' ' CGU . 30.1 p -119.66 167.87 11.6 Favored 'General case' 0 C--N 1.292 -1.932 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.437 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.513 ' O ' ' CB ' ' A' ' 24' ' ' LEU . 42.3 t -87.76 1.33 54.14 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.214 -0.929 . . . . 0.0 109.082 179.201 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.513 ' CB ' ' O ' ' A' ' 23' ' ' SER . 0.2 OUTLIER 77.74 -5.27 2.14 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.429 -0.794 . . . . 0.0 109.832 -179.858 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' CGU . . . . . 0.526 ' O ' ' HB ' ' A' ' 30' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.493 ' HB2' ' HB3' ' A' ' 16' ' ' CGU . . . -58.28 -8.94 1.28 Allowed 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.789 -1.194 . . . . 0.0 110.637 -179.287 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.52 ' NH1' ' HG2' ' A' ' 28' ' ' ARG . 0.0 OUTLIER -79.94 -78.21 0.17 Allowed 'General case' 0 N--CA 1.487 1.423 0 O-C-N 120.766 -1.209 . . . . 0.0 111.571 -179.276 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.526 ' HB ' ' O ' ' A' ' 26' ' ' CGU . 2.0 p -83.98 -29.15 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 120.358 -1.464 . . . . 0.0 109.736 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.567 ' CE1' ' O ' ' A' ' 12' ' ' ASN . 42.4 m-85 -78.87 92.81 4.92 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.351 -0.843 . . . . 0.0 109.944 -179.656 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.577 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 1.5 m-20 -41.45 117.68 0.94 Allowed 'General case' 0 C--N 1.304 -1.41 0 CA-C-O 121.274 0.559 . . . . 0.0 110.752 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.515 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -78.38 -30.64 48.02 Favored 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 107.494 -1.298 . . . . 0.0 107.494 178.381 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' CGU . . . . . 0.4 ' O ' ' C ' ' A' ' 36' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.635 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 13.2 mm100 -50.36 -35.65 28.9 Favored 'General case' 0 C--O 1.206 -1.218 0 C-N-CA 118.261 -1.376 . . . . 0.0 108.023 178.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.72 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -40.97 -58.43 1.72 Allowed 'General case' 0 N--CA 1.499 1.991 0 C-N-CA 117.743 -1.583 . . . . 0.0 107.33 178.569 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.596 ' O ' ' C ' ' A' ' 39' ' ' CGU . 0.6 OUTLIER -81.58 -67.32 0.79 Allowed 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.115 -0.99 . . . . 0.0 109.493 177.291 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' CGU . . . . . 0.596 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.635 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 9.6 t80 -42.81 -54.7 4.0 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 178.37 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.72 ' CD1' ' O ' ' A' ' 37' ' ' THR . 7.1 m95 -79.46 -179.79 7.01 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 120.83 -1.169 . . . . 0.0 108.593 177.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.665 ' O ' ' CB ' ' A' ' 43' ' ' LYS . 1.5 t 36.84 92.86 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.659 -0.651 . . . . 0.0 110.2 179.259 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.665 ' CB ' ' O ' ' A' ' 42' ' ' SER . 0.0 OUTLIER 123.14 -33.33 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 106.235 -1.765 . . . . 0.0 106.235 -178.789 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.632 ' HB2' ' O ' ' A' ' 40' ' ' PHE . 0.1 OUTLIER -55.05 -73.66 0.05 Allowed 'General case' 0 C--N 1.299 -1.614 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.58 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.593 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -0.69 68.96 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.662 0 CA-C-O 121.457 0.646 . . . . 0.0 111.137 179.435 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.602 ' N ' ' O ' ' A' ' 44' ' ' TYR . 8.2 t70 -160.45 28.0 0.16 Allowed 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.381 -0.825 . . . . 0.0 109.204 -178.476 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.534 ' O ' ' CD1' ' A' ' 18' ' ' LEU . . . 67.31 12.1 60.33 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 108.272 -1.931 . . . . 0.0 108.272 -178.5 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.574 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 33.7 t70 71.72 21.4 4.32 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.817 -0.813 . . . . 0.0 109.611 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.601 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 52.9 mm-40 70.53 -10.63 0.68 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.843 -0.536 . . . . 0.0 112.142 178.473 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . 0.468 ' HB2' ' OB ' ' A' ' 63' ' ' BHD . 52.9 t -114.6 -10.11 12.55 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.446 -1.409 . . . . 0.0 109.986 179.555 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.492 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 12.1 tm-20 -62.1 152.26 33.3 Favored 'General case' 0 N--CA 1.482 1.169 0 O-C-N 120.819 -1.176 . . . . 0.0 108.851 179.525 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.441 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . 93.52 -12.77 68.95 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 110.173 -1.171 . . . . 0.0 110.173 179.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.443 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 6.1 t60 68.84 66.08 0.52 Allowed Pre-proline 0 N--CA 1.492 1.651 0 O-C-N 120.982 -1.305 . . . . 0.0 109.234 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.443 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 5.4 Cg_exo -60.86 -40.09 56.49 Favored 'Trans proline' 0 C--N 1.31 -1.494 0 C-N-CA 122.651 2.234 . . . . 0.0 111.302 -179.454 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.493 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 1.0 OUTLIER -83.61 174.05 10.87 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.118 -0.989 . . . . 0.0 109.947 -179.044 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.579 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.2 mt -147.07 -171.77 3.85 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.487 -0.758 . . . . 0.0 108.967 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.735 ' HB3' ' CD2' ' A' ' 76' ' ' PHE . 0.9 OUTLIER 48.71 57.14 6.66 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.419 -0.801 . . . . 0.0 110.055 179.727 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.456 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 0.7 OUTLIER 44.69 33.84 1.03 Allowed 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 178.17 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -83.3 153.7 30.76 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 -179.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.465 ' O ' ' SG ' ' A' ' 55' ' ' CYS . 0.1 OUTLIER -79.53 164.96 23.47 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.4 -1.059 . . . . 0.0 108.319 179.035 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.493 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 20.4 t -134.31 111.69 10.41 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.018 -1.051 . . . . 0.0 110.519 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.48 ' HB3' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER -80.38 176.79 9.46 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 177.46 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' BHD . . . . . 0.492 ' HA ' ' CB ' ' A' ' 68' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.427 ' O ' ' CG ' ' A' ' 49' ' ' GLN . . . 153.39 -175.36 31.83 Favored Glycine 0 N--CA 1.489 2.172 0 N-CA-C 107.618 -2.193 . . . . 0.0 107.618 -179.11 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.526 ' CG2' ' HG3' ' A' ' 43' ' ' LYS . 10.2 mm -94.37 -67.42 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 120.619 -1.518 . . . . 0.0 110.014 179.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . 0.503 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . -43.47 -26.94 0.72 Allowed Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.189 -1.565 . . . . 0.0 109.189 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.503 ' HB3' ' O ' ' A' ' 66' ' ' GLY . 6.6 p-10 175.54 -149.47 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.635 -0.921 . . . . 0.0 109.592 179.275 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.626 ' N ' ' CD1' ' A' ' 68' ' ' TYR . 2.8 p90 -160.43 -165.1 1.36 Allowed 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 -179.399 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.48 ' OG1' ' HB3' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -147.82 179.26 7.85 Favored 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.535 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 3.8 m -141.23 -170.83 3.15 Favored 'General case' 0 C--N 1.297 -1.702 0 O-C-N 120.898 -1.126 . . . . 0.0 108.253 179.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 4.0 m -160.78 140.92 11.18 Favored 'General case' 0 C--N 1.292 -1.901 0 O-C-N 121.461 -0.775 . . . . 0.0 109.315 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 55.9 m -105.77 139.17 40.75 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.147 -0.971 . . . . 0.0 109.37 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.37 175.64 5.27 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.076 -1.015 . . . . 0.0 109.66 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -80.66 102.13 9.67 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 123.065 1.412 . . . . 0.0 107.668 178.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . 0.592 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 130.46 8.15 3.29 Favored Glycine 0 C--N 1.269 -3.17 0 CA-C-N 113.902 -1.499 . . . . 0.0 110.186 -179.352 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.735 ' CD2' ' HB3' ' A' ' 57' ' ' ASN . 13.8 m-85 -130.64 169.19 15.95 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 120.779 -1.424 . . . . 0.0 110.155 -178.547 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.507 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 2.3 mt-10 -160.56 174.52 13.92 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.104 -0.998 . . . . 0.0 110.046 -178.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 112.24 169.37 18.06 Favored Glycine 0 N--CA 1.493 2.47 0 N-CA-C 110.12 -1.192 . . . . 0.0 110.12 179.167 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.441 ' HD3' ' C ' ' A' ' 79' ' ' LYS . 3.1 tmtt? -56.98 -55.71 31.18 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.268 -1.137 . . . . 0.0 108.428 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.579 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.7 OUTLIER -99.75 26.97 5.73 Favored 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 178.183 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.521 ' O ' ' HB2' ' A' ' 57' ' ' ASN . 1.8 m 55.84 71.7 0.54 Allowed 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 105.389 -2.078 . . . . 0.0 105.389 -177.088 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.426 ' O ' ' HG3' ' A' ' 82' ' ' GLU . 0.5 OUTLIER -108.24 -30.9 8.12 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.373 -0.829 . . . . 0.0 110.266 -176.894 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.66 ' N ' ' CD1' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -87.12 81.52 7.99 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.043 -1.035 . . . . 0.0 109.996 -179.792 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.22 108.88 0.46 Allowed 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 179.124 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.421 ' O ' ' OXT' ' A' ' 86' ' ' ARG . 5.0 p -85.89 -11.78 52.34 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.083 -1.011 . . . . 0.0 109.974 -179.29 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.543 ' HG3' ' NH1' ' A' ' 86' ' ' ARG . 0.3 OUTLIER . . . . . 0 C--N 1.297 -1.699 0 CA-C-O 118.104 -0.951 . . . . 0.0 109.467 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -159.75 134.34 7.76 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.26 -0.9 . . . . 0.0 109.297 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 6.2 t -155.18 143.15 20.03 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.199 -0.938 . . . . 0.0 109.584 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.583 ' CZ ' ' O ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -71.71 -20.41 61.91 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.389 -0.82 . . . . 0.0 109.24 179.895 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.535 HD11 ' CD2' ' A' ' 25' ' ' CGU . 0.2 OUTLIER -80.21 0.58 31.89 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.11 -0.993 . . . . 0.0 109.735 -179.807 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' CGU . . . . . 0.528 ' O ' ' CG ' ' A' ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.553 ' CG2' ' O ' ' A' ' 8' ' ' VAL . 13.3 m -40.06 96.8 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.307 -1.27 0 CA-C-O 122.469 1.128 . . . . 0.0 110.047 -179.216 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.562 ' O ' ' CB ' ' A' ' 10' ' ' GLN . 1.3 ptpm? -48.84 -34.5 12.61 Favored 'General case' 0 C--N 1.283 -2.313 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.562 ' CB ' ' O ' ' A' ' 9' ' ' LYS . 5.8 tt0 151.75 -27.41 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 179.409 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.45 ' HA3' HG23 ' A' ' 30' ' ' VAL . . . 79.19 147.62 4.04 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.234 -1.546 . . . . 0.0 109.234 -179.727 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.489 ' HB2' ' HB2' ' A' ' 16' ' ' CGU . 42.2 t30 -103.97 -168.77 1.54 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.088 -1.242 . . . . 0.0 109.723 -179.728 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.624 ' O ' ' CB ' ' A' ' 14' ' ' CGU . 0.1 OUTLIER -77.44 -10.82 59.69 Favored 'General case' 0 C--O 1.2 -1.551 0 O-C-N 120.847 -1.158 . . . . 0.0 110.4 -178.877 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' CGU . . . . . 0.624 ' CB ' ' O ' ' A' ' 13' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.509 ' HD2' ' OD2' ' A' ' 63' ' ' BHD . 0.0 OUTLIER -73.26 -33.13 65.1 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.975 -1.078 . . . . 0.0 111.237 -178.189 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' CGU . . . . . 0.489 ' HB2' ' HB2' ' A' ' 12' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.555 ' HA ' ' CB ' ' A' ' 21' ' ' ALA . 42.1 m -104.1 10.31 35.99 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.795 -1.191 . . . . 0.0 110.435 -179.627 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.411 HD11 ' O ' ' A' ' 18' ' ' LEU . 0.2 OUTLIER -61.8 -14.97 37.79 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 120.802 -1.186 . . . . 0.0 108.569 179.018 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.583 ' O ' ' CZ ' ' A' ' 4' ' ' PHE . . . -52.36 -50.02 63.2 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.072 -1.017 . . . . 0.0 109.928 -179.582 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.538 ' HB3' ' CB ' ' A' ' 26' ' ' CGU . 2.4 m -143.33 -44.35 0.29 Allowed 'General case' 0 C--N 1.289 -2.031 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 179.268 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.419 ' OG ' ' C ' ' A' ' 22' ' ' CYS . 0.0 OUTLIER 61.28 -85.3 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.57 -0.706 . . . . 0.0 110.515 179.328 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.596 HD12 ' CE2' ' A' ' 41' ' ' TRP . 0.9 OUTLIER -124.94 -27.61 3.57 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.964 -1.085 . . . . 0.0 110.139 -179.059 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' CGU . . . . . 0.535 ' CD2' HD11 ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' CGU . . . . . 0.538 ' CB ' ' HB3' ' A' ' 22' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -80.06 8.47 7.06 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 120.482 -1.386 . . . . 0.0 110.175 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 28.7 mtt180 -111.13 -56.38 2.38 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.114 -0.992 . . . . 0.0 110.523 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.516 HG13 ' CD1' ' A' ' 31' ' ' PHE . 1.0 OUTLIER -84.13 -6.94 10.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 120.76 -1.213 . . . . 0.0 108.894 179.78 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.622 ' CE2' ' O ' ' A' ' 13' ' ' LEU . 69.1 m-85 -110.49 113.45 26.1 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.131 -0.981 . . . . 0.0 111.413 -179.326 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.553 ' CB ' ' HG2' ' A' ' 36' ' ' GLN . 0.5 OUTLIER -60.31 114.59 2.99 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 121.822 -0.549 . . . . 0.0 110.974 -179.109 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.496 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -78.26 -27.75 47.56 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 106.368 -1.716 . . . . 0.0 106.368 177.252 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.601 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 0.0 OUTLIER -54.72 -34.29 62.25 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 117.911 -1.515 . . . . 0.0 107.543 179.413 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.693 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -42.22 -59.6 1.74 Allowed 'General case' 0 N--CA 1.496 1.839 0 C-N-CA 117.63 -1.628 . . . . 0.0 106.694 178.46 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.625 ' O ' ' C ' ' A' ' 39' ' ' CGU . 0.7 OUTLIER -82.12 -70.78 0.52 Allowed 'General case' 0 C--N 1.297 -1.689 0 O-C-N 121.131 -0.981 . . . . 0.0 109.023 176.305 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' CGU . . . . . 0.625 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.601 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 9.2 t80 -41.75 -60.04 1.48 Allowed 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 178.013 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.693 ' CD1' ' O ' ' A' ' 37' ' ' THR . 8.7 m95 -81.34 -177.56 6.54 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 176.355 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.475 ' OG ' ' N ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER 73.05 -71.62 0.13 Allowed 'General case' 0 N--CA 1.496 1.848 0 CA-C-O 121.934 0.873 . . . . 0.0 111.646 177.168 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.475 ' N ' ' OG ' ' A' ' 42' ' ' SER . 0.1 OUTLIER -87.48 18.75 3.67 Favored 'General case' 0 C--N 1.278 -2.543 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 -179.903 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.501 ' OH ' ' HB3' ' A' ' 48' ' ' ASP . 0.3 OUTLIER -81.03 31.78 0.32 Allowed 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 119.764 -0.775 . . . . 0.0 110.6 -179.977 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 8.0 pttm -91.0 19.57 5.56 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 120.993 -1.067 . . . . 0.0 108.474 179.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -103.7 3.82 34.67 Favored 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.51 ' O ' ' CB ' ' A' ' 48' ' ' ASP . . . 91.72 -71.98 1.72 Allowed Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.252 -1.539 . . . . 0.0 109.252 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.548 ' O ' ' N ' ' A' ' 50' ' ' CYS . 1.5 p-10 159.59 37.24 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.554 -0.968 . . . . 0.0 109.136 179.66 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.617 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 21.9 mp0 51.96 -86.87 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.449 -0.782 . . . . 0.0 110.043 178.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . 0.548 ' N ' ' O ' ' A' ' 48' ' ' ASP . 2.7 t -39.6 -26.24 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.342 -0.849 . . . . 0.0 109.867 179.717 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.507 ' N ' ' O ' ' A' ' 49' ' ' GLN . 1.1 tt0 -53.64 134.77 41.45 Favored 'General case' 0 N--CA 1.484 1.254 0 O-C-N 120.562 -1.336 . . . . 0.0 108.466 179.522 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.464 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . 103.28 -14.07 54.94 Favored Glycine 0 N--CA 1.495 2.614 0 O-C-N 120.732 -1.23 . . . . 0.0 110.12 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.564 ' CE1' ' O ' ' A' ' 55' ' ' CYS . 0.9 OUTLIER 70.55 61.58 0.48 Allowed Pre-proline 0 N--CA 1.493 1.717 0 O-C-N 121.123 -1.222 . . . . 0.0 109.825 179.912 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.545 ' CB ' ' CE2' ' A' ' 68' ' ' TYR . 3.4 Cg_exo -58.83 -44.9 32.27 Favored 'Trans proline' 0 C--N 1.309 -1.502 0 C-N-CA 122.544 2.162 . . . . 0.0 111.205 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.564 ' O ' ' CE1' ' A' ' 53' ' ' HIS . 0.8 OUTLIER -85.52 165.12 17.37 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.235 -0.916 . . . . 0.0 109.447 -179.114 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.492 ' O ' ' HB2' ' A' ' 81' ' ' CYS . 5.9 mt -149.66 -173.93 4.55 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 120.99 -1.069 . . . . 0.0 110.739 -179.369 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.61 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 1.1 m120 43.77 63.46 1.58 Allowed 'General case' 0 C--N 1.3 -1.561 0 CA-C-O 121.812 0.815 . . . . 0.0 109.414 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.44 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 0.2 OUTLIER 53.93 29.19 9.56 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.641 -0.662 . . . . 0.0 110.19 177.618 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -84.32 145.65 22.28 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.38 -1.488 . . . . 0.0 109.38 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.467 ' O ' ' SG ' ' A' ' 55' ' ' CYS . 1.7 t-160 -79.05 173.23 12.78 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.047 -1.266 . . . . 0.0 108.094 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.459 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 13.5 t -140.65 105.74 5.0 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.83 -1.169 . . . . 0.0 110.922 -179.137 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.586 ' O ' ' CG ' ' A' ' 63' ' ' BHD . 3.2 mtmm -92.77 169.96 10.07 Favored 'General case' 0 C--N 1.296 -1.73 0 N-CA-C 106.072 -1.825 . . . . 0.0 106.072 177.134 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' BHD . . . . . 0.586 ' CG ' ' O ' ' A' ' 62' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.559 ' O ' ' O ' ' A' ' 65' ' ' ILE . . . 131.24 57.7 0.09 OUTLIER Glycine 0 N--CA 1.492 2.418 0 N-CA-C 110.444 -1.062 . . . . 0.0 110.444 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.565 ' CG2' ' N ' ' A' ' 66' ' ' GLY . 0.0 OUTLIER 45.36 173.9 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.128 0 O-C-N 121.532 -0.981 . . . . 0.0 110.673 179.742 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . 0.565 ' N ' ' CG2' ' A' ' 65' ' ' ILE . . . 58.96 -80.99 0.01 OUTLIER Glycine 0 N--CA 1.496 2.671 0 N-CA-C 108.98 -1.648 . . . . 0.0 108.98 -179.135 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.572 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 5.5 p-10 -135.29 -162.57 1.28 Allowed 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 178.378 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.688 ' N ' ' CD1' ' A' ' 68' ' ' TYR . 4.5 p90 -150.76 -159.15 0.99 Allowed 'General case' 0 C--N 1.292 -1.915 0 O-C-N 120.904 -1.122 . . . . 0.0 109.709 -177.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -149.7 171.04 17.34 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 178.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 52.8 m -140.48 -169.1 2.7 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 120.847 -1.158 . . . . 0.0 108.726 179.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -160.46 124.68 3.64 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.538 -0.726 . . . . 0.0 109.318 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.477 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 66.9 m -100.93 142.05 32.95 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.038 -1.038 . . . . 0.0 109.518 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.597 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . . . -73.49 -176.35 2.26 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.189 -0.945 . . . . 0.0 110.678 -179.639 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -81.23 102.44 10.35 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 123.139 1.447 . . . . 0.0 107.983 178.202 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . 0.462 ' HA2' ' OG1' ' A' ' 85' ' ' THR . . . 121.28 21.43 3.08 Favored Glycine 0 C--N 1.267 -3.293 0 N-CA-C 109.09 -1.604 . . . . 0.0 109.09 -179.048 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.61 ' CE2' ' O ' ' A' ' 57' ' ' ASN . 6.0 m-85 -119.58 163.77 16.84 Favored 'General case' 0 C--N 1.294 -1.806 0 O-C-N 121.447 -1.031 . . . . 0.0 109.586 -178.369 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.496 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 1.8 mm-40 -157.21 174.41 15.51 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.956 -1.09 . . . . 0.0 110.317 -179.599 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.39 163.6 38.66 Favored Glycine 0 N--CA 1.489 2.198 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.44 -34.04 73.4 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.299 -1.118 . . . . 0.0 109.532 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.503 ' HB3' ' O ' ' A' ' 54' ' ' PRO . 0.1 OUTLIER -112.34 26.92 10.1 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 179.929 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.496 ' HA ' ' O ' ' A' ' 77' ' ' GLU . 3.0 m 63.22 12.06 5.82 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 120.804 -1.185 . . . . 0.0 108.516 -179.03 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -47.88 -43.57 28.69 Favored 'General case' 0 C--N 1.308 -1.198 0 O-C-N 121.585 -0.697 . . . . 0.0 111.462 -179.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.565 ' N ' ' CD1' ' A' ' 83' ' ' PHE . 0.8 OUTLIER -81.8 83.49 7.14 Favored 'General case' 0 C--N 1.297 -1.702 0 O-C-N 121.294 -0.879 . . . . 0.0 110.585 -178.838 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.474 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 89.7 p -65.0 94.62 0.14 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.152 -0.967 . . . . 0.0 108.586 178.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.462 ' OG1' ' HA2' ' A' ' 75' ' ' GLY . 12.0 p -58.84 -17.01 20.02 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.337 -0.852 . . . . 0.0 110.099 -179.163 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.498 ' NH1' ' HG2' ' A' ' 86' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.291 -1.969 0 CA-C-O 117.964 -1.017 . . . . 0.0 109.525 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.555 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.7 p30 -170.81 -175.92 1.91 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.269 -0.894 . . . . 0.0 109.461 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.456 ' OG ' OE12 ' A' ' 6' ' ' CGU . 0.1 OUTLIER -105.33 153.23 21.91 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.161 -0.962 . . . . 0.0 109.479 -179.917 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.476 ' CE2' ' O ' ' A' ' 22' ' ' CYS . 21.3 p90 -49.98 -38.7 38.13 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.184 -0.948 . . . . 0.0 109.966 -179.561 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.566 ' HG ' ' CG1' ' A' ' 8' ' ' VAL . 0.3 OUTLIER -74.34 -138.21 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.335 0 C-N-CA 117.691 -1.604 . . . . 0.0 107.796 178.41 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' CGU . . . . . 0.565 ' C ' ' O ' ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' CGU . . . . . 0.601 ' C ' ' CD1' ' A' ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.623 ' O ' ' N ' ' A' ' 10' ' ' GLN . 33.7 m -44.55 97.88 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.207 -1.182 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 179.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.518 ' O ' ' C ' ' A' ' 10' ' ' GLN . 0.0 OUTLIER -48.26 88.14 0.0 OUTLIER 'General case' 0 C--N 1.286 -2.194 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 179.648 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.623 ' N ' ' O ' ' A' ' 8' ' ' VAL . 22.9 mp0 27.53 93.75 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 121.274 0.559 . . . . 0.0 110.355 -178.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -102.48 -147.17 18.93 Favored Glycine 0 N--CA 1.489 2.203 0 N-CA-C 110.117 -1.193 . . . . 0.0 110.117 -179.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.514 ' ND2' ' HD3' ' A' ' 15' ' ' ARG . 8.0 t30 -103.11 -169.91 1.72 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.493 -1.004 . . . . 0.0 109.615 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.703 ' CD2' ' CZ ' ' A' ' 40' ' ' PHE . 0.0 OUTLIER -134.94 142.57 46.55 Favored 'General case' 0 C--N 1.306 -1.287 0 O-C-N 121.191 -0.943 . . . . 0.0 108.568 179.861 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' CGU . . . . . 0.599 OE12 ' CZ ' ' A' ' 40' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.546 ' NH1' ' HG2' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -71.54 -52.34 18.76 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.157 -0.964 . . . . 0.0 108.468 179.741 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' CGU . . . . . 0.5 ' HB3' ' HB3' ' A' ' 12' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.534 ' O ' ' SG ' ' A' ' 17' ' ' CYS . 28.7 t -104.73 17.96 23.17 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.405 -0.809 . . . . 0.0 109.51 -179.143 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.517 ' CD1' ' OE1' ' A' ' 51' ' ' GLU . 0.3 OUTLIER -40.79 -85.24 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.76 -1.212 . . . . 0.0 110.426 -179.907 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' CGU . . . . . 0.466 ' O ' ' CD2' ' A' ' 4' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -105.41 8.89 33.78 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.906 -1.121 . . . . 0.0 109.606 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.563 ' O ' ' CB ' ' A' ' 23' ' ' SER . 12.8 t -111.4 -126.46 0.28 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.207 -0.933 . . . . 0.0 109.83 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.563 ' CB ' ' O ' ' A' ' 22' ' ' CYS . 1.9 t 153.86 -23.23 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.007 -1.058 . . . . 0.0 108.164 -179.682 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.519 ' CB ' ' O ' ' A' ' 23' ' ' SER . 0.1 OUTLIER 82.72 -41.91 0.11 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.834 -0.541 . . . . 0.0 109.837 -179.801 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' CGU . . . . . 0.527 ' HB3' ' CD2' ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.695 ' O ' ' CE1' ' A' ' 31' ' ' PHE . . . -48.14 -61.69 1.86 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.668 -1.27 . . . . 0.0 108.998 -179.652 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.528 ' NH1' ' HG3' ' A' ' 28' ' ' ARG . 0.8 OUTLIER -49.93 -57.9 6.53 Favored 'General case' 0 C--N 1.297 -1.681 0 O-C-N 120.575 -1.328 . . . . 0.0 110.85 -179.792 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' CGU . . . . . 0.431 ' C ' ' O ' ' A' ' 28' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.461 ' CG2' OE12 ' A' ' 26' ' ' CGU . 79.7 t -79.79 -36.17 17.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.352 -0.843 . . . . 0.0 110.072 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.695 ' CE1' ' O ' ' A' ' 27' ' ' ALA . 0.1 OUTLIER -136.91 129.86 30.8 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.792 -1.192 . . . . 0.0 111.516 -179.459 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' CGU . . . . . 0.43 ' O ' ' C ' ' A' ' 33' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.494 ' HB3' ' HG2' ' A' ' 36' ' ' GLN . 0.1 OUTLIER -39.22 115.5 0.5 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.398 -0.814 . . . . 0.0 111.234 -177.601 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.523 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -80.54 -31.86 36.9 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 179.375 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.729 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 0.0 OUTLIER -56.93 -37.68 71.84 Favored 'General case' 0 C--O 1.198 -1.634 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 178.542 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.684 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -38.91 -57.71 1.2 Allowed 'General case' 0 N--CA 1.502 2.129 0 O-C-N 119.656 -1.903 . . . . 0.0 107.79 178.414 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.615 ' O ' ' C ' ' A' ' 39' ' ' CGU . 1.8 t70 -82.4 -69.34 0.63 Allowed 'General case' 0 C--N 1.295 -1.784 0 O-C-N 121.154 -0.966 . . . . 0.0 109.898 176.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' CGU . . . . . 0.615 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.729 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 21.5 t80 -39.45 -59.48 1.08 Allowed 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 107.294 -1.372 . . . . 0.0 107.294 177.261 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.684 ' CD1' ' O ' ' A' ' 37' ' ' THR . 11.3 m95 -80.65 -177.03 6.09 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 177.36 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.631 ' O ' ' CB ' ' A' ' 43' ' ' LYS . 0.4 OUTLIER 35.22 81.83 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.125 0 O-C-N 121.46 -0.775 . . . . 0.0 110.055 179.213 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.631 ' CB ' ' O ' ' A' ' 42' ' ' SER . 18.2 tptt 133.86 -26.0 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 105.708 -1.96 . . . . 0.0 105.708 -178.365 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.635 ' O ' ' N ' ' A' ' 46' ' ' ASP . 0.9 OUTLIER -46.55 -71.01 0.08 Allowed 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 115.263 -0.881 . . . . 0.0 108.66 179.035 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.544 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.1 OUTLIER -1.11 64.73 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.68 0 CA-C-O 121.459 0.647 . . . . 0.0 112.054 179.663 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.635 ' N ' ' O ' ' A' ' 44' ' ' TYR . 5.3 t0 -161.38 23.48 0.13 Allowed 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 -179.613 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.59 ' O ' ' HB3' ' A' ' 48' ' ' ASP . . . 82.78 -74.56 2.5 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 107.714 -2.154 . . . . 0.0 107.714 -178.058 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.59 ' HB3' ' O ' ' A' ' 47' ' ' GLY . 0.0 OUTLIER 168.25 13.58 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.02 0 O-C-N 122.239 -0.565 . . . . 0.0 109.75 178.129 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.579 ' HB2' ' O ' ' A' ' 48' ' ' ASP . 22.8 mp0 73.31 -27.27 0.19 Allowed 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.558 -0.714 . . . . 0.0 111.845 178.723 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . 0.468 ' HB2' ' OB ' ' A' ' 63' ' ' BHD . 10.8 t -124.35 2.97 8.46 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 120.522 -1.361 . . . . 0.0 109.691 179.102 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.522 ' N ' ' OD2' ' A' ' 48' ' ' ASP . 10.7 tt0 -57.62 -47.63 81.66 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.824 -1.172 . . . . 0.0 110.878 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -67.38 -0.34 10.94 Favored Glycine 0 N--CA 1.496 2.677 0 O-C-N 120.987 -1.07 . . . . 0.0 111.658 -178.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.527 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 2.2 t60 57.44 61.67 6.03 Favored Pre-proline 0 N--CA 1.492 1.657 0 O-C-N 120.656 -1.496 . . . . 0.0 109.105 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.527 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 1.3 Cg_endo -64.6 -45.77 8.3 Favored 'Trans proline' 0 C--N 1.31 -1.487 0 C-N-CA 122.561 2.174 . . . . 0.0 111.911 -178.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.47 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 2.1 m -63.73 161.12 15.7 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 120.901 -1.124 . . . . 0.0 109.378 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.477 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 4.9 mt -144.0 -174.94 4.41 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.141 -0.975 . . . . 0.0 109.927 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.61 ' O ' ' CD2' ' A' ' 76' ' ' PHE . 5.4 m-80 41.52 63.98 1.15 Allowed 'General case' 0 C--N 1.3 -1.551 0 CA-C-O 121.886 0.85 . . . . 0.0 109.56 -179.263 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.454 ' HG3' ' C ' ' A' ' 57' ' ' ASN . 4.3 mt-30 47.44 35.98 4.62 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.333 -0.854 . . . . 0.0 109.075 178.13 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -79.57 142.44 24.75 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.636 -1.386 . . . . 0.0 109.636 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.484 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 10.9 m170 -79.57 137.93 37.3 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.32 -1.106 . . . . 0.0 108.562 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.47 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 27.6 t -107.96 122.11 46.15 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.152 -0.967 . . . . 0.0 110.302 -179.026 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.48 ' HB2' ' OG1' ' A' ' 69' ' ' THR . 32.2 mmtt -104.03 97.7 7.64 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 105.617 -1.994 . . . . 0.0 105.617 177.237 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' BHD . . . . . 0.536 ' OB ' ' CZ ' ' A' ' 15' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.519 ' O ' ' OE1' ' A' ' 49' ' ' GLN . . . 164.81 -166.1 37.89 Favored Glycine 0 N--CA 1.488 2.134 0 N-CA-C 106.457 -2.657 . . . . 0.0 106.457 -178.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.539 ' CG2' ' HG3' ' A' ' 43' ' ' LYS . 6.2 mm -98.6 -72.77 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 120.273 -1.722 . . . . 0.0 110.222 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . 0.464 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . -42.54 -26.56 0.41 Allowed Glycine 0 N--CA 1.491 2.339 0 C-N-CA 119.553 -1.308 . . . . 0.0 110.263 -178.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.464 ' HB3' ' O ' ' A' ' 66' ' ' GLY . 2.3 p-10 179.93 -154.11 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.021 -1.282 . . . . 0.0 110.44 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.664 ' N ' ' CD1' ' A' ' 68' ' ' TYR . 4.2 p90 -160.46 130.22 5.14 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 -178.328 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.48 ' OG1' ' HB2' ' A' ' 62' ' ' LYS . 43.5 p -98.79 117.15 32.61 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 120.71 -1.244 . . . . 0.0 109.333 -179.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 33.5 m -79.27 -169.24 1.79 Allowed 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.01 -1.056 . . . . 0.0 108.659 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.484 ' HB ' ' HB2' ' A' ' 60' ' ' HIS . 0.2 OUTLIER -160.48 149.82 17.34 Favored 'General case' 0 C--N 1.286 -2.159 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 179.94 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.528 ' HB3' ' CB ' ' A' ' 76' ' ' PHE . 92.8 m -114.06 118.39 33.94 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.146 -0.971 . . . . 0.0 108.945 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.603 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . . . -48.26 -176.57 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.023 -1.048 . . . . 0.0 110.812 -179.223 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -80.29 101.85 9.17 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 123.278 1.513 . . . . 0.0 107.555 178.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . 0.501 ' HA2' ' HG3' ' A' ' 86' ' ' ARG . . . 118.3 20.44 4.36 Favored Glycine 0 C--N 1.268 -3.232 0 N-CA-C 108.91 -1.676 . . . . 0.0 108.91 -178.533 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.61 ' CD2' ' O ' ' A' ' 57' ' ' ASN . 9.2 m-85 -119.55 156.04 31.06 Favored 'General case' 0 C--N 1.294 -1.827 0 O-C-N 121.621 -0.929 . . . . 0.0 109.462 -178.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.505 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 5.5 mm-40 -160.69 161.18 32.23 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.058 -1.026 . . . . 0.0 110.84 -179.33 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 109.97 169.7 19.96 Favored Glycine 0 N--CA 1.493 2.443 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.87 -58.87 5.2 Favored 'General case' 0 C--N 1.306 -1.324 0 O-C-N 121.094 -1.239 . . . . 0.0 109.033 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.477 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 19.2 m-20 -104.98 29.44 6.32 Favored 'General case' 0 C--N 1.289 -2.043 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 178.582 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 77' ' ' GLU . 6.4 m 68.51 16.6 9.13 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.141 -0.975 . . . . 0.0 108.716 -179.306 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.443 ' C ' ' O ' ' A' ' 81' ' ' CYS . 83.2 tt0 -34.9 -32.92 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.328 0 O-C-N 121.739 -0.601 . . . . 0.0 111.763 -179.393 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.52 ' N ' ' CD1' ' A' ' 83' ' ' PHE . 0.3 OUTLIER -104.35 -161.72 0.84 Allowed 'General case' 0 C--N 1.295 -1.786 0 CA-C-O 122.719 1.247 . . . . 0.0 109.379 -179.778 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.402 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 33.1 m -157.31 95.19 1.45 Allowed 'General case' 0 C--N 1.277 -2.583 0 CA-C-N 114.471 -1.241 . . . . 0.0 108.903 179.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.461 ' OG1' ' HA2' ' A' ' 75' ' ' GLY . 31.1 p -50.62 -35.7 31.67 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.321 -0.862 . . . . 0.0 110.234 -179.18 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.501 ' HG3' ' HA2' ' A' ' 75' ' ' GLY . 0.0 OUTLIER . . . . . 0 C--N 1.287 -2.144 0 CA-C-O 118.007 -0.996 . . . . 0.0 109.16 179.842 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.473 ' O ' ' HB2' ' A' ' 2' ' ' ASN . . . . . . . . 0 N--CA 1.489 1.497 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.504 ' CB ' OE12 ' A' ' 6' ' ' CGU . 4.6 m120 72.74 -164.68 0.11 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.278 -0.889 . . . . 0.0 109.634 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 13.4 t -86.64 156.5 19.98 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.257 -0.902 . . . . 0.0 109.769 -179.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.552 ' C ' ' CD1' ' A' ' 4' ' ' PHE . 0.5 OUTLIER -69.21 -20.64 63.98 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.29 -0.881 . . . . 0.0 109.113 179.77 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.482 ' HB3' ' CD2' ' A' ' 26' ' ' CGU . 1.2 mt -65.64 -8.21 19.21 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.117 -0.989 . . . . 0.0 109.714 -179.591 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' CGU . . . . . 0.504 OE12 ' CB ' ' A' ' 2' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' CGU . . . . . 0.432 ' O ' ' C ' ' A' ' 8' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.432 ' C ' ' O ' ' A' ' 7' ' ' CGU . 1.5 p -39.29 125.92 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.199 0 CA-C-O 123.461 1.601 . . . . 0.0 109.913 -178.732 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.452 ' O ' ' O ' ' A' ' 10' ' ' GLN . 0.9 OUTLIER -80.71 25.46 0.43 Allowed 'General case' 0 C--N 1.267 -2.998 0 CA-C-N 113.119 -1.855 . . . . 0.0 110.735 -179.754 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.452 ' O ' ' O ' ' A' ' 9' ' ' LYS . 2.5 tm0? 61.11 144.33 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 O-C-N 120.751 -1.218 . . . . 0.0 109.702 179.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.446 ' O ' ' C ' ' A' ' 12' ' ' ASN . . . 134.26 -129.12 5.13 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.511 ' ND2' OE11 ' A' ' 26' ' ' CGU . 0.7 OUTLIER 40.35 41.46 1.03 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.145 -1.209 . . . . 0.0 110.085 179.875 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.537 ' O ' ' CD2' ' A' ' 14' ' ' CGU . 0.1 OUTLIER -129.76 -7.99 4.52 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.165 -0.959 . . . . 0.0 109.446 179.549 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' CGU . . . . . 0.537 ' CD2' ' O ' ' A' ' 13' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.75 ' O ' ' N ' ' A' ' 17' ' ' CYS . 20.7 mtm180 -84.65 95.96 9.06 Favored 'General case' 0 C--O 1.198 -1.625 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 177.544 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' CGU . . . . . 0.551 OE22 ' CB ' ' A' ' 27' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.75 ' N ' ' O ' ' A' ' 15' ' ' ARG . 84.7 m 32.1 35.71 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.059 0 CA-C-O 121.718 0.77 . . . . 0.0 109.546 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.547 ' N ' ' O ' ' A' ' 16' ' ' CGU . 0.2 OUTLIER -47.85 -22.5 0.57 Allowed 'General case' 0 N--CA 1.495 1.796 0 CA-C-O 121.491 0.662 . . . . 0.0 111.154 -178.705 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' CGU . . . . . 0.409 ' O ' ' C ' ' A' ' 21' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.419 ' C ' ' SG ' ' A' ' 22' ' ' CYS . . . -44.66 -49.67 10.24 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.206 -0.934 . . . . 0.0 109.544 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.419 ' SG ' ' C ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -152.22 -170.7 3.72 Favored 'General case' 0 C--N 1.29 -2.011 0 CA-C-O 121.52 0.676 . . . . 0.0 109.683 -179.816 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.555 ' O ' ' HB2' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -102.34 24.55 10.12 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.913 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.555 ' HB2' ' O ' ' A' ' 23' ' ' SER . 2.6 mm? 76.33 -11.88 1.1 Allowed 'General case' 0 N--CA 1.498 1.932 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.657 -179.699 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' CGU . . . . . 0.511 OE11 ' ND2' ' A' ' 12' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.551 ' CB ' OE22 ' A' ' 16' ' ' CGU . . . -80.83 41.26 0.56 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.842 -1.161 . . . . 0.0 110.605 -179.26 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 8.5 mtt180 -106.61 -58.41 1.93 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.735 -1.228 . . . . 0.0 109.589 179.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' CGU . . . . . 0.409 OE11 OE22 ' A' ' 29' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.621 HG11 ' CD1' ' A' ' 31' ' ' PHE . 2.8 p -79.52 -29.88 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.433 -0.792 . . . . 0.0 109.583 -179.62 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.621 ' CD1' HG11 ' A' ' 30' ' ' VAL . 42.9 m-85 -79.26 101.41 8.01 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.38 -0.825 . . . . 0.0 109.491 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' CGU . . . . . 0.508 ' C ' ' O ' ' A' ' 31' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.517 ' O ' ' N ' ' A' ' 35' ' ' CGU . 23.0 m-20 -61.4 83.56 0.01 OUTLIER 'General case' 0 C--O 1.191 -1.974 0 O-C-N 121.71 -0.618 . . . . 0.0 110.748 -179.641 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.484 ' HA ' ' OG1' ' A' ' 37' ' ' THR . . . -39.59 -27.38 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.95 0 O-C-N 120.886 -1.134 . . . . 0.0 110.185 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' CGU . . . . . 0.517 ' N ' ' O ' ' A' ' 33' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.701 ' O ' ' HB3' ' A' ' 40' ' ' PHE . 42.6 mt-30 -49.85 -46.42 51.36 Favored 'General case' 0 C--O 1.203 -1.359 0 N-CA-C 106.313 -1.736 . . . . 0.0 106.313 177.43 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.539 ' C ' ' O ' ' A' ' 36' ' ' GLN . 1.4 m -35.94 -59.9 0.57 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.309 -0.869 . . . . 0.0 108.814 178.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.614 ' O ' ' C ' ' A' ' 39' ' ' CGU . 5.7 m-20 -81.96 -73.11 0.4 Allowed 'General case' 0 C--N 1.298 -1.664 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 177.206 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' CGU . . . . . 0.614 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.701 ' HB3' ' O ' ' A' ' 36' ' ' GLN . 7.7 t80 -40.1 -50.83 2.64 Favored 'General case' 0 C--N 1.292 -1.9 0 O-C-N 121.634 -0.666 . . . . 0.0 110.259 178.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.544 ' O ' ' HB3' ' A' ' 44' ' ' TYR . 26.4 t-105 -82.32 -72.59 0.43 Allowed 'General case' 0 C--N 1.294 -1.844 0 O-C-N 121.353 -0.842 . . . . 0.0 112.499 -176.911 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.482 ' O ' ' HG3' ' A' ' 45' ' ' LYS . 35.4 p -47.96 -63.53 1.04 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.64 -1.288 . . . . 0.0 110.632 -178.313 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.546 ' HB3' ' O ' ' A' ' 39' ' ' CGU . 3.7 tttm -52.32 -21.71 3.81 Favored 'General case' 0 C--N 1.291 -1.973 0 O-C-N 121.384 -0.822 . . . . 0.0 108.925 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.687 ' HB2' ' O ' ' A' ' 40' ' ' PHE . 25.2 t80 -80.19 -96.16 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 178.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.536 ' HD3' ' CZ2' ' A' ' 41' ' ' TRP . 4.4 mtmt 33.37 34.56 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.13 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -179.433 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.57 ' N ' ' O ' ' A' ' 44' ' ' TYR . 1.4 t70 -131.39 -21.71 2.54 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.804 -176.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.511 ' HA2' ' OH ' ' A' ' 44' ' ' TYR . . . 49.06 60.12 6.36 Favored Glycine 0 N--CA 1.492 2.418 0 N-CA-C 105.845 -2.902 . . . . 0.0 105.845 -177.03 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.429 ' C ' ' OE1' ' A' ' 49' ' ' GLN . 27.1 t0 -126.41 -129.87 0.24 Allowed 'General case' 0 C--N 1.307 -1.268 0 O-C-N 121.546 -0.973 . . . . 0.0 110.658 -176.743 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.599 ' CD ' ' N ' ' A' ' 49' ' ' GLN . 8.4 mp0 57.3 -86.12 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.333 -0.854 . . . . 0.0 110.445 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . 0.549 ' HA ' ' CG ' ' A' ' 54' ' ' PRO . 4.6 t -98.2 -1.58 41.75 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.03 -1.044 . . . . 0.0 111.188 -178.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.459 ' O ' ' HG3' ' A' ' 51' ' ' GLU . 0.6 OUTLIER -55.47 -26.01 39.95 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 120.961 -1.087 . . . . 0.0 111.527 -179.078 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.434 ' O ' ' C ' ' A' ' 53' ' ' HIS . . . -86.13 28.22 5.22 Favored Glycine 0 N--CA 1.494 2.506 0 O-C-N 120.545 -1.347 . . . . 0.0 110.921 -178.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.582 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 3.4 t-160 41.68 53.2 7.24 Favored Pre-proline 0 N--CA 1.493 1.715 0 O-C-N 121.108 -1.231 . . . . 0.0 109.775 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.595 ' CB ' ' CE2' ' A' ' 68' ' ' TYR . 4.0 Cg_exo -56.77 -37.17 98.54 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 C-N-CA 122.562 2.175 . . . . 0.0 111.299 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.535 ' SG ' ' CB ' ' A' ' 61' ' ' CYS . 0.6 OUTLIER -89.43 168.29 12.32 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.371 -0.831 . . . . 0.0 110.19 -178.218 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.49 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.8 mt -146.13 -173.66 4.23 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 122.08 0.943 . . . . 0.0 110.562 -179.397 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.615 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 51.0 m-80 40.29 64.56 0.9 Allowed 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 122.038 0.923 . . . . 0.0 110.124 -179.684 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.441 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 2.2 mm-40 51.35 33.4 9.89 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-O 121.561 0.696 . . . . 0.0 109.835 177.393 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -81.41 127.3 7.84 Favored Glycine 0 N--CA 1.487 2.057 0 N-CA-C 109.174 -1.57 . . . . 0.0 109.174 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -78.97 168.01 20.3 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.115 -1.227 . . . . 0.0 107.951 179.402 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.54 ' HA ' ' HA ' ' A' ' 70' ' ' CYS . 0.5 OUTLIER -156.53 126.99 6.62 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 118.323 -1.351 . . . . 0.0 111.175 -178.878 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.8 mmtm -94.95 108.57 20.63 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 106.944 -1.502 . . . . 0.0 106.944 177.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' BHD . . . . . 0.533 ' CG ' ' HG2' ' A' ' 15' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.538 ' O ' ' O ' ' A' ' 67' ' ' ASP . . . 147.66 123.01 1.35 Allowed Glycine 0 N--CA 1.489 2.232 0 N-CA-C 108.221 -1.952 . . . . 0.0 108.221 -179.427 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.598 HG23 ' CA ' ' A' ' 44' ' ' TYR . 2.2 pp -38.0 160.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.504 2.253 0 CA-C-N 118.935 1.367 . . . . 0.0 110.13 -178.209 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . 0.53 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . 95.46 -47.55 1.92 Allowed Glycine 0 C--N 1.294 -1.759 0 N-CA-C 106.07 -2.812 . . . . 0.0 106.07 -177.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.538 ' O ' ' O ' ' A' ' 64' ' ' GLY . 14.7 p-10 169.69 -145.61 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 178.267 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.619 ' N ' ' CD1' ' A' ' 68' ' ' TYR . 4.1 p90 -160.53 -167.16 1.81 Allowed 'General case' 0 C--N 1.298 -1.646 0 O-C-N 120.691 -1.256 . . . . 0.0 108.926 -179.427 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.459 ' O ' ' HA ' ' A' ' 61' ' ' CYS . 0.1 OUTLIER -147.99 152.08 36.86 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 178.675 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 0.54 ' HA ' ' HA ' ' A' ' 61' ' ' CYS . 85.0 m -116.98 -170.16 1.78 Allowed 'General case' 0 C--N 1.302 -1.481 0 O-C-N 120.496 -1.378 . . . . 0.0 109.197 179.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 1.8 m -161.27 108.21 1.44 Allowed 'General case' 0 C--N 1.294 -1.829 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.486 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 89.2 m -80.16 138.29 36.86 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.96 -1.087 . . . . 0.0 109.213 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.593 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . . . -72.43 -174.4 1.34 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.074 -1.016 . . . . 0.0 111.25 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -81.57 102.36 10.57 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-O 123.035 1.398 . . . . 0.0 108.185 178.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 120.37 18.0 4.24 Favored Glycine 0 C--N 1.267 -3.294 0 N-CA-C 109.213 -1.555 . . . . 0.0 109.213 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.615 ' CE2' ' O ' ' A' ' 57' ' ' ASN . 4.2 m-85 -115.82 163.99 15.05 Favored 'General case' 0 C--N 1.294 -1.838 0 O-C-N 121.476 -1.014 . . . . 0.0 109.622 -178.38 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.467 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 1.9 tt0 -157.38 167.15 31.11 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.146 -0.971 . . . . 0.0 110.051 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 96.4 162.86 32.95 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.636 -1.386 . . . . 0.0 109.636 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 7.4 tptt -60.19 -33.74 72.64 Favored 'General case' 0 C--N 1.306 -1.306 0 O-C-N 121.249 -1.147 . . . . 0.0 109.727 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.49 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.2 OUTLIER -113.97 22.12 14.21 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.877 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.532 ' O ' ' ND2' ' A' ' 57' ' ' ASN . 5.0 m 70.34 7.02 6.05 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.035 -1.041 . . . . 0.0 108.85 -179.236 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.525 ' HA ' ' ND2' ' A' ' 57' ' ' ASN . 56.3 tt0 -37.6 -47.19 0.92 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.573 -0.704 . . . . 0.0 111.305 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.579 ' N ' ' CD1' ' A' ' 83' ' ' PHE . 0.6 OUTLIER -82.96 83.63 7.74 Favored 'General case' 0 C--N 1.294 -1.811 0 O-C-N 121.136 -0.977 . . . . 0.0 110.55 -178.625 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.454 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 1.6 p -70.97 91.38 0.86 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.275 -0.891 . . . . 0.0 108.802 178.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 10.2 p -60.76 -14.97 24.72 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.311 -0.868 . . . . 0.0 110.014 -179.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.505 ' O ' ' CD ' ' A' ' 86' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.293 -1.852 0 CA-C-O 118.055 -0.974 . . . . 0.0 109.454 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.432 ' O ' ' O ' ' A' ' 2' ' ' ASN . . . . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.432 ' O ' ' O ' ' A' ' 1' ' ' ALA . 25.7 m120 59.38 156.32 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.242 -0.911 . . . . 0.0 109.253 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.47 ' HB3' ' O ' ' A' ' 8' ' ' VAL . 0.3 OUTLIER 46.87 39.05 6.82 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.101 -1.0 . . . . 0.0 108.73 -179.632 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.523 ' C ' ' CD1' ' A' ' 4' ' ' PHE . 0.0 OUTLIER -79.87 6.82 10.1 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.528 -0.733 . . . . 0.0 110.517 -179.351 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.552 ' HB2' ' CG1' ' A' ' 8' ' ' VAL . 40.9 mt -63.41 91.4 0.05 Allowed 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' CGU . . . . . 0.596 ' C ' ' CD2' ' A' ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' CGU . . . . . 0.596 ' CD2' ' C ' ' A' ' 6' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.552 ' CG1' ' HB2' ' A' ' 5' ' ' LEU . 4.6 m -55.2 97.57 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 118.061 -1.455 . . . . 0.0 107.978 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.508 ' C ' ' O ' ' A' ' 8' ' ' VAL . 2.3 tptp -39.37 -31.57 0.09 Allowed 'General case' 0 C--N 1.29 -2.016 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 179.108 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.482 ' CG ' ' C ' ' A' ' 9' ' ' LYS . 0.9 OUTLIER 165.62 84.49 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 178.664 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.47 ' O ' ' CD2' ' A' ' 13' ' ' LEU . . . -120.27 -145.05 7.31 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.689 -1.364 . . . . 0.0 109.689 -179.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.464 ' HB3' HG13 ' A' ' 30' ' ' VAL . 21.4 m-20 56.38 77.66 0.24 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.238 -1.154 . . . . 0.0 109.387 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.47 ' CD2' ' O ' ' A' ' 11' ' ' GLY . 3.4 mm? -134.04 7.52 3.71 Favored 'General case' 0 C--N 1.308 -1.229 0 O-C-N 121.168 -0.957 . . . . 0.0 109.901 -179.613 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' CGU . . . . . 0.534 ' C ' ' OB ' ' A' ' 63' ' ' BHD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.664 ' O ' ' N ' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -84.22 96.2 8.91 Favored 'General case' 0 C--O 1.197 -1.68 0 N-CA-C 105.338 -2.097 . . . . 0.0 105.338 177.618 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' CGU . . . . . 0.657 ' CD2' ' CZ ' ' A' ' 40' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.664 ' N ' ' O ' ' A' ' 15' ' ' ARG . 7.6 p 13.16 60.0 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.278 0 CA-C-O 122.106 0.955 . . . . 0.0 111.108 -178.657 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.528 ' N ' ' O ' ' A' ' 16' ' ' CGU . 0.2 OUTLIER -80.3 0.81 31.28 Favored 'General case' 0 C--N 1.289 -2.05 0 CA-C-O 121.346 0.593 . . . . 0.0 109.552 -179.38 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' CGU . . . . . 0.421 ' C ' ' N ' ' A' ' 22' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.471 ' O ' HD12 ' A' ' 5' ' ' LEU . . . -53.24 -19.82 3.52 Favored 'General case' 0 C--N 1.296 -1.73 0 O-C-N 121.63 -0.669 . . . . 0.0 110.014 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.528 ' HB2' ' CD1' ' A' ' 5' ' ' LEU . 0.0 OUTLIER 172.11 -29.4 0.0 OUTLIER 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.402 -0.811 . . . . 0.0 109.442 179.884 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.505 ' CB ' ' O ' ' A' ' 22' ' ' CYS . 1.7 m 77.11 -76.26 0.05 Allowed 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 -178.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.484 ' CD1' ' O ' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -162.47 24.56 0.1 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.216 -0.927 . . . . 0.0 108.829 179.189 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' CGU . . . . . 0.402 ' O ' ' HB2' ' A' ' 28' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' CGU . . . . . 0.523 ' C ' ' N ' ' A' ' 28' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.48 ' C ' ' O ' ' A' ' 26' ' ' CGU . . . -39.76 -27.89 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.13 -0.981 . . . . 0.0 109.565 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.523 ' N ' ' C ' ' A' ' 26' ' ' CGU . 0.0 OUTLIER -50.25 -70.81 0.08 Allowed 'General case' 0 C--N 1.303 -1.442 0 CA-C-O 121.968 0.889 . . . . 0.0 110.831 179.812 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.586 HG11 ' CD2' ' A' ' 31' ' ' PHE . 0.4 OUTLIER -79.17 -20.03 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 120.908 -1.12 . . . . 0.0 109.543 -179.662 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.691 ' CZ ' ' CZ ' ' A' ' 40' ' ' PHE . 88.6 m-85 -100.74 94.42 6.07 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.227 -0.921 . . . . 0.0 110.243 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' CGU . . . . . 0.458 OE12 ' HA ' ' A' ' 32' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.556 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 0.4 OUTLIER -39.7 136.55 1.01 Allowed 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 121.334 0.588 . . . . 0.0 111.078 -179.293 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.548 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -80.74 -35.88 32.78 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 179.062 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' CGU . . . . . 0.472 ' O ' ' HB3' ' A' ' 39' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.616 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 55.2 mt-30 -55.07 -37.4 66.72 Favored 'General case' 0 C--O 1.204 -1.323 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 178.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.704 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -42.19 -60.61 1.4 Allowed 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 117.759 -1.577 . . . . 0.0 107.172 178.499 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.678 ' O ' ' C ' ' A' ' 39' ' ' CGU . 0.3 OUTLIER -81.62 -72.05 0.45 Allowed 'General case' 0 C--N 1.296 -1.753 0 O-C-N 120.844 -1.16 . . . . 0.0 109.693 177.357 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' CGU . . . . . 0.678 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.691 ' CZ ' ' CZ ' ' A' ' 31' ' ' PHE . 7.3 t80 -47.55 -56.99 5.96 Favored 'General case' 0 C--N 1.295 -1.761 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 178.228 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.704 ' CD1' ' O ' ' A' ' 37' ' ' THR . 9.1 m95 -77.36 -63.73 1.31 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.309 -0.869 . . . . 0.0 112.185 -179.504 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.523 ' OG ' ' N ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -42.43 -70.06 0.12 Allowed 'General case' 0 N--CA 1.499 2.008 0 O-C-N 120.843 -1.161 . . . . 0.0 112.517 -177.556 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.541 ' CG ' ' O ' ' A' ' 39' ' ' CGU . 0.1 OUTLIER -79.15 32.36 0.22 Allowed 'General case' 0 C--N 1.288 -2.081 0 O-C-N 121.482 -0.761 . . . . 0.0 110.543 -178.55 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.614 ' O ' ' CD1' ' A' ' 44' ' ' TYR . 1.0 OUTLIER -80.91 33.9 0.34 Allowed 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.126 -0.984 . . . . 0.0 110.414 179.7 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.14 37.99 1.21 Allowed 'General case' 0 C--N 1.302 -1.459 0 O-C-N 120.557 -1.339 . . . . 0.0 107.702 178.569 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -126.58 -1.1 6.81 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.724 -0.61 . . . . 0.0 109.912 -178.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.543 ' O ' ' CB ' ' A' ' 48' ' ' ASP . . . 71.64 6.71 63.36 Favored Glycine 0 N--CA 1.495 2.579 0 N-CA-C 109.179 -1.569 . . . . 0.0 109.179 -179.195 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.627 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER 85.62 5.32 0.48 Allowed 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.743 -0.857 . . . . 0.0 109.907 179.746 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.707 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 36.3 mm-40 82.37 -47.52 0.18 Allowed 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.819 -0.55 . . . . 0.0 111.723 178.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 11.2 t -83.04 -0.44 48.96 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.946 -1.096 . . . . 0.0 109.757 -179.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.493 ' OE1' ' CA ' ' A' ' 47' ' ' GLY . 47.3 tt0 -74.81 148.2 40.53 Favored 'General case' 0 N--CA 1.484 1.257 0 O-C-N 121.09 -1.007 . . . . 0.0 108.425 179.339 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 91.65 0.07 73.07 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.38 -1.488 . . . . 0.0 109.38 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.439 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 0.8 OUTLIER 54.41 63.3 7.5 Favored Pre-proline 0 C--N 1.307 -1.263 0 O-C-N 121.225 -1.162 . . . . 0.0 109.762 179.39 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.439 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 4.6 Cg_exo -56.88 -38.48 95.8 Favored 'Trans proline' 0 C--N 1.309 -1.506 0 C-N-CA 122.448 2.099 . . . . 0.0 110.325 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.483 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 0.3 OUTLIER -86.37 169.59 12.78 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.365 -0.835 . . . . 0.0 109.59 -179.714 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.497 ' O ' ' HB2' ' A' ' 81' ' ' CYS . 4.8 mt -147.13 -174.52 4.53 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.31 -0.869 . . . . 0.0 109.594 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.598 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 1.4 m-80 41.56 63.2 1.33 Allowed 'General case' 0 C--N 1.301 -1.531 0 CA-C-O 121.778 0.799 . . . . 0.0 109.824 -179.633 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.449 ' HG3' ' C ' ' A' ' 57' ' ' ASN . 1.8 mt-30 45.84 35.92 2.56 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.372 -0.83 . . . . 0.0 109.374 177.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -80.38 151.78 33.3 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -79.36 166.03 22.5 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.276 -1.132 . . . . 0.0 108.895 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.483 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 37.7 t -139.36 128.03 23.22 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.06 -1.025 . . . . 0.0 110.212 -179.515 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.49 ' HB2' ' OG1' ' A' ' 69' ' ' THR . 9.1 mmmt -102.61 -175.29 2.78 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 106.332 -1.729 . . . . 0.0 106.332 177.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' BHD . . . . . 0.534 ' OB ' ' C ' ' A' ' 14' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.512 ' O ' ' O ' ' A' ' 67' ' ' ASP . . . 152.0 137.63 2.63 Favored Glycine 0 N--CA 1.488 2.119 0 N-CA-C 107.688 -2.165 . . . . 0.0 107.688 -179.184 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.521 HG21 ' N ' ' A' ' 66' ' ' GLY . 0.5 OUTLIER -46.15 -59.43 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.555 0 O-C-N 120.578 -1.542 . . . . 0.0 109.164 -179.128 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . 0.521 ' N ' HG21 ' A' ' 65' ' ' ILE . . . -44.64 -38.2 5.4 Favored Glycine 0 N--CA 1.493 2.448 0 N-CA-C 110.552 -1.019 . . . . 0.0 110.552 -178.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.512 ' O ' ' O ' ' A' ' 64' ' ' GLY . 9.0 p-10 177.59 -147.7 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.172 -1.193 . . . . 0.0 110.555 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.707 ' CD1' ' HB3' ' A' ' 49' ' ' GLN . 1.7 p90 -156.86 -170.89 3.45 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.924 -1.11 . . . . 0.0 109.741 -179.424 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.49 ' OG1' ' HB2' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -160.62 112.9 1.96 Allowed 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.296 -0.877 . . . . 0.0 109.815 -179.739 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 35.6 m -80.42 -171.09 2.86 Favored 'General case' 0 C--N 1.296 -1.758 0 O-C-N 120.976 -1.077 . . . . 0.0 110.107 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.444 ' O ' ' SG ' ' A' ' 81' ' ' CYS . 0.2 OUTLIER -160.67 166.97 27.91 Favored 'General case' 0 C--N 1.288 -2.086 0 CA-C-N 115.362 -0.836 . . . . 0.0 108.779 179.927 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.487 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 90.4 m -128.96 125.59 37.78 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.025 -1.047 . . . . 0.0 109.269 179.589 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.598 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . . . -51.0 179.95 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.017 -1.052 . . . . 0.0 110.552 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -80.95 102.27 10.02 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 123.119 1.437 . . . . 0.0 107.735 178.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . 0.485 ' CA ' ' OG1' ' A' ' 85' ' ' THR . . . 118.68 23.04 3.49 Favored Glycine 0 C--N 1.268 -3.218 0 N-CA-C 108.756 -1.738 . . . . 0.0 108.756 -178.516 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.598 ' CE1' ' HB2' ' A' ' 73' ' ' ALA . 8.7 m-85 -119.14 159.35 24.14 Favored 'General case' 0 C--N 1.294 -1.817 0 O-C-N 121.67 -0.9 . . . . 0.0 109.451 -178.167 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.469 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 0.2 OUTLIER -156.16 165.7 35.63 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 120.879 -1.138 . . . . 0.0 110.59 -179.06 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 101.77 165.52 27.12 Favored Glycine 0 N--CA 1.493 2.47 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -58.01 -39.51 78.48 Favored 'General case' 0 C--N 1.307 -1.263 0 O-C-N 121.13 -1.218 . . . . 0.0 109.404 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.478 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 3.8 m-20 -113.56 24.42 12.2 Favored 'General case' 0 C--N 1.291 -1.946 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 179.577 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.497 ' HB2' ' O ' ' A' ' 56' ' ' LEU . 4.6 m 71.14 6.1 5.71 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 120.985 -1.072 . . . . 0.0 109.305 -179.848 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.462 ' C ' ' O ' ' A' ' 81' ' ' CYS . 15.0 tt0 -33.15 -46.81 0.17 Allowed 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.341 0.591 . . . . 0.0 111.579 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.613 ' N ' ' CD1' ' A' ' 83' ' ' PHE . 0.2 OUTLIER -88.16 89.63 8.07 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.472 -0.767 . . . . 0.0 110.576 -178.517 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.486 ' N ' ' OD1' ' A' ' 57' ' ' ASN . 3.8 p -70.58 92.64 0.86 Allowed 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 178.588 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.485 ' OG1' ' CA ' ' A' ' 75' ' ' GLY . 16.6 p -42.87 -28.87 0.28 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.246 -0.909 . . . . 0.0 110.242 -178.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.593 ' CB ' ' CZ ' ' A' ' 86' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.289 -2.025 0 CA-C-O 118.029 -0.986 . . . . 0.0 109.526 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.512 ' O ' ' N ' ' A' ' 4' ' ' PHE . 36.8 m-20 59.02 -168.06 0.15 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.355 -0.841 . . . . 0.0 109.646 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.2 m -47.58 92.95 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.303 -0.873 . . . . 0.0 109.683 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.512 ' N ' ' O ' ' A' ' 2' ' ' ASN . 2.0 t80 -63.66 -44.76 92.85 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.222 -0.924 . . . . 0.0 109.124 179.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.538 ' O ' ' C ' ' A' ' 6' ' ' CGU . 0.1 OUTLIER -62.69 -148.48 0.0 OUTLIER 'General case' 0 C--N 1.303 -1.419 0 C-N-CA 118.624 -1.23 . . . . 0.0 108.403 179.595 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' CGU . . . . . 0.538 ' C ' ' O ' ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' CGU . . . . . 0.454 ' O ' ' HG ' ' A' ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.465 ' CG1' ' N ' ' A' ' 9' ' ' LYS . 2.9 p -81.16 -150.59 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 -179.532 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.523 ' O ' ' CB ' ' A' ' 10' ' ' GLN . 0.1 OUTLIER -82.21 24.79 0.64 Allowed 'General case' 0 C--N 1.293 -1.879 0 O-C-N 121.114 -0.991 . . . . 0.0 110.416 179.63 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.523 ' CB ' ' O ' ' A' ' 9' ' ' LYS . 0.0 OUTLIER 80.03 -11.73 1.13 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.071 -1.018 . . . . 0.0 109.705 -179.446 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -179.15 127.9 1.19 Allowed Glycine 0 N--CA 1.49 2.298 0 N-CA-C 108.994 -1.642 . . . . 0.0 108.994 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.634 ' HB3' ' CZ ' ' A' ' 31' ' ' PHE . 0.9 OUTLIER -110.45 159.47 17.46 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.112 -1.229 . . . . 0.0 109.619 -179.598 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.702 ' HA ' ' CE2' ' A' ' 31' ' ' PHE . 2.6 tm? 178.89 146.08 0.16 Allowed 'General case' 0 C--N 1.313 -1.015 0 O-C-N 120.91 -1.118 . . . . 0.0 108.788 -179.669 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' CGU . . . . . 0.618 ' CB ' ' O ' ' A' ' 13' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.449 ' CA ' HD22 ' A' ' 18' ' ' LEU . 7.9 mtm-85 -85.19 99.64 11.23 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 104.23 -2.508 . . . . 0.0 104.23 175.121 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' CGU . . . . . 0.668 ' HG ' ' CD2' ' A' ' 31' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.553 ' CB ' ' O ' ' A' ' 16' ' ' CGU . 5.7 m 84.83 -59.46 0.09 Allowed 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.534 -0.729 . . . . 0.0 109.822 179.633 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.538 HD12 ' CZ ' ' A' ' 40' ' ' PHE . 2.5 mm? 65.29 -86.84 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.508 0 CA-C-O 121.873 0.844 . . . . 0.0 110.254 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' CGU . . . . . 0.486 ' C ' ' N ' ' A' ' 22' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.434 ' O ' ' CB ' ' A' ' 22' ' ' CYS . . . -49.48 -21.22 0.88 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.074 -1.017 . . . . 0.0 109.351 179.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.486 ' N ' ' C ' ' A' ' 20' ' ' CGU . 0.0 OUTLIER 172.63 -22.76 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.705 0 O-C-N 121.612 -0.68 . . . . 0.0 109.465 179.703 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.455 ' O ' ' HB1' ' A' ' 27' ' ' ALA . 5.9 p 53.81 -147.04 0.51 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.004 -1.06 . . . . 0.0 110.23 179.052 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.614 ' HG ' ' CZ2' ' A' ' 41' ' ' TRP . 0.3 OUTLIER -79.03 7.84 6.67 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.389 -0.82 . . . . 0.0 110.063 -179.669 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' CGU . . . . . 0.434 ' HB3' ' O ' ' A' ' 22' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' CGU . . . . . 0.503 ' CB ' HD21 ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.58 ' O ' ' CD1' ' A' ' 31' ' ' PHE . . . -66.17 -77.16 0.07 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.522 -1.361 . . . . 0.0 109.331 179.798 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -64.92 -14.71 60.7 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.672 -1.268 . . . . 0.0 111.008 -179.085 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' CGU . . . . . 0.444 ' HB3' ' HA ' ' A' ' 26' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.577 HG11 ' CD1' ' A' ' 31' ' ' PHE . 1.2 t -94.23 0.32 10.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.044 -1.035 . . . . 0.0 109.678 -179.18 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.702 ' CE2' ' HA ' ' A' ' 13' ' ' LEU . 7.4 m-85 -110.13 132.11 54.46 Favored 'General case' 0 C--N 1.295 -1.771 0 O-C-N 121.1 -1.0 . . . . 0.0 113.32 -177.239 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' CGU . . . . . 0.449 OE21 ' HA ' ' A' ' 32' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.495 ' O ' ' OG1' ' A' ' 37' ' ' THR . 69.7 m-20 -39.54 98.79 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.215 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.325 -178.682 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.513 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -77.37 -29.68 53.4 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 177.556 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' CGU . . . . . 0.435 ' O ' ' C ' ' A' ' 36' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.672 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 22.4 mm-40 -48.21 -30.51 4.76 Favored 'General case' 0 C--O 1.202 -1.427 0 C-N-CA 118.245 -1.382 . . . . 0.0 108.753 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.66 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -47.14 -60.23 2.61 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 119.506 -1.996 . . . . 0.0 107.082 177.76 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.537 ' O ' ' C ' ' A' ' 39' ' ' CGU . 0.5 OUTLIER -82.18 -64.74 1.12 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.331 -0.856 . . . . 0.0 109.655 177.336 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' CGU . . . . . 0.537 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.672 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 19.8 t80 -43.7 -52.71 6.32 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 107.259 -1.386 . . . . 0.0 107.259 178.663 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.66 ' CD1' ' O ' ' A' ' 37' ' ' THR . 7.9 m95 -80.73 178.61 8.26 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 177.419 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.523 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 23.2 t 63.63 105.31 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.821 -1.175 . . . . 0.0 110.757 179.092 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.528 ' HG3' ' CG2' ' A' ' 65' ' ' ILE . 0.0 OUTLIER 79.21 14.17 1.1 Allowed 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.667 0.746 . . . . 0.0 108.988 179.514 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.545 ' CG ' HD13 ' A' ' 65' ' ' ILE . 1.1 t80 -81.38 34.14 0.37 Allowed 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.417 -0.802 . . . . 0.0 110.208 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 2.1 mmmt -92.72 32.81 1.19 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 120.932 -1.105 . . . . 0.0 109.217 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -116.33 3.39 13.34 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.329 -0.857 . . . . 0.0 109.539 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.575 ' O ' ' CB ' ' A' ' 48' ' ' ASP . . . 88.4 -40.04 3.09 Favored Glycine 0 N--CA 1.494 2.547 0 N-CA-C 108.937 -1.665 . . . . 0.0 108.937 -179.418 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.575 ' CB ' ' O ' ' A' ' 47' ' ' GLY . 5.5 p30 152.04 15.83 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.036 0 O-C-N 122.11 -0.641 . . . . 0.0 110.027 179.184 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.565 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 68.2 mm-40 69.72 -11.39 0.53 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.229 -0.919 . . . . 0.0 111.1 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . 0.456 ' SG ' ' HD2' ' A' ' 54' ' ' PRO . 49.3 t -135.26 10.69 3.52 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 120.749 -1.22 . . . . 0.0 109.729 179.123 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.484 ' HB2' ' OD1' ' A' ' 48' ' ' ASP . 3.2 tt0 -58.58 -53.14 61.69 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.834 -1.166 . . . . 0.0 110.199 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.468 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . -68.37 -3.81 34.09 Favored Glycine 0 N--CA 1.492 2.426 0 C-N-CA 120.257 -0.973 . . . . 0.0 110.776 -179.043 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.468 ' HB3' ' O ' ' A' ' 52' ' ' GLY . 5.2 t-160 68.32 70.18 0.43 Allowed Pre-proline 0 N--CA 1.492 1.657 0 O-C-N 120.942 -1.328 . . . . 0.0 109.363 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.495 ' CB ' ' CE2' ' A' ' 68' ' ' TYR . 5.8 Cg_exo -60.29 -38.25 76.74 Favored 'Trans proline' 0 C--N 1.308 -1.568 0 C-N-CA 122.599 2.199 . . . . 0.0 111.35 -179.701 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.495 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 1.8 m -78.07 172.52 13.39 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.217 -0.927 . . . . 0.0 109.891 -178.815 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.504 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.5 mt -149.47 -173.41 4.39 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.061 -1.024 . . . . 0.0 110.373 -179.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.597 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 2.1 m-80 41.79 63.55 1.28 Allowed 'General case' 0 C--N 1.303 -1.452 0 CA-C-O 121.855 0.836 . . . . 0.0 110.132 -179.619 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 47.98 33.53 3.49 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.376 -0.828 . . . . 0.0 109.856 177.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -78.74 143.67 26.95 Favored Glycine 0 N--CA 1.488 2.105 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.477 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 68.6 m80 -78.84 123.33 27.11 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 179.037 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.495 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 41.2 t -101.12 113.46 26.51 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.187 -0.946 . . . . 0.0 111.507 -177.635 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.48 ' HB3' ' OG1' ' A' ' 69' ' ' THR . 0.1 OUTLIER -79.55 -169.05 1.76 Allowed 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 105.955 -1.869 . . . . 0.0 105.955 176.762 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' BHD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.528 ' O ' ' CG ' ' A' ' 49' ' ' GLN . . . 140.93 174.68 14.2 Favored Glycine 0 N--CA 1.488 2.103 0 N-CA-C 107.479 -2.249 . . . . 0.0 107.479 -178.456 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.574 ' CG1' ' HA ' ' A' ' 40' ' ' PHE . 19.3 mm -93.63 -61.6 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 120.609 -1.524 . . . . 0.0 109.8 -179.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . 0.492 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . -47.63 -25.0 3.08 Favored Glycine 0 N--CA 1.488 2.111 0 N-CA-C 108.645 -1.782 . . . . 0.0 108.645 179.446 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.492 ' HB3' ' O ' ' A' ' 66' ' ' GLY . 3.3 p-10 176.78 -149.36 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.645 -0.915 . . . . 0.0 109.69 179.255 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.641 ' N ' ' CD1' ' A' ' 68' ' ' TYR . 4.3 p90 -160.31 -167.09 1.82 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.37 -0.831 . . . . 0.0 109.248 -179.065 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.48 ' OG1' ' HB3' ' A' ' 62' ' ' LYS . 0.1 OUTLIER -144.96 171.63 14.18 Favored 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 178.651 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 20.6 m -136.27 -174.5 3.7 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 120.843 -1.161 . . . . 0.0 108.313 179.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.477 ' HB ' ' HB2' ' A' ' 60' ' ' HIS . 0.2 OUTLIER -160.54 150.85 18.1 Favored 'General case' 0 C--N 1.292 -1.909 0 O-C-N 121.518 -0.739 . . . . 0.0 109.249 179.478 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.497 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 88.3 m -120.95 124.86 45.94 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.114 -0.991 . . . . 0.0 109.133 179.712 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.595 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . . . -57.13 -179.81 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.019 -1.051 . . . . 0.0 111.103 -179.27 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.26 100.97 6.04 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 123.425 1.583 . . . . 0.0 108.702 178.633 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . 0.478 ' HA2' ' OG1' ' A' ' 85' ' ' THR . . . 119.5 20.42 3.91 Favored Glycine 0 C--N 1.266 -3.309 0 CA-C-N 113.21 -1.814 . . . . 0.0 108.834 -178.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.597 ' CE2' ' O ' ' A' ' 57' ' ' ASN . 6.5 m-85 -117.51 158.03 25.26 Favored 'General case' 0 C--N 1.296 -1.749 0 O-C-N 121.61 -0.935 . . . . 0.0 109.89 -178.036 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.54 ' CG ' HG21 ' A' ' 85' ' ' THR . 0.9 OUTLIER -160.08 163.33 33.97 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.18 -0.95 . . . . 0.0 110.487 -179.505 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 108.23 166.33 21.24 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.14 -39.42 72.24 Favored 'General case' 0 C--N 1.308 -1.216 0 O-C-N 121.167 -1.196 . . . . 0.0 109.17 179.716 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.504 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 70.8 m-20 -119.03 29.5 7.66 Favored 'General case' 0 C--N 1.292 -1.933 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 179.315 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.504 ' O ' ' HB2' ' A' ' 57' ' ' ASN . 6.8 m 68.41 10.73 8.03 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.035 -1.041 . . . . 0.0 108.575 -179.13 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.461 ' C ' ' O ' ' A' ' 81' ' ' CYS . 22.1 tt0 -29.47 -45.45 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 121.186 0.517 . . . . 0.0 112.232 -179.543 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.474 ' HB2' ' HG3' ' A' ' 77' ' ' GLU . 0.4 OUTLIER -101.41 -161.06 0.83 Allowed 'General case' 0 C--N 1.294 -1.832 0 CA-C-O 122.84 1.305 . . . . 0.0 109.834 -178.895 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 1.5 p -147.94 115.04 6.16 Favored 'General case' 0 C--N 1.278 -2.518 0 CA-C-N 114.23 -1.35 . . . . 0.0 108.877 179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.54 HG21 ' CG ' ' A' ' 77' ' ' GLU . 18.2 p -63.44 -18.24 63.54 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.128 -0.983 . . . . 0.0 109.729 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.1 ptt180 . . . . . 0 C--N 1.293 -1.87 0 CA-C-O 118.01 -0.995 . . . . 0.0 109.504 -179.987 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.451 ' O ' ' HB2' ' A' ' 2' ' ' ASN . . . . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 1' ' ' ALA . 0.5 OUTLIER 71.04 22.21 4.61 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.264 -0.897 . . . . 0.0 109.42 -179.891 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 88.1 p -146.49 74.17 1.35 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.243 -0.91 . . . . 0.0 109.467 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.506 ' C ' ' CD1' ' A' ' 4' ' ' PHE . 0.1 OUTLIER -80.6 24.49 0.47 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.261 -0.9 . . . . 0.0 110.749 -179.701 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.421 ' HA ' OE11 ' A' ' 26' ' ' CGU . 0.1 OUTLIER -64.66 -36.31 83.86 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.72 -1.237 . . . . 0.0 109.362 -179.91 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' CGU . . . . . 0.452 OE12 ' HB3' ' A' ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' CGU . . . . . 0.467 ' O ' ' C ' ' A' ' 8' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.578 ' CG2' ' O ' ' A' ' 8' ' ' VAL . 4.2 m -39.72 99.95 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 CA-C-O 122.644 1.212 . . . . 0.0 109.424 -179.405 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.467 ' O ' ' HB3' ' A' ' 10' ' ' GLN . 3.5 tmtt? -39.89 -27.44 0.04 OUTLIER 'General case' 0 C--N 1.287 -2.147 0 CA-C-N 115.177 -0.92 . . . . 0.0 109.768 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.472 ' N ' ' O ' ' A' ' 8' ' ' VAL . 27.1 tt0 61.73 119.25 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.088 -1.007 . . . . 0.0 109.219 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 178.41 -75.29 0.07 OUTLIER Glycine 0 N--CA 1.492 2.39 0 N-CA-C 110.003 -1.239 . . . . 0.0 110.003 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.434 ' OD1' ' HD2' ' A' ' 15' ' ' ARG . 1.0 OUTLIER -102.93 163.85 11.96 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.201 -1.176 . . . . 0.0 109.401 -179.781 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.583 ' CD2' ' CD1' ' A' ' 31' ' ' PHE . 4.3 mp -80.33 -125.85 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.23 0 O-C-N 121.099 -1.0 . . . . 0.0 109.747 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' CGU . . . . . 0.533 OE22 ' CE2' ' A' ' 44' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.526 ' NE ' ' HB3' ' A' ' 62' ' ' LYS . 82.5 mtt180 -46.32 -33.64 3.94 Favored 'General case' 0 N--CA 1.487 1.408 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.538 ' CB ' ' O ' ' A' ' 23' ' ' SER . 1.7 m -93.73 33.28 1.31 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.088 -1.008 . . . . 0.0 110.194 -179.662 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.54 ' CD1' ' O ' ' A' ' 18' ' ' LEU . 2.8 tm? -80.51 -16.29 54.63 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-O 121.943 0.878 . . . . 0.0 108.709 178.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -79.41 -0.69 33.93 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.161 -0.962 . . . . 0.0 109.918 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.533 ' HB3' ' HA ' ' A' ' 17' ' ' CYS . 7.0 t 179.33 158.87 0.64 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.116 -0.99 . . . . 0.0 109.259 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.538 ' O ' ' CB ' ' A' ' 17' ' ' CYS . 3.1 m -99.62 -161.5 0.88 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.964 -1.085 . . . . 0.0 110.721 -178.461 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.583 HD11 ' CH2' ' A' ' 41' ' ' TRP . 3.9 mm? -94.27 -41.77 9.28 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.541 -0.724 . . . . 0.0 109.5 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' CGU . . . . . 0.523 ' CD2' ' C ' ' A' ' 26' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.652 ' O ' ' CE1' ' A' ' 31' ' ' PHE . . . -57.03 -43.21 81.66 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.005 -1.059 . . . . 0.0 109.408 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.439 ' NH1' ' HG3' ' A' ' 28' ' ' ARG . 0.0 OUTLIER -65.77 -22.5 66.59 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.658 -1.277 . . . . 0.0 109.752 -179.908 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 53.3 t -80.77 -41.2 19.62 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 O-C-N 121.542 -0.724 . . . . 0.0 109.964 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.652 ' CE1' ' O ' ' A' ' 27' ' ' ALA . 0.1 OUTLIER -114.35 118.94 35.3 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.848 -1.158 . . . . 0.0 110.38 179.947 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' CGU . . . . . 0.46 ' O ' ' C ' ' A' ' 33' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.544 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 0.8 OUTLIER -39.46 126.02 1.77 Allowed 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.636 -0.665 . . . . 0.0 110.442 -178.609 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.536 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -80.32 -34.77 36.45 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 179.858 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.683 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 3.4 mm100 -53.18 -38.25 62.65 Favored 'General case' 0 C--O 1.203 -1.37 0 C-N-CA 118.369 -1.332 . . . . 0.0 107.834 178.36 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.688 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -40.28 -59.82 1.21 Allowed 'General case' 0 N--CA 1.502 2.133 0 O-C-N 120.203 -1.561 . . . . 0.0 107.787 178.812 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.634 ' O ' ' C ' ' A' ' 39' ' ' CGU . 0.5 OUTLIER -80.82 -67.71 0.75 Allowed 'General case' 0 C--N 1.297 -1.714 0 O-C-N 120.969 -1.082 . . . . 0.0 109.46 177.847 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' CGU . . . . . 0.634 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.683 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 14.9 t80 -39.9 -51.28 2.47 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 178.278 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.688 ' CD1' ' O ' ' A' ' 37' ' ' THR . 10.2 m95 -81.22 -68.78 0.66 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.933 -1.104 . . . . 0.0 112.427 -179.156 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.527 ' O ' ' CG ' ' A' ' 45' ' ' LYS . 0.3 OUTLIER -49.16 -53.25 21.94 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.65 -1.281 . . . . 0.0 111.476 -177.377 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.512 ' HB3' ' O ' ' A' ' 39' ' ' CGU . 0.4 OUTLIER -62.74 -27.35 69.21 Favored 'General case' 0 C--N 1.283 -2.3 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 179.793 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.601 ' CA ' HG22 ' A' ' 65' ' ' ILE . 25.4 t80 -81.35 -95.63 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.381 0 O-C-N 121.425 -0.797 . . . . 0.0 108.857 179.368 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.556 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.0 OUTLIER 29.32 38.2 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.365 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 -178.782 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.601 ' N ' ' O ' ' A' ' 44' ' ' TYR . 19.7 t0 -127.91 -18.89 4.13 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.672 -176.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.472 ' HA2' ' OH ' ' A' ' 44' ' ' TYR . . . 49.73 49.36 34.52 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 105.897 -2.881 . . . . 0.0 105.897 -177.338 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.502 ' O ' ' C ' ' A' ' 49' ' ' GLN . 15.1 t0 -117.31 -138.18 0.36 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 122.089 -0.653 . . . . 0.0 110.625 -177.245 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.64 ' O ' ' CB ' ' A' ' 50' ' ' CYS . 7.3 mt-30 24.0 80.15 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.893 0 CA-C-O 121.617 0.722 . . . . 0.0 111.487 -179.654 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . 0.64 ' CB ' ' O ' ' A' ' 49' ' ' GLN . 50.5 t 112.8 -30.59 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 115.279 -0.873 . . . . 0.0 108.863 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.457 ' CB ' ' O ' ' A' ' 47' ' ' GLY . 1.4 tm-20 -61.47 -53.17 59.95 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.359 -0.838 . . . . 0.0 109.985 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.56 ' O ' ' CB ' ' A' ' 53' ' ' HIS . . . -61.28 -9.61 17.25 Favored Glycine 0 N--CA 1.493 2.474 0 N-CA-C 110.035 -1.226 . . . . 0.0 110.035 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.577 ' CE1' HD22 ' A' ' 56' ' ' LEU . 1.0 OUTLIER 80.74 53.73 0.1 Allowed Pre-proline 0 N--CA 1.486 1.355 0 O-C-N 121.372 -1.076 . . . . 0.0 110.193 179.563 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.548 ' CD ' ' N ' ' A' ' 53' ' ' HIS . 3.4 Cg_exo -57.91 -38.16 93.41 Favored 'Trans proline' 0 C--N 1.312 -1.377 0 C-N-CA 122.457 2.105 . . . . 0.0 109.731 178.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.45 ' O ' ' ND1' ' A' ' 53' ' ' HIS . 1.6 m -96.1 174.29 6.99 Favored 'General case' 0 C--N 1.298 -1.657 0 CA-C-O 121.157 0.503 . . . . 0.0 109.844 -178.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.577 HD22 ' CE1' ' A' ' 53' ' ' HIS . 5.1 mt -149.6 -174.78 4.78 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.114 -0.991 . . . . 0.0 110.309 -179.568 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.624 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 1.0 OUTLIER 45.54 62.18 2.29 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-O 121.769 0.795 . . . . 0.0 109.929 -179.578 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.455 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 1.8 mm100 49.94 28.04 2.68 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.55 -0.719 . . . . 0.0 110.653 177.193 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -65.57 132.77 35.2 Favored Glycine 0 N--CA 1.489 2.201 0 N-CA-C 109.012 -1.635 . . . . 0.0 109.012 179.555 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 57.7 t60 -79.07 136.28 37.12 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.106 -1.232 . . . . 0.0 108.288 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.518 ' HA ' ' SG ' ' A' ' 70' ' ' CYS . 1.1 p -120.52 150.85 40.19 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 120.969 -1.082 . . . . 0.0 111.344 -178.373 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.526 ' HB3' ' NE ' ' A' ' 15' ' ' ARG . 8.3 mttp -124.11 97.16 5.22 Favored 'General case' 0 C--N 1.299 -1.614 0 N-CA-C 105.364 -2.087 . . . . 0.0 105.364 177.037 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' BHD . . . . . 0.512 ' N ' ' HG2' ' A' ' 15' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.521 ' O ' ' O ' ' A' ' 65' ' ' ILE . . . 162.14 114.54 0.33 Allowed Glycine 0 N--CA 1.483 1.797 0 N-CA-C 107.031 -2.428 . . . . 0.0 107.031 -179.583 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.601 HG22 ' CA ' ' A' ' 44' ' ' TYR . 2.4 pp -35.63 154.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 CA-C-N 118.322 1.061 . . . . 0.0 110.016 -177.819 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . 0.499 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . 103.47 -44.42 1.49 Allowed Glycine 0 N--CA 1.483 1.812 0 N-CA-C 104.432 -3.467 . . . . 0.0 104.432 -176.104 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.499 ' HB3' ' O ' ' A' ' 66' ' ' GLY . 5.2 p-10 171.81 -152.35 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 176.508 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.61 ' N ' ' CD1' ' A' ' 68' ' ' TYR . 6.4 p90 -158.43 115.05 2.79 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 -179.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.492 ' OG1' ' HB2' ' A' ' 62' ' ' LYS . 76.8 p -79.67 115.11 19.1 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 120.659 -1.275 . . . . 0.0 109.438 -178.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 0.518 ' SG ' ' HA ' ' A' ' 61' ' ' CYS . 0.0 OUTLIER -103.12 -172.54 2.13 Favored 'General case' 0 C--N 1.304 -1.384 0 O-C-N 121.195 -0.94 . . . . 0.0 109.303 179.814 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 7.8 m -162.03 131.4 4.49 Favored 'General case' 0 C--N 1.291 -1.976 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 179.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.533 ' HB3' ' CB ' ' A' ' 76' ' ' PHE . 94.1 m -82.05 116.49 21.67 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.832 -1.167 . . . . 0.0 108.569 179.152 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.612 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . . . -43.67 172.56 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.014 -1.054 . . . . 0.0 111.319 -179.075 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.02 100.41 3.57 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-O 123.583 1.659 . . . . 0.0 108.586 178.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . 0.552 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 118.96 28.96 1.92 Allowed Glycine 0 C--N 1.264 -3.47 0 N-CA-C 108.066 -2.013 . . . . 0.0 108.066 -178.284 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.624 ' CE2' ' O ' ' A' ' 57' ' ' ASN . 17.7 m-85 -128.0 148.78 50.54 Favored 'General case' 0 C--N 1.296 -1.759 0 O-C-N 121.833 -0.804 . . . . 0.0 110.367 -178.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.516 ' HB2' HG22 ' A' ' 85' ' ' THR . 0.7 OUTLIER -152.58 166.55 31.69 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.252 -0.905 . . . . 0.0 110.514 -179.73 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 109.24 163.97 20.15 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.476 -1.45 . . . . 0.0 109.476 179.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.6 tptt -57.84 -33.61 68.83 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.113 -1.228 . . . . 0.0 109.106 179.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.492 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.4 OUTLIER -121.9 27.76 7.93 Favored 'General case' 0 C--N 1.291 -1.963 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 179.644 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.51 ' O ' ' HB2' ' A' ' 57' ' ' ASN . 4.7 m 62.53 14.24 6.87 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 -178.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.448 ' C ' ' O ' ' A' ' 81' ' ' CYS . 45.9 tt0 -33.54 -36.94 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.323 0 O-C-N 121.666 -0.646 . . . . 0.0 111.923 -179.101 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.475 ' O ' ' OD1' ' A' ' 57' ' ' ASN . 1.3 m-85 -106.19 -166.49 1.2 Allowed 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 122.809 1.29 . . . . 0.0 109.492 -179.309 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.492 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 0.7 OUTLIER -138.82 107.27 5.83 Favored 'General case' 0 C--N 1.275 -2.659 0 CA-C-N 114.415 -1.266 . . . . 0.0 109.113 -179.871 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.516 HG22 ' HB2' ' A' ' 77' ' ' GLU . 2.4 p -62.36 96.49 0.08 Allowed 'General case' 0 C--N 1.302 -1.464 0 O-C-N 120.913 -1.117 . . . . 0.0 110.032 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.521 ' NH1' ' HG2' ' A' ' 86' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.294 -1.829 0 CA-C-O 118.052 -0.975 . . . . 0.0 110.099 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.424 ' O ' ' C ' ' A' ' 2' ' ' ASN . . . . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.424 ' C ' ' O ' ' A' ' 1' ' ' ALA . 0.9 OUTLIER 44.07 54.13 6.1 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.242 -0.911 . . . . 0.0 109.461 -179.996 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.481 ' O ' ' CD2' ' A' ' 6' ' ' CGU . 0.6 OUTLIER -86.42 125.23 33.54 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.308 -0.87 . . . . 0.0 109.699 -179.896 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.537 ' CZ ' OE21 ' A' ' 26' ' ' CGU . 0.0 OUTLIER -72.63 -20.13 61.33 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.304 -0.873 . . . . 0.0 108.901 179.693 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.5 ' O ' ' CG1' ' A' ' 8' ' ' VAL . 0.1 OUTLIER -75.5 -10.77 59.74 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.238 -0.914 . . . . 0.0 109.442 179.924 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' CGU . . . . . 0.519 ' C ' ' CD1' ' A' ' 6' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' CGU . . . . . 0.484 ' O ' ' N ' ' A' ' 9' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.554 ' CG2' ' O ' ' A' ' 8' ' ' VAL . 5.5 m -42.79 98.83 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.306 -1.299 0 CA-C-O 122.528 1.156 . . . . 0.0 109.488 -179.679 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.486 ' O ' ' HB3' ' A' ' 10' ' ' GLN . 0.8 OUTLIER -41.53 -27.29 0.09 Allowed 'General case' 0 C--N 1.286 -2.192 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.251 179.935 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.486 ' HB3' ' O ' ' A' ' 9' ' ' LYS . 15.9 tt0 67.54 77.41 0.26 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.515 -0.741 . . . . 0.0 110.006 179.531 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.427 ' O ' ' CG ' ' A' ' 12' ' ' ASN . . . 128.71 94.34 0.78 Allowed Glycine 0 N--CA 1.49 2.286 0 N-CA-C 110.003 -1.239 . . . . 0.0 110.003 179.602 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.575 ' HB3' ' CB ' ' A' ' 16' ' ' CGU . 6.0 m-20 174.84 142.17 0.05 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.253 -1.145 . . . . 0.0 109.169 179.47 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.8 mp -109.07 -146.69 0.41 Allowed 'General case' 0 N--CA 1.478 0.93 0 O-C-N 120.576 -1.327 . . . . 0.0 110.725 -179.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' CGU . . . . . 0.507 ' HB2' ' CZ ' ' A' ' 40' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.3 mtp180 -66.79 -43.23 84.46 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' CGU . . . . . 0.575 ' CB ' ' HB3' ' A' ' 12' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.441 ' HB2' ' HB3' ' A' ' 22' ' ' CYS . 0.0 OUTLIER -53.02 -50.95 63.19 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.535 -0.728 . . . . 0.0 109.29 -179.559 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.457 ' O ' ' CZ ' ' A' ' 44' ' ' TYR . 0.3 OUTLIER 57.68 -88.79 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.394 -0.816 . . . . 0.0 109.998 179.864 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' CGU . . . . . 0.504 ' O ' ' SG ' ' A' ' 22' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.8 -16.13 60.48 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.36 -0.837 . . . . 0.0 109.172 179.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.504 ' SG ' ' O ' ' A' ' 19' ' ' CGU . 1.0 OUTLIER -113.37 173.98 6.14 Favored 'General case' 0 N--CA 1.496 1.827 0 C-N-CA 119.656 -0.818 . . . . 0.0 109.412 179.281 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.606 ' O ' ' HB2' ' A' ' 24' ' ' LEU . 29.7 t -121.84 14.33 10.8 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.227 -0.92 . . . . 0.0 109.461 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.606 ' HB2' ' O ' ' A' ' 23' ' ' SER . 3.5 mm? 78.43 -37.97 0.23 Allowed 'General case' 0 N--CA 1.503 2.195 0 O-C-N 122.162 -0.336 . . . . 0.0 110.61 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' CGU . . . . . 0.537 OE21 ' CZ ' ' A' ' 4' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.593 ' O ' ' CE1' ' A' ' 31' ' ' PHE . . . -62.75 -43.28 99.21 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.189 -0.944 . . . . 0.0 109.626 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.435 ' CG ' ' NH1' ' A' ' 28' ' ' ARG . 0.0 OUTLIER -57.19 -53.0 63.02 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-O 122.309 1.052 . . . . 0.0 110.105 -179.568 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.593 HG11 ' CD1' ' A' ' 31' ' ' PHE . 0.3 OUTLIER -87.72 -41.0 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 120.935 -1.103 . . . . 0.0 110.763 -178.896 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.648 ' CE2' ' CE2' ' A' ' 40' ' ' PHE . 0.1 OUTLIER -135.8 124.16 23.34 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.474 -1.391 . . . . 0.0 111.626 -179.784 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.553 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 6.8 m-20 -39.35 127.49 1.81 Allowed 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.662 -0.649 . . . . 0.0 111.417 -177.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.507 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -80.71 -30.02 36.37 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 178.582 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' CGU . . . . . 0.401 ' O ' ' C ' ' A' ' 36' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.662 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 11.1 mm100 -50.01 -41.37 47.03 Favored 'General case' 0 C--O 1.203 -1.37 0 C-N-CA 118.802 -1.159 . . . . 0.0 108.01 178.347 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.64 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.1 OUTLIER -40.88 -59.1 1.51 Allowed 'General case' 0 N--CA 1.498 1.943 0 C-N-CA 118.23 -1.388 . . . . 0.0 108.631 179.31 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.595 ' O ' ' C ' ' A' ' 39' ' ' CGU . 0.8 OUTLIER -80.95 -65.91 0.95 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.043 -1.036 . . . . 0.0 110.196 178.796 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' CGU . . . . . 0.595 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.662 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 10.0 t80 -39.9 -50.01 2.45 Favored 'General case' 0 C--N 1.296 -1.758 0 O-C-N 121.956 -0.465 . . . . 0.0 109.928 178.363 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.64 ' CD1' ' O ' ' A' ' 37' ' ' THR . 9.4 m95 -81.3 -69.32 0.62 Allowed 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.522 -0.736 . . . . 0.0 112.802 -178.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.489 ' OG ' ' N ' ' A' ' 43' ' ' LYS . 0.1 OUTLIER -42.89 -73.74 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.026 0 O-C-N 120.831 -1.168 . . . . 0.0 112.646 -176.906 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.531 ' HD2' ' CG2' ' A' ' 65' ' ' ILE . 1.4 ptpt -78.2 31.88 0.18 Allowed 'General case' 0 C--N 1.287 -2.113 0 O-C-N 121.649 -0.657 . . . . 0.0 110.57 -178.509 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.59 ' HB2' ' O ' ' A' ' 40' ' ' PHE . 0.8 OUTLIER -80.26 23.37 0.49 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.014 -1.054 . . . . 0.0 110.693 179.747 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -90.21 31.92 0.97 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 120.776 -1.202 . . . . 0.0 108.619 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.52 ' OD2' ' NE2' ' A' ' 49' ' ' GLN . 1.6 t0 -111.12 4.12 19.09 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.464 -0.773 . . . . 0.0 109.827 -179.235 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.546 ' O ' ' CB ' ' A' ' 48' ' ' ASP . . . 69.42 16.13 71.17 Favored Glycine 0 N--CA 1.492 2.395 0 N-CA-C 108.577 -1.809 . . . . 0.0 108.577 -179.086 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.577 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER 83.58 7.96 0.64 Allowed 'General case' 0 N--CA 1.501 2.106 0 O-C-N 121.779 -0.836 . . . . 0.0 109.527 -179.815 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.632 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 33.7 mm-40 72.33 -21.91 0.22 Allowed 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.462 -0.774 . . . . 0.0 111.838 179.273 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . 0.463 ' O ' ' HD3' ' A' ' 54' ' ' PRO . 25.1 t -105.97 -20.05 13.55 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.426 -1.421 . . . . 0.0 109.436 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.464 ' HB2' ' O ' ' A' ' 47' ' ' GLY . 72.5 tt0 -49.83 136.45 17.97 Favored 'General case' 0 N--CA 1.485 1.281 0 O-C-N 121.088 -1.007 . . . . 0.0 109.073 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 100.0 -11.9 60.59 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 110.094 -1.203 . . . . 0.0 110.094 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.452 ' CD2' ' O ' ' A' ' 55' ' ' CYS . 3.8 t-160 60.82 65.74 1.96 Allowed Pre-proline 0 N--CA 1.491 1.582 0 O-C-N 121.088 -1.242 . . . . 0.0 109.436 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.463 ' HD3' ' O ' ' A' ' 50' ' ' CYS . 5.7 Cg_exo -58.86 -38.57 87.78 Favored 'Trans proline' 0 C--N 1.308 -1.558 0 C-N-CA 122.415 2.077 . . . . 0.0 110.751 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.476 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 1.8 m -72.4 172.45 10.39 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.353 -0.842 . . . . 0.0 109.233 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.476 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 4.7 mt -144.88 -174.99 4.5 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.238 -0.914 . . . . 0.0 109.934 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.614 ' O ' ' CD2' ' A' ' 76' ' ' PHE . 1.0 OUTLIER 44.76 61.9 2.29 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-O 121.666 0.746 . . . . 0.0 109.538 -179.857 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.451 ' HG3' ' C ' ' A' ' 57' ' ' ASN . 1.4 mt-30 45.18 33.84 1.24 Allowed 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.232 -0.917 . . . . 0.0 109.387 177.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -80.27 152.28 34.12 Favored Glycine 0 N--CA 1.489 2.182 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.461 ' O ' ' SG ' ' A' ' 55' ' ' CYS . 0.0 OUTLIER -79.85 169.31 18.1 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.337 -1.096 . . . . 0.0 108.631 179.502 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.476 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 19.2 t -140.72 125.87 18.51 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.024 -1.047 . . . . 0.0 110.125 -179.389 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.508 ' O ' ' HB2' ' A' ' 68' ' ' TYR . 0.1 OUTLIER -109.12 -175.95 2.9 Favored 'General case' 0 N--CA 1.486 1.375 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 178.148 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' BHD . . . . . 0.453 ' OD1' OE12 ' A' ' 14' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.557 ' O ' ' N ' ' A' ' 66' ' ' GLY . . . 144.5 41.97 0.05 OUTLIER Glycine 0 N--CA 1.49 2.262 0 N-CA-C 110.026 -1.23 . . . . 0.0 110.026 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.531 ' CG2' ' HD2' ' A' ' 43' ' ' LYS . 2.2 mm 47.67 -86.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 121.432 -1.04 . . . . 0.0 110.081 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . 0.557 ' N ' ' O ' ' A' ' 64' ' ' GLY . . . -31.26 -38.24 0.03 OUTLIER Glycine 0 N--CA 1.5 2.938 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.517 ' N ' ' O ' ' A' ' 65' ' ' ILE . 5.0 p-10 -175.29 -150.42 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.393 -1.063 . . . . 0.0 109.549 178.722 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.644 ' N ' ' CD1' ' A' ' 68' ' ' TYR . 1.8 p90 -160.38 139.16 10.43 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.198 -0.939 . . . . 0.0 109.606 -178.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.48 ' OG1' ' HD3' ' A' ' 62' ' ' LYS . 50.1 p -104.64 120.14 40.63 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.11 -0.994 . . . . 0.0 109.341 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 6.9 m -79.33 -166.64 0.99 Allowed 'General case' 0 C--N 1.303 -1.419 0 O-C-N 120.663 -1.273 . . . . 0.0 108.82 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.459 ' O ' ' SG ' ' A' ' 81' ' ' CYS . 4.7 m -160.37 159.3 30.97 Favored 'General case' 0 C--N 1.288 -2.084 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.531 ' HB3' ' CB ' ' A' ' 76' ' ' PHE . 87.2 m -125.65 123.04 38.1 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.026 -1.046 . . . . 0.0 109.484 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.574 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . . . -50.34 -176.15 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.073 -1.017 . . . . 0.0 110.757 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -81.03 102.11 9.98 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-O 123.067 1.413 . . . . 0.0 107.869 178.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . 0.491 ' HA2' ' OG1' ' A' ' 85' ' ' THR . . . 117.37 21.21 4.47 Favored Glycine 0 C--N 1.267 -3.283 0 N-CA-C 108.583 -1.807 . . . . 0.0 108.583 -178.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.614 ' CD2' ' O ' ' A' ' 57' ' ' ASN . 8.3 m-85 -119.8 157.32 28.88 Favored 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.632 -0.922 . . . . 0.0 110.156 -177.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.54 ' HG2' ' N ' ' A' ' 85' ' ' THR . 0.6 OUTLIER -160.17 163.03 33.98 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.048 -1.032 . . . . 0.0 110.955 -179.25 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 109.84 166.03 19.83 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.352 -1.499 . . . . 0.0 109.352 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.64 -34.82 69.74 Favored 'General case' 0 C--N 1.306 -1.313 0 O-C-N 121.155 -1.203 . . . . 0.0 109.12 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.476 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.7 OUTLIER -121.84 27.07 8.32 Favored 'General case' 0 C--N 1.291 -1.962 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 179.363 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.504 ' HA ' ' O ' ' A' ' 77' ' ' GLU . 7.1 m 65.99 10.63 7.13 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.23 -0.919 . . . . 0.0 109.198 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.542 ' HB3' ' CE1' ' A' ' 83' ' ' PHE . 28.5 tt0 -32.78 -43.03 0.09 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.868 -0.52 . . . . 0.0 111.821 -179.499 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.562 ' N ' ' CD1' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -99.6 -160.3 0.79 Allowed 'General case' 0 C--N 1.296 -1.742 0 CA-C-O 122.864 1.316 . . . . 0.0 109.738 -179.043 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.483 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 1.0 OUTLIER -148.43 123.02 9.8 Favored 'General case' 0 C--N 1.278 -2.53 0 CA-C-N 114.314 -1.312 . . . . 0.0 109.051 179.603 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.54 ' N ' ' HG2' ' A' ' 77' ' ' GLU . 14.2 p -69.38 -16.23 63.47 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.205 -0.934 . . . . 0.0 109.656 -179.56 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.406 ' OXT' ' O ' ' A' ' 85' ' ' THR . 1.5 mtt180 . . . . . 0 C--N 1.295 -1.798 0 CA-C-O 118.03 -0.986 . . . . 0.0 109.588 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.546 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.402 ' O ' ' CB ' ' A' ' 3' ' ' SER . 4.5 p30 -148.2 124.76 11.05 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.25 -0.906 . . . . 0.0 109.677 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.402 ' CB ' ' O ' ' A' ' 2' ' ' ASN . 0.4 OUTLIER 171.15 45.12 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.284 -0.885 . . . . 0.0 109.304 179.96 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.569 ' CE1' ' O ' ' A' ' 21' ' ' ALA . 1.5 p90 -80.2 7.89 8.43 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.249 -0.907 . . . . 0.0 109.577 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.526 ' CD1' ' HB3' ' A' ' 23' ' ' SER . 1.0 OUTLIER -71.33 -24.01 62.03 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.999 -1.063 . . . . 0.0 108.963 -179.826 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' CGU . . . . . 0.487 ' C ' ' O ' ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' CGU . . . . . 0.428 ' O ' ' C ' ' A' ' 8' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.594 ' CG2' ' O ' ' A' ' 8' ' ' VAL . 2.7 m -39.68 102.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 CA-C-O 122.706 1.241 . . . . 0.0 109.489 -178.455 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.551 ' O ' ' CG ' ' A' ' 10' ' ' GLN . 27.5 mttp -45.1 -20.28 0.04 OUTLIER 'General case' 0 C--N 1.284 -2.245 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.531 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.551 ' CG ' ' O ' ' A' ' 9' ' ' LYS . 19.3 pt20 42.3 53.09 4.55 Favored 'General case' 0 N--CA 1.483 1.223 0 O-C-N 121.079 -1.013 . . . . 0.0 109.825 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -131.5 144.91 16.57 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.927 -1.269 . . . . 0.0 109.927 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.522 ' HB2' ' CD1' ' A' ' 16' ' ' CGU . 5.5 m120 60.92 152.89 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.521 -0.988 . . . . 0.0 110.111 179.734 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.487 ' HA ' HG13 ' A' ' 30' ' ' VAL . 3.2 mp -75.42 -97.19 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.164 0 O-C-N 121.084 -1.01 . . . . 0.0 110.582 -179.447 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' CGU . . . . . 0.514 OE11 ' N ' ' A' ' 15' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.514 ' N ' OE11 ' A' ' 14' ' ' CGU . 4.0 mtt180 -62.92 -22.46 66.77 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 120.512 -1.368 . . . . 0.0 109.927 -179.39 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' CGU . . . . . 0.522 ' CD1' ' HB2' ' A' ' 12' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.539 ' HA ' ' HB3' ' A' ' 22' ' ' CYS . 1.6 t -100.9 1.07 39.55 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.998 -1.064 . . . . 0.0 109.52 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.564 ' HG ' ' CB ' ' A' ' 48' ' ' ASP . 0.4 OUTLIER -64.43 -15.57 60.85 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.526 -1.359 . . . . 0.0 110.197 179.56 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' CGU . . . . . 0.446 ' C ' ' H ' ' A' ' 21' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.569 ' O ' ' CE1' ' A' ' 4' ' ' PHE . . . -76.2 6.53 5.3 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.387 -0.821 . . . . 0.0 110.804 -179.171 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.539 ' HB3' ' HA ' ' A' ' 17' ' ' CYS . 11.9 p -139.68 -150.62 0.33 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.704 -1.247 . . . . 0.0 110.803 -179.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.526 ' HB3' ' CD1' ' A' ' 5' ' ' LEU . 47.1 t -166.52 -70.5 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.646 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.5 ' CD2' ' O ' ' A' ' 23' ' ' SER . 0.2 OUTLIER -152.48 -82.06 0.09 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.276 -0.89 . . . . 0.0 109.726 179.824 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' CGU . . . . . 0.433 OE11 OE12 ' A' ' 29' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' CGU . . . . . 0.591 ' CD1' ' C ' ' A' ' 26' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.595 ' O ' ' CE1' ' A' ' 31' ' ' PHE . . . -76.92 -46.31 24.73 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.874 -1.142 . . . . 0.0 110.242 -179.589 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.453 ' CG ' HH11 ' A' ' 28' ' ' ARG . 0.0 OUTLIER -73.57 3.68 5.92 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 120.59 -1.318 . . . . 0.0 110.396 179.569 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' CGU . . . . . 0.433 OE12 OE11 ' A' ' 25' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.493 HG12 ' O ' ' A' ' 12' ' ' ASN . 58.8 t -106.15 -50.01 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 120.714 -1.241 . . . . 0.0 110.833 -179.719 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.595 ' CE1' ' O ' ' A' ' 27' ' ' ALA . 0.0 OUTLIER -107.89 146.91 31.68 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 120.713 -1.242 . . . . 0.0 112.233 -178.993 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' CGU . . . . . 0.418 ' O ' ' C ' ' A' ' 33' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.515 ' OD2' ' CE1' ' A' ' 31' ' ' PHE . 51.3 p-10 -38.73 101.25 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.544 0 CA-C-O 121.759 0.79 . . . . 0.0 111.795 -177.293 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.563 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -80.28 -25.4 39.45 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 178.143 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.647 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 81.1 mt-30 -51.61 -38.59 55.29 Favored 'General case' 0 C--O 1.203 -1.393 0 O-C-N 120.947 -1.095 . . . . 0.0 108.299 178.481 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.676 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 1.0 OUTLIER -42.26 -57.46 2.54 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.292 -1.505 . . . . 0.0 107.774 179.061 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.63 ' O ' ' C ' ' A' ' 39' ' ' CGU . 1.9 t70 -80.85 -69.19 0.62 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 120.875 -1.141 . . . . 0.0 108.666 176.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' CGU . . . . . 0.63 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.647 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 14.2 t80 -39.56 -52.44 2.18 Favored 'General case' 0 C--N 1.295 -1.765 0 O-C-N 121.923 -0.485 . . . . 0.0 110.008 178.474 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.676 ' CD1' ' O ' ' A' ' 37' ' ' THR . 7.7 m95 -77.64 -66.0 0.89 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.563 -0.71 . . . . 0.0 112.648 -178.58 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.496 ' OG ' ' N ' ' A' ' 43' ' ' LYS . 0.1 OUTLIER -42.55 -73.4 0.05 OUTLIER 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.738 -1.226 . . . . 0.0 112.223 -177.344 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.564 ' HD2' ' CG2' ' A' ' 65' ' ' ILE . 0.0 OUTLIER -81.32 35.9 0.4 Allowed 'General case' 0 C--N 1.286 -2.162 0 O-C-N 121.544 -0.723 . . . . 0.0 109.814 -178.874 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.578 ' CE1' ' OD1' ' A' ' 48' ' ' ASP . 0.6 OUTLIER -80.03 12.9 2.5 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.135 -0.978 . . . . 0.0 110.695 -179.709 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 4.6 mttm -86.77 55.01 3.37 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 120.964 -1.085 . . . . 0.0 108.377 179.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -131.64 4.5 4.25 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.501 -0.749 . . . . 0.0 110.128 -178.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.558 ' O ' ' CB ' ' A' ' 51' ' ' GLU . . . 72.49 29.23 66.21 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 108.606 -1.798 . . . . 0.0 108.606 -179.308 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.578 ' OD1' ' CE1' ' A' ' 44' ' ' TYR . 0.0 OUTLIER 46.58 21.57 0.14 Allowed 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.482 -1.01 . . . . 0.0 110.329 -179.868 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.637 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 33.2 mm-40 59.06 -92.29 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.453 0 O-C-N 120.973 -1.079 . . . . 0.0 111.157 178.036 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . 0.511 ' CB ' ' OB ' ' A' ' 63' ' ' BHD . 36.5 t -45.87 -25.64 0.56 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.183 -0.948 . . . . 0.0 110.862 -178.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.558 ' CB ' ' O ' ' A' ' 47' ' ' GLY . 20.1 tt0 -49.43 148.55 2.67 Favored 'General case' 0 N--CA 1.485 1.312 0 O-C-N 120.577 -1.327 . . . . 0.0 108.708 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.459 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . 90.8 -15.92 59.47 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 110.078 -1.209 . . . . 0.0 110.078 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.46 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 30.7 t60 65.03 64.26 1.06 Allowed Pre-proline 0 N--CA 1.493 1.72 0 O-C-N 121.144 -1.209 . . . . 0.0 109.599 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.461 ' HD3' ' O ' ' A' ' 50' ' ' CYS . 4.9 Cg_exo -61.19 -39.5 58.08 Favored 'Trans proline' 0 C--N 1.31 -1.5 0 C-N-CA 122.604 2.203 . . . . 0.0 110.604 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.482 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 1.8 m -71.51 173.05 8.48 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.381 -0.824 . . . . 0.0 109.304 -179.576 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.547 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.6 mt -146.6 -176.84 5.34 Favored 'General case' 0 N--CA 1.492 1.635 0 CA-C-O 122.231 1.015 . . . . 0.0 109.906 179.466 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.615 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 1.6 m120 45.84 61.33 2.7 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.513 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.415 ' HG3' ' C ' ' A' ' 57' ' ' ASN . 3.4 mt-30 46.54 33.36 1.96 Allowed 'General case' 0 C--N 1.299 -1.591 0 C-N-CA 119.468 -0.893 . . . . 0.0 109.384 177.828 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -73.93 145.71 35.53 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.669 -1.373 . . . . 0.0 109.669 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.437 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 1.3 t60 -79.91 115.8 19.7 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.208 -1.172 . . . . 0.0 109.021 179.701 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.482 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 44.5 t -91.92 134.37 34.85 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.102 -0.999 . . . . 0.0 110.092 -179.438 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.49 ' HB2' ' O ' ' A' ' 69' ' ' THR . 2.1 tttp -117.74 115.08 24.31 Favored 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 106.919 -1.511 . . . . 0.0 106.919 178.237 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' BHD . . . . . 0.531 ' OD1' ' CD1' ' A' ' 18' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.513 ' O ' ' O ' ' A' ' 67' ' ' ASP . . . 147.69 138.32 3.06 Favored Glycine 0 N--CA 1.488 2.161 0 N-CA-C 107.71 -2.156 . . . . 0.0 107.71 -179.243 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.564 ' CG2' ' HD2' ' A' ' 43' ' ' LYS . 0.4 OUTLIER -53.31 -61.98 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 O-C-N 120.461 -1.611 . . . . 0.0 109.216 -179.088 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . 0.496 ' N ' HG23 ' A' ' 65' ' ' ILE . . . -43.68 -38.46 4.26 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 110.029 -1.228 . . . . 0.0 110.029 -179.469 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.523 ' OD1' ' N ' ' A' ' 68' ' ' TYR . 1.6 p30 179.29 -157.16 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.255 -1.144 . . . . 0.0 110.094 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.647 ' N ' ' CD1' ' A' ' 68' ' ' TYR . 3.1 p90 -150.66 124.84 9.39 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.121 -0.987 . . . . 0.0 108.919 -178.82 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.49 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 70.3 p -95.34 119.33 33.67 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 120.898 -1.126 . . . . 0.0 109.201 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 9.5 m -79.11 -171.46 2.67 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.664 -1.273 . . . . 0.0 108.382 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.437 ' HB ' ' HB3' ' A' ' 60' ' ' HIS . 5.1 m -161.19 145.1 13.21 Favored 'General case' 0 C--N 1.285 -2.198 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 179.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.479 ' O ' ' O ' ' A' ' 73' ' ' ALA . 73.8 m -109.06 118.34 36.53 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.176 -0.953 . . . . 0.0 108.974 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.611 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . . . -47.89 -178.02 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.066 -1.021 . . . . 0.0 110.42 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -80.51 100.67 8.67 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-O 123.2 1.476 . . . . 0.0 108.065 178.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . 0.46 ' O ' ' OG1' ' A' ' 85' ' ' THR . . . 119.17 18.5 4.58 Favored Glycine 0 C--N 1.269 -3.148 0 CA-C-N 113.575 -1.648 . . . . 0.0 108.994 -179.208 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.615 ' CE2' ' O ' ' A' ' 57' ' ' ASN . 4.8 m-85 -115.58 160.07 20.46 Favored 'General case' 0 C--N 1.294 -1.813 0 O-C-N 121.372 -1.076 . . . . 0.0 109.726 -178.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.591 ' HG3' ' CD2' ' A' ' 83' ' ' PHE . 19.3 pt-20 -160.72 167.26 27.26 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.158 -0.964 . . . . 0.0 110.304 -179.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 108.28 166.68 21.22 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 110.105 -1.198 . . . . 0.0 110.105 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.39 -47.49 72.66 Favored 'General case' 0 C--N 1.307 -1.251 0 O-C-N 121.371 -1.076 . . . . 0.0 109.638 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.547 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 2.9 m-20 -111.79 32.57 5.36 Favored 'General case' 0 C--N 1.287 -2.129 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 179.272 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.497 ' HA ' ' O ' ' A' ' 77' ' ' GLU . 3.3 m 52.27 67.82 0.92 Allowed 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 105.67 -1.974 . . . . 0.0 105.67 -177.215 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.433 ' C ' ' OD1' ' A' ' 57' ' ' ASN . 37.9 tt0 -103.52 -25.2 13.31 Favored 'General case' 0 C--N 1.306 -1.29 0 O-C-N 121.589 -0.694 . . . . 0.0 111.067 -176.558 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.632 ' N ' ' CD1' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -99.53 74.84 1.91 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.898 -1.126 . . . . 0.0 109.212 -179.827 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.444 ' C ' ' O ' ' A' ' 83' ' ' PHE . 0.3 OUTLIER -43.66 94.97 0.01 OUTLIER 'General case' 0 C--N 1.293 -1.862 0 C-N-CA 119.697 -0.801 . . . . 0.0 109.521 -179.82 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.563 ' CG2' ' HG2' ' A' ' 77' ' ' GLU . 5.8 p -68.38 -11.69 59.98 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.339 -0.851 . . . . 0.0 109.822 -179.639 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.439 ' OXT' ' O ' ' A' ' 85' ' ' THR . 3.5 mtp180 . . . . . 0 C--N 1.299 -1.605 0 CA-C-O 118.034 -0.984 . . . . 0.0 109.936 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.497 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -143.85 86.54 1.87 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.242 -0.911 . . . . 0.0 109.648 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.6 t -80.9 155.33 26.57 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.275 -0.891 . . . . 0.0 109.145 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.545 ' CE2' ' HA ' ' A' ' 22' ' ' CYS . 6.3 p90 -77.06 -2.75 35.68 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.167 -0.958 . . . . 0.0 109.408 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.511 ' O ' ' C ' ' A' ' 6' ' ' CGU . 0.4 OUTLIER -66.04 -36.35 83.0 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.236 -0.915 . . . . 0.0 109.532 -179.907 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' CGU . . . . . 0.535 ' CD2' ' N ' ' A' ' 6' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' CGU . . . . . 0.485 ' O ' ' N ' ' A' ' 9' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.562 ' CG2' ' O ' ' A' ' 8' ' ' VAL . 11.4 m -39.54 97.71 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.307 -1.256 0 CA-C-O 122.402 1.096 . . . . 0.0 110.037 -178.872 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.51 ' O ' ' N ' ' A' ' 11' ' ' GLY . 8.1 tptt -47.5 92.68 0.01 OUTLIER 'General case' 0 C--N 1.285 -2.239 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 179.505 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.531 ' N ' ' O ' ' A' ' 8' ' ' VAL . 0.9 OUTLIER -39.04 94.56 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.54 -0.725 . . . . 0.0 110.005 -179.037 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.51 ' N ' ' O ' ' A' ' 9' ' ' LYS . . . 81.73 131.83 1.38 Allowed Glycine 0 N--CA 1.493 2.445 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.53 ' CB ' ' HB2' ' A' ' 16' ' ' CGU . 0.5 OUTLIER -169.9 158.62 7.38 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.228 -1.16 . . . . 0.0 109.668 -179.936 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.486 ' CD2' ' N ' ' A' ' 13' ' ' LEU . 3.4 mm? -110.91 -173.73 2.31 Favored 'General case' 0 N--CA 1.48 1.054 0 O-C-N 121.069 -1.02 . . . . 0.0 109.05 179.696 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' CGU . . . . . 0.637 ' C ' ' CD2' ' A' ' 14' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.602 ' CB ' ' CZ ' ' A' ' 15' ' ' ARG . 0.4 OUTLIER -76.79 -48.78 17.56 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.273 -0.892 . . . . 0.0 109.243 179.443 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' CGU . . . . . 0.53 ' HB2' ' CB ' ' A' ' 12' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.504 ' O ' ' HB2' ' A' ' 22' ' ' CYS . 0.6 OUTLIER -167.34 43.76 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.091 -1.078 . . . . 0.0 108.091 -179.235 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.546 ' CA ' ' O ' ' A' ' 14' ' ' CGU . 0.3 OUTLIER -56.66 -117.41 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.873 -0.517 . . . . 0.0 110.011 -179.713 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.403 ' O ' ' HA ' ' A' ' 17' ' ' CYS . . . -93.28 12.76 23.49 Favored 'General case' 0 C--N 1.297 -1.681 0 O-C-N 121.454 -0.779 . . . . 0.0 109.062 179.597 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.545 ' HA ' ' CE2' ' A' ' 4' ' ' PHE . 1.7 t -130.67 173.24 11.1 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.397 -0.814 . . . . 0.0 109.379 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.525 ' O ' ' CB ' ' A' ' 24' ' ' LEU . 30.4 t -135.91 -0.74 2.52 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.217 -0.927 . . . . 0.0 109.934 179.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.525 ' CB ' ' O ' ' A' ' 23' ' ' SER . 0.1 OUTLIER 80.93 -35.04 0.12 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.212 -0.93 . . . . 0.0 110.465 179.966 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' CGU . . . . . 0.415 ' O ' OE12 ' A' ' 29' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' CGU . . . . . 0.523 ' CD1' HG22 ' A' ' 30' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.432 ' HB3' ' SG ' ' A' ' 22' ' ' CYS . . . -60.17 -13.91 14.63 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.975 -1.078 . . . . 0.0 109.555 -179.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -80.27 -54.6 5.58 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 122.19 0.995 . . . . 0.0 110.394 -179.651 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' CGU . . . . . 0.415 OE12 ' O ' ' A' ' 25' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.523 HG22 ' CD1' ' A' ' 26' ' ' CGU . 5.3 t -88.57 -28.71 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.173 -0.954 . . . . 0.0 109.801 -179.711 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.584 ' CE2' ' CE2' ' A' ' 40' ' ' PHE . 1.9 m-85 -103.54 92.37 4.43 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 120.885 -1.134 . . . . 0.0 109.831 -179.694 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' CGU . . . . . 0.439 ' O ' ' C ' ' A' ' 33' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.577 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 22.6 m-20 -39.95 125.72 1.96 Allowed 'General case' 0 C--N 1.303 -1.45 0 CA-C-O 121.255 0.55 . . . . 0.0 110.69 -179.416 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.522 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -79.85 -31.43 40.48 Favored 'General case' 0 N--CA 1.487 1.375 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 178.611 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' CGU . . . . . 0.462 ' O ' ' HB3' ' A' ' 39' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.661 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 5.8 mm100 -52.98 -37.15 61.0 Favored 'General case' 0 C--O 1.203 -1.376 0 O-C-N 120.55 -1.344 . . . . 0.0 108.216 178.535 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.614 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -41.55 -60.09 1.42 Allowed 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.164 -1.585 . . . . 0.0 107.926 179.056 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.601 ' O ' ' C ' ' A' ' 39' ' ' CGU . 1.8 t70 -81.44 -65.87 0.96 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.337 -0.852 . . . . 0.0 109.263 177.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' CGU . . . . . 0.601 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.661 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 20.6 t80 -39.49 -49.34 2.09 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 178.655 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.614 ' CD1' ' O ' ' A' ' 37' ' ' THR . 9.5 m95 -80.94 -71.85 0.45 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.778 -0.576 . . . . 0.0 112.101 -179.176 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.52 ' OG ' ' N ' ' A' ' 43' ' ' LYS . 1.1 p -53.77 -60.34 3.45 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.435 -1.416 . . . . 0.0 110.711 -178.113 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.531 ' CD ' OE11 ' A' ' 39' ' ' CGU . 0.3 OUTLIER -62.38 -13.71 32.21 Favored 'General case' 0 C--N 1.284 -2.246 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 -179.738 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.707 ' O ' ' N ' ' A' ' 46' ' ' ASP . 0.9 OUTLIER -43.23 -65.72 0.46 Allowed 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.31 -0.869 . . . . 0.0 109.0 -179.769 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.543 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.2 OUTLIER -15.58 73.34 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.719 0 CA-C-O 121.203 0.525 . . . . 0.0 111.272 -179.938 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.707 ' N ' ' O ' ' A' ' 44' ' ' TYR . 2.6 t0 -161.71 -30.26 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.215 -0.928 . . . . 0.0 110.414 -178.602 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.491 ' O ' ' OD2' ' A' ' 48' ' ' ASP . . . 105.34 16.15 17.19 Favored Glycine 0 N--CA 1.486 1.999 0 N-CA-C 108.15 -1.98 . . . . 0.0 108.15 -178.199 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.652 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER 72.21 9.23 5.93 Favored 'General case' 0 N--CA 1.504 2.244 0 O-C-N 121.777 -0.837 . . . . 0.0 109.988 -179.704 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.652 ' HB2' ' O ' ' A' ' 48' ' ' ASP . 32.5 mm-40 79.42 -25.13 0.19 Allowed 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.77 -0.581 . . . . 0.0 111.807 178.609 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 19.2 t -111.8 -14.49 13.55 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.676 -1.265 . . . . 0.0 110.349 -179.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.487 ' CB ' ' O ' ' A' ' 47' ' ' GLY . 13.9 tt0 -54.98 -20.39 9.0 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 120.943 -1.098 . . . . 0.0 111.514 -179.34 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.415 ' O ' ' C ' ' A' ' 53' ' ' HIS . . . -95.94 21.74 43.31 Favored Glycine 0 N--CA 1.497 2.708 0 O-C-N 120.701 -1.25 . . . . 0.0 111.244 -178.518 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.557 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 13.2 t60 42.94 54.66 10.27 Favored Pre-proline 0 N--CA 1.493 1.717 0 O-C-N 120.956 -1.32 . . . . 0.0 109.721 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.557 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 6.3 Cg_exo -57.89 -39.43 86.71 Favored 'Trans proline' 0 C--N 1.309 -1.542 0 C-N-CA 122.537 2.158 . . . . 0.0 111.846 -179.633 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.479 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 1.0 OUTLIER -83.84 158.84 21.52 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.083 -1.011 . . . . 0.0 110.348 -178.405 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.518 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.4 mt -144.69 -172.84 3.9 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.434 -0.791 . . . . 0.0 109.516 -179.83 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.641 ' HB3' ' CD2' ' A' ' 76' ' ' PHE . 8.1 m-80 46.78 58.81 4.38 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-O 121.827 0.822 . . . . 0.0 110.363 178.662 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.566 ' OE1' ' CZ ' ' A' ' 76' ' ' PHE . 8.4 mt-30 52.64 30.16 8.31 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-O 121.489 0.662 . . . . 0.0 109.54 177.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . 0.423 ' HA2' ' O ' ' A' ' 71' ' ' THR . . . -82.31 141.32 21.29 Favored Glycine 0 N--CA 1.489 2.217 0 N-CA-C 109.728 -1.349 . . . . 0.0 109.728 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -79.39 149.71 31.57 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.193 -1.18 . . . . 0.0 108.036 179.137 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.479 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 41.0 t -119.55 113.79 21.26 Favored 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 119.027 -1.069 . . . . 0.0 111.254 -178.529 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.404 ' HB3' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER -97.29 -178.14 4.07 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 105.454 -2.054 . . . . 0.0 105.454 176.595 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' BHD . . . . . 0.553 ' OD2' ' CD1' ' A' ' 14' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.503 ' O ' ' O ' ' A' ' 67' ' ' ASP . . . 135.19 132.93 3.21 Favored Glycine 0 N--CA 1.488 2.142 0 N-CA-C 107.438 -2.265 . . . . 0.0 107.438 -178.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.522 HG23 ' N ' ' A' ' 66' ' ' GLY . 0.0 OUTLIER -45.53 -56.21 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 120.662 -1.493 . . . . 0.0 109.132 -178.826 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . 0.522 ' N ' HG23 ' A' ' 65' ' ' ILE . . . -44.04 -43.58 7.09 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.503 ' O ' ' O ' ' A' ' 64' ' ' GLY . 2.1 p-10 178.44 -154.87 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.408 -1.054 . . . . 0.0 109.686 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.648 ' N ' ' CD1' ' A' ' 68' ' ' TYR . 1.9 p90 -144.82 157.73 44.06 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 120.859 -1.151 . . . . 0.0 109.962 -179.211 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.404 ' OG1' ' HB3' ' A' ' 62' ' ' LYS . 73.7 p -122.52 115.15 21.69 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.429 -0.795 . . . . 0.0 109.181 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 65.8 m -84.63 -167.61 1.87 Allowed 'General case' 0 C--N 1.298 -1.643 0 O-C-N 120.889 -1.132 . . . . 0.0 108.937 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.423 ' O ' ' HA2' ' A' ' 59' ' ' GLY . 1.3 m -160.85 120.93 2.74 Favored 'General case' 0 C--N 1.29 -2.011 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.442 ' O ' ' O ' ' A' ' 73' ' ' ALA . 91.4 m -89.56 115.88 27.29 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.126 -0.983 . . . . 0.0 109.437 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.442 ' O ' ' O ' ' A' ' 72' ' ' CYS . . . -49.51 -179.42 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.481 0 O-C-N 120.915 -1.116 . . . . 0.0 110.162 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -81.03 101.3 9.47 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-O 122.97 1.367 . . . . 0.0 107.799 178.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . 0.583 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 130.99 5.11 3.97 Favored Glycine 0 C--N 1.269 -3.149 0 CA-C-N 114.003 -1.453 . . . . 0.0 110.003 -179.315 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.641 ' CD2' ' HB3' ' A' ' 57' ' ' ASN . 45.4 m-85 -133.45 154.16 51.02 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.111 -1.229 . . . . 0.0 110.606 -177.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.468 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 0.0 OUTLIER -155.92 168.22 27.91 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.247 -0.908 . . . . 0.0 110.206 -179.233 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 116.79 171.99 16.11 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 109.452 -1.459 . . . . 0.0 109.452 179.882 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.451 ' HD3' ' C ' ' A' ' 79' ' ' LYS . 0.4 OUTLIER -50.98 -56.26 13.32 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.152 -1.205 . . . . 0.0 108.65 179.687 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.518 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 1.3 m-20 -108.39 26.87 9.95 Favored 'General case' 0 C--N 1.287 -2.122 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.538 ' O ' ' ND2' ' A' ' 57' ' ' ASN . 4.1 m 63.87 14.63 8.49 Favored 'General case' 0 C--N 1.305 -1.342 0 O-C-N 121.083 -1.01 . . . . 0.0 108.372 -178.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.415 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 36.8 tt0 -38.24 -25.5 0.01 OUTLIER 'General case' 0 C--N 1.309 -1.179 0 O-C-N 121.861 -0.525 . . . . 0.0 111.71 -179.53 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.551 ' N ' ' CD1' ' A' ' 83' ' ' PHE . 0.4 OUTLIER -97.43 -161.44 0.87 Allowed 'General case' 0 C--N 1.299 -1.599 0 CA-C-O 122.836 1.303 . . . . 0.0 109.597 -179.743 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.468 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 54.7 m -161.44 93.1 0.92 Allowed 'General case' 0 C--N 1.277 -2.555 0 CA-C-N 114.302 -1.317 . . . . 0.0 109.098 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.437 ' C ' ' HG3' ' A' ' 86' ' ' ARG . 82.7 p -51.92 -58.81 5.4 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.191 -0.943 . . . . 0.0 109.885 -179.519 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.437 ' HG3' ' C ' ' A' ' 85' ' ' THR . 2.5 ppt_? . . . . . 0 C--N 1.285 -2.225 0 CA-C-O 117.997 -1.002 . . . . 0.0 109.445 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 49.08 74.5 0.18 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.288 -0.883 . . . . 0.0 109.671 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.473 ' HB2' ' HB3' ' A' ' 6' ' ' CGU . 62.5 p -66.02 90.21 0.13 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.326 -0.859 . . . . 0.0 109.257 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.579 ' CZ ' ' O ' ' A' ' 21' ' ' ALA . 17.6 t80 -73.93 -30.49 62.59 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.3 -0.875 . . . . 0.0 109.709 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.491 HD12 ' CA ' ' A' ' 26' ' ' CGU . 0.4 OUTLIER -77.33 -29.24 53.43 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.099 -1.001 . . . . 0.0 110.013 -179.432 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' CGU . . . . . 0.473 ' HB3' ' HB2' ' A' ' 3' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' CGU . . . . . 0.463 ' O ' ' C ' ' A' ' 8' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.556 ' CG2' ' O ' ' A' ' 8' ' ' VAL . 5.0 m -40.09 101.86 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.309 -1.175 0 CA-C-O 122.335 1.064 . . . . 0.0 109.255 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.459 ' C ' ' O ' ' A' ' 8' ' ' VAL . 0.0 OUTLIER -39.25 -29.26 0.04 OUTLIER 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 115.536 -0.756 . . . . 0.0 108.979 -179.796 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.486 ' N ' ' O ' ' A' ' 8' ' ' VAL . 0.7 OUTLIER -168.14 178.46 5.02 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.449 -0.782 . . . . 0.0 109.273 179.01 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -88.4 34.24 3.88 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.697 -1.361 . . . . 0.0 109.697 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.556 ' C ' ' CD1' ' A' ' 13' ' ' LEU . 1.4 t-20 -110.04 154.12 23.67 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.159 -1.2 . . . . 0.0 109.486 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.665 HD21 ' N ' ' A' ' 14' ' ' CGU . 0.0 OUTLIER -153.49 -32.16 0.12 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.075 -1.016 . . . . 0.0 109.836 178.665 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' CGU . . . . . 0.665 ' N ' HD21 ' A' ' 13' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.533 ' NH1' ' O ' ' A' ' 61' ' ' CYS . 26.5 mtm180 -75.91 -34.13 59.91 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.706 -0.621 . . . . 0.0 110.221 179.092 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' CGU . . . . . 0.48 ' HB2' ' HA ' ' A' ' 13' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.682 ' HA ' ' HB3' ' A' ' 22' ' ' CYS . 44.6 t -110.28 25.42 11.8 Favored 'General case' 0 N--CA 1.49 1.567 0 CA-C-O 122.227 1.013 . . . . 0.0 109.287 179.786 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.538 ' CD1' ' O ' ' A' ' 48' ' ' ASP . 0.1 OUTLIER -79.48 -14.32 58.97 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.146 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.579 ' O ' ' CZ ' ' A' ' 4' ' ' PHE . . . -83.22 17.92 1.9 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.108 -0.995 . . . . 0.0 110.801 -178.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.682 ' HB3' ' HA ' ' A' ' 17' ' ' CYS . 18.1 p -134.5 -163.59 1.39 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.842 -1.161 . . . . 0.0 110.491 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.531 ' O ' ' N ' ' A' ' 25' ' ' CGU . 84.4 p -170.62 137.8 1.38 Allowed 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 179.317 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.625 ' CD1' ' N ' ' A' ' 25' ' ' CGU . 0.0 OUTLIER -41.24 -21.03 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.227 -0.92 . . . . 0.0 111.042 -179.278 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' CGU . . . . . 0.625 ' N ' ' CD1' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' CGU . . . . . 0.491 ' CA ' HD12 ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.36 66.3 6.85 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 179.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.535 ' CG ' ' O ' ' A' ' 24' ' ' LEU . 4.1 mtp180 -121.35 -85.3 0.66 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.252 -0.905 . . . . 0.0 110.801 -179.345 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.583 ' CG2' ' HG ' ' A' ' 13' ' ' LEU . 1.9 t -79.26 -34.22 16.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 120.813 -1.179 . . . . 0.0 109.569 -179.614 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.632 ' CZ ' ' NE2' ' A' ' 36' ' ' GLN . 0.0 OUTLIER -122.55 123.52 41.42 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 119.138 -1.025 . . . . 0.0 110.014 178.265 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' CGU . . . . . 0.416 ' O ' ' C ' ' A' ' 33' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.565 ' HB2' ' CG ' ' A' ' 36' ' ' GLN . 4.8 m-20 -39.25 108.87 0.09 Allowed 'General case' 0 C--N 1.304 -1.402 0 CA-C-O 121.561 0.696 . . . . 0.0 111.44 -179.21 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.54 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -78.09 -25.94 47.83 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 106.12 -1.808 . . . . 0.0 106.12 177.078 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' CGU . . . . . 0.421 ' O ' ' N ' ' A' ' 39' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.691 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 0.0 OUTLIER -51.24 -35.87 39.09 Favored 'General case' 0 C--O 1.202 -1.417 0 C-N-CA 117.796 -1.562 . . . . 0.0 107.432 179.344 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.604 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -41.89 -61.89 1.03 Allowed 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 117.548 -1.661 . . . . 0.0 106.969 178.698 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.637 ' O ' ' C ' ' A' ' 39' ' ' CGU . 0.4 OUTLIER -83.69 -68.49 0.71 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.358 -0.839 . . . . 0.0 109.544 176.397 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' CGU . . . . . 0.637 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.738 ' O ' ' HB2' ' A' ' 44' ' ' TYR . 21.0 t80 -47.13 -52.95 14.09 Favored 'General case' 0 C--O 1.189 -2.103 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 178.081 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.604 ' CD1' ' O ' ' A' ' 37' ' ' THR . 16.2 m95 -80.94 -66.06 0.93 Allowed 'General case' 0 C--N 1.294 -1.817 0 O-C-N 120.656 -1.278 . . . . 0.0 112.019 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.55 ' O ' ' CB ' ' A' ' 43' ' ' LYS . 0.6 OUTLIER -71.85 79.62 0.88 Allowed 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 122.334 1.064 . . . . 0.0 109.565 -178.81 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.55 ' CB ' ' O ' ' A' ' 42' ' ' SER . 0.0 OUTLIER 153.68 -26.69 0.0 OUTLIER 'General case' 0 C--N 1.283 -2.324 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 -179.46 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.738 ' HB2' ' O ' ' A' ' 40' ' ' PHE . 22.1 t80 -80.38 -97.55 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 179.034 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.551 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.1 OUTLIER 35.84 33.41 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 -179.057 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.556 ' HB2' ' O ' ' A' ' 44' ' ' TYR . 7.4 t0 -134.21 -17.59 2.08 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.712 -176.308 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.537 ' HA2' ' CE1' ' A' ' 44' ' ' TYR . . . 45.06 60.88 3.75 Favored Glycine 0 N--CA 1.496 2.685 0 N-CA-C 106.328 -2.709 . . . . 0.0 106.328 -177.31 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.538 ' O ' ' CD1' ' A' ' 18' ' ' LEU . 13.0 t70 -129.18 -129.22 0.21 Allowed 'General case' 0 C--N 1.308 -1.228 0 O-C-N 121.445 -1.032 . . . . 0.0 111.434 -176.166 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.529 ' HG3' ' N ' ' A' ' 67' ' ' ASP . 0.1 OUTLIER 52.04 -86.0 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.425 -0.797 . . . . 0.0 111.343 -179.385 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . 0.496 ' HA ' ' CG ' ' A' ' 54' ' ' PRO . 46.1 t -101.33 12.63 37.1 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.948 -1.095 . . . . 0.0 111.221 -178.542 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -70.19 146.05 51.02 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 120.714 -1.241 . . . . 0.0 109.008 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 90.94 -1.85 78.62 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 110.107 -1.197 . . . . 0.0 110.107 179.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.42 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 10.2 t60 62.59 66.52 1.3 Allowed Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.114 -1.227 . . . . 0.0 109.411 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.496 ' CG ' ' HA ' ' A' ' 50' ' ' CYS . 3.0 Cg_exo -61.97 -52.93 2.4 Favored 'Trans proline' 0 C--N 1.309 -1.502 0 C-N-CA 122.42 2.08 . . . . 0.0 111.259 -179.666 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.494 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 1.8 m -65.76 160.72 22.35 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.093 -1.005 . . . . 0.0 109.178 -179.349 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.475 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.3 mt -145.21 -173.83 4.21 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.195 -0.941 . . . . 0.0 110.026 -179.573 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.651 ' HB3' ' CD2' ' A' ' 76' ' ' PHE . 8.2 m-80 45.68 59.7 3.51 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-O 121.995 0.902 . . . . 0.0 110.281 178.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.447 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 2.2 mm-40 53.66 30.18 10.58 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-O 121.521 0.677 . . . . 0.0 109.709 177.678 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . 0.479 ' HA2' ' O ' ' A' ' 71' ' ' THR . . . -81.58 131.13 10.17 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.435 -1.466 . . . . 0.0 109.435 179.752 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -79.63 123.48 27.67 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.116 -1.226 . . . . 0.0 109.019 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.533 ' O ' ' NH1' ' A' ' 15' ' ' ARG . 39.0 t -91.96 148.98 21.79 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.383 -0.823 . . . . 0.0 110.397 -179.046 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 69' ' ' THR . 0.9 OUTLIER -136.56 102.36 4.91 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 178.446 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' BHD . . . . . 0.528 ' OB ' ' CG ' ' A' ' 15' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.556 ' O ' ' O ' ' A' ' 65' ' ' ILE . . . 153.27 33.25 0.03 OUTLIER Glycine 0 N--CA 1.488 2.106 0 C-N-CA 119.527 -1.321 . . . . 0.0 110.95 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.558 ' CD1' ' HA ' ' A' ' 44' ' ' TYR . 0.1 OUTLIER 54.97 143.34 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.258 -1.142 . . . . 0.0 109.975 179.776 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 85.07 -43.47 3.26 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 108.223 -1.951 . . . . 0.0 108.223 -178.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.529 ' N ' ' HG3' ' A' ' 49' ' ' GLN . 1.8 p-10 -176.15 -157.46 0.05 Allowed 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.488 -1.007 . . . . 0.0 109.162 178.51 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.704 ' N ' ' CD1' ' A' ' 68' ' ' TYR . 4.0 p90 -160.71 125.46 3.69 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.303 -0.873 . . . . 0.0 108.759 -177.724 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.473 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 73.3 p -85.48 128.21 34.66 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 120.492 -1.38 . . . . 0.0 109.66 179.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 31.0 m -92.89 -170.91 2.56 Favored 'General case' 0 C--N 1.306 -1.287 0 O-C-N 120.972 -1.08 . . . . 0.0 108.422 179.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.479 ' O ' ' HA2' ' A' ' 59' ' ' GLY . 9.0 m -161.34 112.65 1.76 Allowed 'General case' 0 C--N 1.289 -2.06 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.571 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 99.6 m -79.74 121.19 25.03 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 120.96 -1.088 . . . . 0.0 108.766 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -52.05 175.34 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.403 0 O-C-N 120.937 -1.102 . . . . 0.0 109.732 -179.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -80.75 101.33 9.25 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-O 123.022 1.391 . . . . 0.0 107.788 178.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . 0.553 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 131.45 5.99 3.53 Favored Glycine 0 C--N 1.27 -3.126 0 CA-C-N 113.905 -1.498 . . . . 0.0 110.184 -179.374 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.651 ' CD2' ' HB3' ' A' ' 57' ' ' ASN . 27.1 m-85 -130.64 160.78 33.22 Favored 'General case' 0 C--N 1.299 -1.626 0 O-C-N 121.041 -1.27 . . . . 0.0 110.6 -178.238 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.473 ' C ' ' HA ' ' A' ' 81' ' ' CYS . 0.8 OUTLIER -159.44 169.23 24.37 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.119 -0.988 . . . . 0.0 110.494 -179.387 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 115.83 173.49 17.35 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 109.322 -1.511 . . . . 0.0 109.322 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.55 -57.47 7.02 Favored 'General case' 0 C--N 1.306 -1.301 0 O-C-N 121.088 -1.242 . . . . 0.0 109.018 179.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.488 ' O ' ' CB ' ' A' ' 81' ' ' CYS . 2.7 m-20 -108.51 23.94 13.78 Favored 'General case' 0 C--N 1.29 -2.013 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 178.762 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.545 ' O ' ' ND2' ' A' ' 57' ' ' ASN . 3.3 m 72.05 15.47 5.55 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.078 -1.014 . . . . 0.0 108.566 -179.451 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 34.8 tt0 -39.42 -25.13 0.02 OUTLIER 'General case' 0 C--N 1.308 -1.239 0 O-C-N 121.772 -0.58 . . . . 0.0 112.348 -179.266 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.52 ' N ' ' CD1' ' A' ' 83' ' ' PHE . 0.4 OUTLIER -101.96 -161.84 0.88 Allowed 'General case' 0 C--N 1.299 -1.608 0 CA-C-O 122.91 1.338 . . . . 0.0 110.092 -179.079 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.497 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 8.0 m -156.36 99.07 1.89 Allowed 'General case' 0 C--N 1.278 -2.515 0 CA-C-N 114.13 -1.396 . . . . 0.0 109.069 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 77.9 p -58.29 -55.48 34.46 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.085 -1.009 . . . . 0.0 109.764 -179.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.473 ' HG2' ' HA2' ' A' ' 75' ' ' GLY . 0.0 OUTLIER . . . . . 0 C--N 1.285 -2.208 0 CA-C-O 117.984 -1.008 . . . . 0.0 109.411 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.513 ' OD1' ' N ' ' A' ' 3' ' ' SER . 17.7 t-20 -79.27 -98.19 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.301 -0.874 . . . . 0.0 109.346 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.513 ' N ' ' OD1' ' A' ' 2' ' ' ASN . 16.2 t 54.38 -89.95 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.0 -1.062 . . . . 0.0 109.923 179.645 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.559 ' CE1' HD11 ' A' ' 5' ' ' LEU . 38.3 p90 -62.3 -11.91 17.86 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.201 -0.937 . . . . 0.0 109.818 -179.467 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.559 HD11 ' CE1' ' A' ' 4' ' ' PHE . 0.2 OUTLIER -63.77 -32.37 73.85 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.084 -1.01 . . . . 0.0 109.435 179.979 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' CGU . . . . . 0.478 ' C ' ' O ' ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' CGU . . . . . 0.463 ' O ' ' N ' ' A' ' 9' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.583 ' CG2' ' O ' ' A' ' 8' ' ' VAL . 4.7 m -40.15 99.29 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.308 -1.203 0 CA-C-O 122.391 1.091 . . . . 0.0 109.761 -179.364 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.463 ' N ' ' O ' ' A' ' 7' ' ' CGU . 8.2 mtmt -51.43 89.08 0.0 OUTLIER 'General case' 0 C--N 1.283 -2.31 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.54 ' N ' ' O ' ' A' ' 8' ' ' VAL . 0.4 OUTLIER -47.24 127.58 10.83 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.101 -1.0 . . . . 0.0 109.284 -179.257 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -121.93 -52.26 0.23 Allowed Glycine 0 N--CA 1.49 2.283 0 C-N-CA 119.723 -1.227 . . . . 0.0 110.293 -179.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.477 ' O ' ' HB3' ' A' ' 16' ' ' CGU . 5.1 t-20 -170.12 -167.09 0.6 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.121 -1.223 . . . . 0.0 109.553 -179.493 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.572 ' O ' ' CD1' ' A' ' 14' ' ' CGU . 3.4 mm? -110.37 124.77 52.31 Favored 'General case' 0 C--N 1.309 -1.185 0 O-C-N 120.775 -1.203 . . . . 0.0 108.999 -179.72 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' CGU . . . . . 0.588 ' HA ' ' CE2' ' A' ' 40' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.583 ' CB ' ' CZ ' ' A' ' 15' ' ' ARG . 2.3 mtm-85 -83.31 18.73 1.68 Allowed 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.281 -0.887 . . . . 0.0 109.333 178.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' CGU . . . . . 0.537 ' C ' ' SG ' ' A' ' 17' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.758 ' HB3' ' C ' ' A' ' 21' ' ' ALA . 3.6 m -164.12 61.28 0.15 Allowed 'General case' 0 C--N 1.307 -1.247 0 CA-C-O 123.024 1.392 . . . . 0.0 107.891 178.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.564 ' CD1' ' HB2' ' A' ' 48' ' ' ASP . 0.4 OUTLIER -105.35 -35.06 7.65 Favored 'General case' 0 C--N 1.286 -2.176 0 CA-C-N 114.43 -1.259 . . . . 0.0 107.62 177.488 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' CGU . . . . . 0.41 ' C ' ' H ' ' A' ' 21' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' CGU . . . . . 0.477 ' C ' ' N ' ' A' ' 22' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.758 ' C ' ' HB3' ' A' ' 17' ' ' CYS . . . 43.34 33.11 0.56 Allowed 'General case' 0 C--N 1.306 -1.299 0 CA-C-O 122.746 1.26 . . . . 0.0 108.698 -179.476 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.486 ' SG ' ' HB2' ' A' ' 26' ' ' CGU . 17.0 p 20.14 -142.2 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 CA-C-N 113.342 -1.754 . . . . 0.0 112.397 177.599 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.464 ' O ' ' N ' ' A' ' 25' ' ' CGU . 32.2 t -127.21 58.47 1.45 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.849 -1.157 . . . . 0.0 111.168 -178.4 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.578 ' HA ' ' CH2' ' A' ' 41' ' ' TRP . 0.2 OUTLIER 50.55 -90.12 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.234 -0.916 . . . . 0.0 111.229 178.372 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' CGU . . . . . 0.48 ' C ' ' O ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' CGU . . . . . 0.517 ' HG ' ' CG1' ' A' ' 8' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.595 ' O ' ' CE1' ' A' ' 31' ' ' PHE . . . -70.56 -22.8 62.55 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.932 -1.105 . . . . 0.0 110.427 -179.349 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 25' ' ' CGU . 1.3 ptm180 -65.64 -15.13 62.47 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.929 -1.107 . . . . 0.0 110.077 -179.305 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.49 HG13 ' O ' ' A' ' 27' ' ' ALA . 1.7 p -87.2 -42.69 15.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 120.912 -1.117 . . . . 0.0 109.954 -179.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.595 ' CE1' ' O ' ' A' ' 27' ' ' ALA . 0.1 OUTLIER -116.67 136.63 52.81 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.922 -1.111 . . . . 0.0 111.025 -179.854 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' CGU . . . . . 0.445 OE11 ' O ' ' A' ' 32' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.573 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 0.8 OUTLIER -39.97 115.87 0.58 Allowed 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.648 -0.657 . . . . 0.0 111.583 -178.386 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.489 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -77.41 -27.57 52.4 Favored 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 106.477 -1.675 . . . . 0.0 106.477 177.432 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' CGU . . . . . 0.612 ' N ' ' CD2' ' A' ' 35' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.632 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 23.1 mt-30 -49.06 -35.71 16.51 Favored 'General case' 0 C--O 1.205 -1.289 0 C-N-CA 118.424 -1.311 . . . . 0.0 108.445 179.131 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.67 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -43.11 -59.35 2.08 Favored 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 117.709 -1.596 . . . . 0.0 107.317 178.502 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.584 ' O ' ' C ' ' A' ' 39' ' ' CGU . 1.0 OUTLIER -81.92 -68.45 0.7 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.277 -0.89 . . . . 0.0 109.405 177.195 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' CGU . . . . . 0.584 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.632 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 10.9 t80 -43.2 -56.29 3.52 Favored 'General case' 0 N--CA 1.486 1.364 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 178.468 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.67 ' CD1' ' O ' ' A' ' 37' ' ' THR . 9.9 m95 -77.07 177.35 7.88 Favored 'General case' 0 C--N 1.306 -1.304 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 176.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' SER . . . . . 0.567 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 0.1 OUTLIER 62.65 110.97 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.345 0 O-C-N 120.506 -1.371 . . . . 0.0 108.625 -179.992 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.567 ' CG ' ' O ' ' A' ' 42' ' ' SER . 0.0 OUTLIER 84.59 -25.48 0.13 Allowed 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 -178.617 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.714 ' O ' ' N ' ' A' ' 46' ' ' ASP . 1.0 OUTLIER -40.6 -63.72 0.61 Allowed 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.545 -179.948 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.513 ' C ' ' O ' ' A' ' 44' ' ' TYR . 5.6 ptmt -20.84 74.35 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.557 0 CA-C-O 121.238 0.542 . . . . 0.0 111.185 -179.469 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.714 ' N ' ' O ' ' A' ' 44' ' ' TYR . 3.8 t70 -161.82 18.46 0.1 Allowed 'General case' 0 N--CA 1.486 1.341 0 O-C-N 121.238 -0.914 . . . . 0.0 109.709 -178.382 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.509 ' O ' ' CD1' ' A' ' 18' ' ' LEU . . . 67.35 11.44 59.31 Favored Glycine 0 N--CA 1.492 2.403 0 N-CA-C 107.906 -2.078 . . . . 0.0 107.906 -177.685 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.564 ' HB2' ' CD1' ' A' ' 18' ' ' LEU . 0.3 OUTLIER 71.61 5.89 5.53 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.612 -0.934 . . . . 0.0 109.785 -179.644 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.554 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 2.9 mm100 78.09 -18.38 0.51 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.312 -0.867 . . . . 0.0 111.255 178.254 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . 0.468 ' SG ' ' O ' ' A' ' 62' ' ' LYS . 0.1 OUTLIER -108.38 -18.27 13.79 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 120.756 -1.215 . . . . 0.0 110.157 -179.683 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.427 ' O ' ' HG3' ' A' ' 51' ' ' GLU . 1.9 tt0 -50.62 -20.07 1.1 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.173 -0.954 . . . . 0.0 111.238 -179.247 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.416 ' O ' ' C ' ' A' ' 53' ' ' HIS . . . -85.63 19.94 21.58 Favored Glycine 0 N--CA 1.495 2.585 0 O-C-N 120.813 -1.179 . . . . 0.0 110.867 -178.848 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.545 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 20.3 t-160 45.03 59.55 14.02 Favored Pre-proline 0 N--CA 1.492 1.647 0 O-C-N 120.892 -1.358 . . . . 0.0 109.086 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.545 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 5.5 Cg_exo -57.74 -53.11 4.88 Favored 'Trans proline' 0 C--N 1.309 -1.541 0 C-N-CA 122.658 2.239 . . . . 0.0 111.869 -179.568 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.559 ' SG ' ' CB ' ' A' ' 61' ' ' CYS . 3.6 m -60.32 175.41 0.43 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 120.836 -1.165 . . . . 0.0 110.046 -178.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.497 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 4.9 mt -148.87 -174.98 4.77 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-O 121.647 0.737 . . . . 0.0 109.121 179.198 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.634 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 54.5 m-80 39.14 64.01 0.87 Allowed 'General case' 0 C--N 1.299 -1.591 0 CA-C-O 121.886 0.851 . . . . 0.0 109.662 -179.664 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.443 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 0.2 OUTLIER 51.75 35.74 16.02 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 121.667 0.746 . . . . 0.0 109.328 178.148 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -86.99 131.12 10.38 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.775 -1.33 . . . . 0.0 109.775 -179.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.467 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 88.9 m-70 -79.43 142.26 36.07 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.309 -1.112 . . . . 0.0 108.561 179.499 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.561 ' HA ' ' HA ' ' A' ' 70' ' ' CYS . 0.1 OUTLIER -116.13 127.23 54.66 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.075 -1.016 . . . . 0.0 110.137 -179.039 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.519 ' HB3' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER -79.05 -154.22 0.08 Allowed 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 106.595 -1.632 . . . . 0.0 106.595 177.569 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' BHD . . . . . 0.545 ' CG ' ' N ' ' A' ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.545 ' N ' ' CG ' ' A' ' 63' ' ' BHD . . . 179.26 175.67 46.37 Favored Glycine 0 N--CA 1.494 2.523 0 N-CA-C 108.389 -1.884 . . . . 0.0 108.389 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.513 HD11 ' HA ' ' A' ' 44' ' ' TYR . 35.9 mm -86.68 -66.59 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 120.744 -1.444 . . . . 0.0 110.341 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . 0.427 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . -61.19 -12.57 31.55 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 -179.544 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.45 ' HA ' HE21 ' A' ' 49' ' ' GLN . 1.5 p-10 -178.1 -157.3 0.04 OUTLIER 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.201 -1.176 . . . . 0.0 110.357 179.378 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.697 ' N ' ' CD1' ' A' ' 68' ' ' TYR . 2.0 p90 -156.15 -160.37 1.0 Allowed 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -178.632 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.519 ' OG1' ' HB3' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -151.04 177.67 9.94 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 177.955 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . 0.561 ' HA ' ' HA ' ' A' ' 61' ' ' CYS . 1.3 m -137.09 -174.47 3.75 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 120.674 -1.266 . . . . 0.0 109.4 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.467 ' HB ' ' HB2' ' A' ' 60' ' ' HIS . 0.7 OUTLIER -161.09 123.63 3.14 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 179.362 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.479 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 84.7 m -97.84 140.34 32.36 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.93 -1.106 . . . . 0.0 109.571 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.583 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . . . -73.76 -176.39 2.39 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.073 -1.017 . . . . 0.0 110.659 -179.621 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -81.45 102.31 10.45 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-O 123.119 1.438 . . . . 0.0 108.265 178.362 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . 0.464 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 123.31 17.57 3.24 Favored Glycine 0 C--N 1.268 -3.238 0 CA-C-N 113.765 -1.561 . . . . 0.0 109.459 -179.332 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.634 ' CE2' ' O ' ' A' ' 57' ' ' ASN . 4.8 m-85 -119.92 167.79 11.79 Favored 'General case' 0 C--N 1.294 -1.805 0 O-C-N 121.44 -1.035 . . . . 0.0 109.578 -178.316 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.502 ' CB ' ' HB2' ' A' ' 83' ' ' PHE . 3.7 mt-10 -160.41 171.01 19.83 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.038 -1.039 . . . . 0.0 110.355 -179.658 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.33 169.01 40.41 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 179.573 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.435 ' HD3' ' C ' ' A' ' 79' ' ' LYS . 1.0 OUTLIER -57.89 -55.81 30.1 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.303 -1.116 . . . . 0.0 109.318 179.897 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.497 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.2 OUTLIER -95.56 25.46 4.5 Favored 'General case' 0 C--N 1.287 -2.119 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.585 179.999 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.507 ' O ' ' ND2' ' A' ' 57' ' ' ASN . 6.6 m 69.7 11.6 7.9 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.84 -1.163 . . . . 0.0 109.021 -179.619 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.475 ' HA ' ' ND2' ' A' ' 57' ' ' ASN . 26.7 tt0 -42.06 -47.4 4.49 Favored 'General case' 0 N--CA 1.489 1.517 0 CA-C-O 121.446 0.641 . . . . 0.0 111.39 -179.71 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.619 ' N ' ' CD1' ' A' ' 83' ' ' PHE . 0.6 OUTLIER -79.77 84.63 5.54 Favored 'General case' 0 C--N 1.295 -1.794 0 O-C-N 121.223 -0.923 . . . . 0.0 110.66 -178.328 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.453 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 3.9 p -67.42 94.5 0.4 Allowed 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.583 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.446 ' OG1' ' HA2' ' A' ' 75' ' ' GLY . 18.5 p -54.92 -21.38 11.44 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.172 -0.955 . . . . 0.0 109.924 -179.041 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 14.4 ptm180 . . . . . 0 C--N 1.289 -2.044 0 CA-C-O 118.033 -0.985 . . . . 0.0 109.556 -179.899 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.422 ' O ' ' HB2' ' A' ' 2' ' ' ASN . . . . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 121.256 0.55 . . . . 0.0 109.536 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.441 ' O ' ' CB ' ' A' ' 3' ' ' SER . 6.8 m-20 61.18 76.88 0.35 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.238 -0.914 . . . . 0.0 109.395 -179.903 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.441 ' CB ' ' O ' ' A' ' 2' ' ' ASN . 0.2 OUTLIER 168.85 -169.75 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.251 -0.906 . . . . 0.0 109.402 179.955 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -63.29 -22.85 67.13 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.106 -0.996 . . . . 0.0 109.261 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.487 ' O ' ' CG1' ' A' ' 8' ' ' VAL . 4.1 mp -68.81 -25.55 64.73 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.174 -0.953 . . . . 0.0 109.462 -179.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' CGU . . . . . 0.409 OE21 ' HA ' ' A' ' 6' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' CGU . . . . . 0.425 ' O ' ' C ' ' A' ' 8' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.628 ' CG2' ' O ' ' A' ' 8' ' ' VAL . 1.3 m -39.77 103.82 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.308 -1.217 0 CA-C-O 122.343 1.068 . . . . 0.0 109.86 -178.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.478 ' O ' ' O ' ' A' ' 10' ' ' GLN . 3.1 mtmt -63.57 84.93 0.03 OUTLIER 'General case' 0 C--N 1.283 -2.287 0 N-CA-C 106.868 -1.53 . . . . 0.0 106.868 178.359 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.478 ' O ' ' O ' ' A' ' 9' ' ' LYS . 3.5 tt0 56.01 158.67 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.335 0 O-C-N 121.536 -0.727 . . . . 0.0 109.442 -178.207 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.457 ' O ' ' HB2' ' A' ' 12' ' ' ASN . . . -104.1 -171.16 25.15 Favored Glycine 0 N--CA 1.491 2.301 0 C-N-CA 119.841 -1.171 . . . . 0.0 110.428 -179.005 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.553 ' HB3' ' CB ' ' A' ' 16' ' ' CGU . 0.6 OUTLIER 170.26 -179.93 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 -179.416 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.58 ' CD2' ' N ' ' A' ' 13' ' ' LEU . 0.5 OUTLIER -84.75 -173.58 4.8 Favored 'General case' 0 C--N 1.312 -1.023 0 O-C-N 120.171 -1.58 . . . . 0.0 109.104 -179.772 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' CGU . . . . . 0.693 ' C ' ' CD2' ' A' ' 14' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.516 ' N ' OE12 ' A' ' 14' ' ' CGU . 4.2 mtp180 -76.37 -40.71 50.35 Favored 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 119.294 -0.962 . . . . 0.0 110.172 -178.84 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' CGU . . . . . 0.553 ' CB ' ' HB3' ' A' ' 12' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.499 ' HA ' ' HB2' ' A' ' 21' ' ' ALA . 28.2 m -61.79 -28.45 69.47 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.924 -1.11 . . . . 0.0 111.199 -178.124 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.475 HD23 ' OD2' ' A' ' 48' ' ' ASP . 0.1 OUTLIER -48.37 -24.56 1.27 Allowed 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 118.641 -1.224 . . . . 0.0 108.061 179.252 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' CGU . . . . . 0.444 ' N ' ' C ' ' A' ' 17' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.508 ' HB1' ' O ' ' A' ' 16' ' ' CGU . . . -74.43 -41.78 60.26 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 120.526 -1.358 . . . . 0.0 110.07 -179.56 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.488 ' HB2' ' HB3' ' A' ' 17' ' ' CYS . 1.4 m -149.57 168.59 23.11 Favored 'General case' 0 C--N 1.292 -1.909 0 O-C-N 121.549 -0.719 . . . . 0.0 109.178 178.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.548 ' O ' ' CB ' ' A' ' 24' ' ' LEU . 0.7 OUTLIER -85.29 31.62 0.57 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.158 -0.964 . . . . 0.0 110.502 -178.986 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.548 ' CB ' ' O ' ' A' ' 23' ' ' SER . 0.1 OUTLIER 81.26 -40.24 0.14 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.409 -0.807 . . . . 0.0 110.31 179.665 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' CGU . . . . . 0.471 OE12 ' HB ' ' A' ' 8' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.68 62.18 5.4 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.105 -0.997 . . . . 0.0 110.213 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.517 ' O ' ' CB ' ' A' ' 29' ' ' CGU . 26.3 ptt180 -159.4 110.75 2.05 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 178.416 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' CGU . . . . . 0.517 ' CB ' ' O ' ' A' ' 28' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.477 HG13 ' O ' ' A' ' 12' ' ' ASN . 2.1 t -80.25 -14.79 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 O-C-N 120.87 -1.144 . . . . 0.0 108.38 179.306 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.693 ' CD1' ' N ' ' A' ' 31' ' ' PHE . 0.0 OUTLIER -127.09 139.21 53.15 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 121.381 -0.825 . . . . 0.0 109.772 -179.695 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' CGU . . . . . 0.55 ' O ' ' N ' ' A' ' 34' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.617 ' HB2' ' CD2' ' A' ' 31' ' ' PHE . 0.9 OUTLIER -38.63 90.88 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 121.379 0.609 . . . . 0.0 110.57 -179.787 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.55 ' N ' ' O ' ' A' ' 32' ' ' CGU . . . -80.38 -28.03 38.05 Favored 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.68 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 65.8 mt-30 -52.86 -34.81 56.06 Favored 'General case' 0 C--O 1.202 -1.41 0 C-N-CA 117.99 -1.484 . . . . 0.0 108.261 179.256 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.647 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -42.54 -59.3 1.94 Allowed 'General case' 0 N--CA 1.499 2.014 0 O-C-N 119.797 -1.814 . . . . 0.0 107.571 178.4 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.611 ' O ' ' C ' ' A' ' 39' ' ' CGU . 2.0 t70 -82.13 -68.09 0.73 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.43 -0.794 . . . . 0.0 109.305 177.354 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' CGU . . . . . 0.611 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.68 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 18.5 t80 -40.23 -55.72 2.1 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 178.128 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.647 ' CD1' ' O ' ' A' ' 37' ' ' THR . 9.1 m95 -80.99 172.02 14.26 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.878 -0.514 . . . . 0.0 109.857 178.505 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 76.47 -59.8 0.49 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.532 -0.73 . . . . 0.0 112.254 177.632 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.557 ' HD2' ' CD1' ' A' ' 39' ' ' CGU . 0.0 OUTLIER -101.74 11.05 39.43 Favored 'General case' 0 C--N 1.28 -2.432 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 178.489 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.607 ' O ' ' N ' ' A' ' 46' ' ' ASP . 0.8 OUTLIER -56.9 -76.22 0.04 OUTLIER 'General case' 0 C--N 1.307 -1.248 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 179.589 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.549 ' C ' ' O ' ' A' ' 44' ' ' TYR . 7.1 mttt 9.85 55.55 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.419 0 CA-C-O 121.172 0.511 . . . . 0.0 112.144 179.095 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.607 ' N ' ' O ' ' A' ' 44' ' ' TYR . 0.9 OUTLIER -156.35 8.55 0.22 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.131 -0.981 . . . . 0.0 110.056 -179.667 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.571 ' O ' ' CB ' ' A' ' 48' ' ' ASP . . . 86.03 -48.46 3.95 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 108.636 -1.785 . . . . 0.0 108.636 -179.147 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.571 ' CB ' ' O ' ' A' ' 47' ' ' GLY . 16.1 p-10 140.42 -10.04 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.247 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 179.561 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.594 ' NE2' ' O ' ' A' ' 65' ' ' ILE . 0.0 OUTLIER 77.78 -15.99 0.7 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.754 -0.591 . . . . 0.0 110.858 -179.547 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . 0.492 ' HB2' ' OD1' ' A' ' 63' ' ' BHD . 20.2 t -99.23 -21.09 16.26 Favored 'General case' 0 N--CA 1.487 1.403 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 176.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.469 ' HB2' ' OD1' ' A' ' 48' ' ' ASP . 21.9 tt0 -58.93 148.89 28.74 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 121.319 -0.863 . . . . 0.0 108.899 179.248 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.457 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . 102.2 -22.25 38.57 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 109.357 -1.497 . . . . 0.0 109.357 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.538 ' CE1' ' O ' ' A' ' 55' ' ' CYS . 0.6 OUTLIER 68.8 58.24 0.64 Allowed Pre-proline 0 N--CA 1.49 1.56 0 O-C-N 121.456 -1.026 . . . . 0.0 109.847 -179.954 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.529 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 3.2 Cg_exo -57.05 -35.09 98.8 Favored 'Trans proline' 0 C--N 1.31 -1.494 0 C-N-CA 122.36 2.04 . . . . 0.0 110.317 179.327 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.538 ' O ' ' CE1' ' A' ' 53' ' ' HIS . 0.2 OUTLIER -75.28 164.2 26.69 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.576 -0.703 . . . . 0.0 109.197 -179.617 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.495 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.8 mt -145.0 -175.34 4.65 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.241 -0.912 . . . . 0.0 110.037 179.724 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.602 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 0.9 OUTLIER 42.59 63.63 1.38 Allowed 'General case' 0 C--N 1.299 -1.605 0 CA-C-O 121.931 0.872 . . . . 0.0 109.143 -179.965 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.427 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 0.2 OUTLIER 51.61 32.66 9.45 Favored 'General case' 0 C--N 1.301 -1.532 0 C-N-CA 119.934 -0.706 . . . . 0.0 109.771 177.938 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -82.2 139.35 19.66 Favored Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.367 -1.493 . . . . 0.0 109.367 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -79.76 149.69 31.03 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.264 -1.139 . . . . 0.0 109.095 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.463 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 44.3 t -116.12 124.78 51.21 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.106 -0.996 . . . . 0.0 110.144 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.517 ' HB2' ' OG1' ' A' ' 69' ' ' THR . 80.5 mttt -102.3 -169.12 1.63 Allowed 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 177.882 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' BHD . . . . . 0.509 ' HA ' ' HA ' ' A' ' 68' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.651 ' O ' ' N ' ' A' ' 66' ' ' GLY . . . 119.75 63.2 0.27 Allowed Glycine 0 N--CA 1.492 2.385 0 N-CA-C 109.121 -1.592 . . . . 0.0 109.121 -178.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.594 ' O ' ' NE2' ' A' ' 49' ' ' GLN . 0.6 OUTLIER 19.74 -71.01 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.511 2.611 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -178.726 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . 0.651 ' N ' ' O ' ' A' ' 64' ' ' GLY . . . -32.7 -36.33 0.04 OUTLIER Glycine 0 N--CA 1.502 3.05 0 N-CA-C 109.222 -1.551 . . . . 0.0 109.222 -179.295 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.555 ' N ' ' O ' ' A' ' 65' ' ' ILE . 3.1 p-10 175.84 -162.87 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 177.584 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.644 ' N ' ' CD1' ' A' ' 68' ' ' TYR . 1.0 OUTLIER -131.18 -176.48 4.03 Favored 'General case' 0 C--N 1.291 -1.971 0 O-C-N 121.01 -1.056 . . . . 0.0 108.341 179.934 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.517 ' OG1' ' HB2' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -148.5 109.83 4.39 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 120.821 -1.174 . . . . 0.0 109.537 179.342 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 66.8 m -84.47 -174.15 5.12 Favored 'General case' 0 C--N 1.292 -1.904 0 CA-C-O 122.149 0.976 . . . . 0.0 109.608 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 10.3 m -161.35 144.21 12.41 Favored 'General case' 0 C--N 1.286 -2.195 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.31 179.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . 0.503 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 99.1 m -106.81 134.31 50.15 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.144 -0.973 . . . . 0.0 108.991 179.522 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.613 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . . . -64.92 -175.12 0.17 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.943 -1.098 . . . . 0.0 111.076 -179.092 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -81.5 101.56 10.0 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-O 123.114 1.435 . . . . 0.0 108.307 178.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . 0.484 ' O ' ' OG1' ' A' ' 85' ' ' THR . . . 120.3 16.54 4.71 Favored Glycine 0 C--N 1.269 -3.192 0 N-CA-C 109.146 -1.581 . . . . 0.0 109.146 -179.23 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.613 ' CE1' ' HB2' ' A' ' 73' ' ' ALA . 4.2 m-85 -113.31 164.38 13.64 Favored 'General case' 0 C--N 1.293 -1.856 0 O-C-N 121.443 -1.034 . . . . 0.0 109.23 -178.434 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.481 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 0.0 OUTLIER -160.52 170.11 21.59 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.004 -1.06 . . . . 0.0 110.335 -179.372 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 97.2 173.36 34.19 Favored Glycine 0 N--CA 1.488 2.14 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 179.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.3 tmtt? -60.2 -57.8 11.24 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.343 -1.092 . . . . 0.0 109.234 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.495 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 1.0 OUTLIER -98.59 27.47 4.81 Favored 'General case' 0 C--N 1.287 -2.113 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 179.428 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.481 ' HA ' ' O ' ' A' ' 77' ' ' GLU . 4.6 m 71.71 7.83 6.0 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.99 -1.069 . . . . 0.0 109.422 -179.898 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.424 ' C ' ' O ' ' A' ' 81' ' ' CYS . 41.1 tt0 -36.34 -44.62 0.43 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.542 -0.724 . . . . 0.0 111.489 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.607 ' N ' ' CD1' ' A' ' 83' ' ' PHE . 0.9 OUTLIER -80.47 86.82 5.73 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.269 -0.894 . . . . 0.0 110.424 -178.607 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.544 ' CB ' ' OD1' ' A' ' 57' ' ' ASN . 0.2 OUTLIER -74.66 92.2 2.42 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.416 -0.802 . . . . 0.0 109.164 179.345 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.484 ' OG1' ' O ' ' A' ' 75' ' ' GLY . 10.5 p -72.61 -14.4 61.6 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.22 -0.925 . . . . 0.0 109.694 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.451 ' HD3' ' CZ ' ' A' ' 76' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.78 0 CA-C-O 117.995 -1.002 . . . . 0.0 109.633 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 1.1 m120 54.96 86.67 0.05 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.229 -0.92 . . . . 0.0 109.326 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 5.5 t -131.12 -171.1 2.5 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.268 -0.895 . . . . 0.0 109.714 -179.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.573 ' CZ ' ' O ' ' A' ' 21' ' ' ALA . 2.3 p90 -80.7 14.58 2.06 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.323 -0.861 . . . . 0.0 110.194 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.463 ' O ' HG11 ' A' ' 8' ' ' VAL . 0.2 OUTLIER -63.95 -30.78 71.83 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 120.926 -1.109 . . . . 0.0 109.831 -179.632 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' CGU . . . . . 0.441 OE12 ' HB3' ' A' ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' CGU . . . . . 0.473 ' O ' ' N ' ' A' ' 9' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.581 ' CG2' ' O ' ' A' ' 8' ' ' VAL . 3.6 m -39.66 98.46 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.307 -1.25 0 CA-C-O 122.83 1.3 . . . . 0.0 110.18 -178.617 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.549 ' O ' ' CB ' ' A' ' 10' ' ' GLN . 2.6 mmpt? -55.82 -17.31 5.93 Favored 'General case' 0 C--N 1.283 -2.301 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 178.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.549 ' CB ' ' O ' ' A' ' 9' ' ' LYS . 1.2 tt0 85.44 109.72 0.05 Allowed 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 121.217 0.532 . . . . 0.0 109.735 179.586 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.478 ' O ' ' O ' ' A' ' 10' ' ' GLN . . . -61.02 -135.19 0.01 OUTLIER Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.043 -1.623 . . . . 0.0 109.043 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.518 ' HB2' ' CB ' ' A' ' 16' ' ' CGU . 0.9 OUTLIER -169.58 -46.61 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.398 0 O-C-N 120.763 -1.433 . . . . 0.0 110.798 179.787 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.551 ' O ' ' CG ' ' A' ' 14' ' ' CGU . 0.0 OUTLIER -167.12 -22.4 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.227 0 O-C-N 120.398 -1.439 . . . . 0.0 111.223 -179.959 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' CGU . . . . . 0.551 ' CG ' ' O ' ' A' ' 13' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.517 ' NH1' ' HG3' ' A' ' 15' ' ' ARG . 9.1 mtm-85 -80.08 -21.39 43.4 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.543 -0.723 . . . . 0.0 111.322 -179.08 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' CGU . . . . . 0.518 ' CB ' ' HB2' ' A' ' 12' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.677 ' O ' ' SG ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -166.52 42.27 0.06 Allowed 'General case' 0 N--CA 1.491 1.576 0 CA-C-O 124.013 1.863 . . . . 0.0 107.991 -178.918 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.483 HD11 ' O ' ' A' ' 18' ' ' LEU . 0.2 OUTLIER -115.32 -2.05 12.74 Favored 'General case' 0 C--N 1.29 -1.987 0 O-C-N 120.857 -1.152 . . . . 0.0 109.319 178.868 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.573 ' O ' ' CZ ' ' A' ' 4' ' ' PHE . . . -89.28 32.43 0.84 Allowed 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.282 -0.886 . . . . 0.0 109.766 -179.718 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' CYS . . . . . 0.526 ' O ' ' CB ' ' A' ' 23' ' ' SER . 11.5 t -150.82 -47.67 0.12 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.334 -0.854 . . . . 0.0 110.341 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.558 ' O ' ' CB ' ' A' ' 24' ' ' LEU . 7.8 t 84.26 -2.46 1.03 Allowed 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 -178.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.558 ' CB ' ' O ' ' A' ' 23' ' ' SER . 0.4 OUTLIER 83.66 -54.69 0.15 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.614 -0.679 . . . . 0.0 110.436 179.667 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' CGU . . . . . 0.463 ' O ' OE11 ' A' ' 29' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' CGU . . . . . 0.455 ' HA ' OE11 ' A' ' 26' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.59 ' O ' ' CD1' ' A' ' 31' ' ' PHE . . . -68.81 -26.37 65.15 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.099 -1.001 . . . . 0.0 109.814 -179.684 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.449 ' HG2' ' O ' ' A' ' 25' ' ' CGU . 8.1 ptm180 -91.82 -17.87 24.68 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.934 -1.104 . . . . 0.0 110.654 -179.27 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' CGU . . . . . 0.463 OE11 ' O ' ' A' ' 25' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.464 ' CG1' ' O ' ' A' ' 30' ' ' VAL . 0.9 OUTLIER -93.08 -6.34 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 120.901 -1.124 . . . . 0.0 110.125 -179.104 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.59 ' CD1' ' O ' ' A' ' 27' ' ' ALA . 25.7 m-85 -100.0 96.1 7.31 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 120.893 -1.129 . . . . 0.0 111.055 -178.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' CGU . . . . . 0.432 ' O ' ' C ' ' A' ' 33' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.527 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 3.9 m-20 -39.88 111.74 0.22 Allowed 'General case' 0 C--N 1.305 -1.333 0 O-C-N 121.894 -0.504 . . . . 0.0 110.325 -179.323 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.521 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -78.37 -31.03 48.28 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 178.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . 0.639 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 2.3 mm100 -53.95 -34.65 60.27 Favored 'General case' 0 C--O 1.205 -1.278 0 C-N-CA 118.846 -1.142 . . . . 0.0 108.676 179.013 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.671 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.2 OUTLIER -46.12 -59.0 3.14 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.259 -1.526 . . . . 0.0 107.797 178.952 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . 0.6 ' O ' ' C ' ' A' ' 39' ' ' CGU . 3.0 t70 -80.68 -66.5 0.88 Allowed 'General case' 0 C--N 1.298 -1.665 0 O-C-N 121.17 -0.956 . . . . 0.0 109.91 178.733 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' CGU . . . . . 0.6 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.639 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 6.4 t80 -46.96 -46.94 21.86 Favored 'General case' 0 C--N 1.299 -1.618 0 O-C-N 121.62 -0.675 . . . . 0.0 110.36 179.467 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.671 ' CD1' ' O ' ' A' ' 37' ' ' THR . 6.8 m95 -80.35 -67.5 0.76 Allowed 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.452 -0.78 . . . . 0.0 112.304 -178.611 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -57.34 -50.08 74.08 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.516 -1.365 . . . . 0.0 110.356 -177.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.505 ' HD3' HG21 ' A' ' 65' ' ' ILE . 0.7 OUTLIER -81.87 2.14 31.75 Favored 'General case' 0 C--N 1.287 -2.136 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 179.624 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . 0.687 ' O ' ' N ' ' A' ' 46' ' ' ASP . 1.0 OUTLIER -46.43 -70.39 0.1 Allowed 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.379 -0.826 . . . . 0.0 109.182 -179.913 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.542 ' C ' ' O ' ' A' ' 44' ' ' TYR . 3.1 ptmt -9.75 69.05 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.647 0 CA-C-O 121.366 0.603 . . . . 0.0 111.797 -179.481 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.687 ' N ' ' O ' ' A' ' 44' ' ' TYR . 2.4 t0 -162.13 -30.44 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.4 -0.813 . . . . 0.0 110.077 -179.109 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.48 ' O ' ' OD2' ' A' ' 48' ' ' ASP . . . 98.61 13.97 39.23 Favored Glycine 0 N--CA 1.486 2.003 0 N-CA-C 107.83 -2.108 . . . . 0.0 107.83 -177.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.609 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER 74.6 11.35 3.94 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.784 -0.833 . . . . 0.0 109.358 -179.628 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.655 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 34.5 mm-40 73.85 -10.79 1.04 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.807 -0.558 . . . . 0.0 111.125 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 15.0 t -114.83 -11.45 12.24 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.665 -1.272 . . . . 0.0 110.088 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.44 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 53.5 tt0 -74.12 152.73 39.81 Favored 'General case' 0 N--CA 1.483 1.223 0 O-C-N 120.888 -1.132 . . . . 0.0 109.135 179.884 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.454 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . 94.27 -14.07 66.05 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . 0.454 ' HB3' ' O ' ' A' ' 52' ' ' GLY . 1.2 t60 68.42 69.6 0.44 Allowed Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.336 -1.096 . . . . 0.0 109.343 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' PRO . . . . . 0.439 ' HG2' ' SG ' ' A' ' 61' ' ' CYS . 5.7 Cg_exo -59.67 -39.83 70.35 Favored 'Trans proline' 0 C--N 1.31 -1.479 0 C-N-CA 122.45 2.1 . . . . 0.0 110.61 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.492 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 0.6 OUTLIER -84.77 177.89 7.85 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.338 -0.851 . . . . 0.0 109.302 -179.863 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.507 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.5 mt -140.08 -175.37 4.22 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 179.199 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ASN . . . . . 0.576 ' HB3' ' CD2' ' A' ' 76' ' ' PHE . 4.9 m-80 48.49 56.43 7.53 Favored 'General case' 0 C--N 1.296 -1.729 0 CA-C-O 121.718 0.771 . . . . 0.0 110.943 178.013 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 47.06 30.15 1.25 Allowed 'General case' 0 C--N 1.301 -1.507 0 CA-C-O 121.439 0.638 . . . . 0.0 109.873 177.455 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -79.08 150.92 34.49 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.198 -1.561 . . . . 0.0 109.198 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.482 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 3.1 t60 -79.64 156.47 27.6 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.98 -1.306 . . . . 0.0 108.772 179.585 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' CYS . . . . . 0.492 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 0.6 OUTLIER -124.56 116.98 23.32 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.18 -0.95 . . . . 0.0 109.948 -179.082 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.472 ' HB3' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER -79.12 -173.05 3.41 Favored 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 106.91 -1.515 . . . . 0.0 106.91 177.755 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' BHD . . . . . 0.503 ' CG ' ' N ' ' A' ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . 0.574 ' O ' ' O ' ' A' ' 67' ' ' ASP . . . 137.03 134.46 3.28 Favored Glycine 0 N--CA 1.493 2.479 0 N-CA-C 108.079 -2.008 . . . . 0.0 108.079 -179.26 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ILE . . . . . 0.568 ' CG2' ' N ' ' A' ' 66' ' ' GLY . 0.0 OUTLIER -51.76 -61.94 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 119.881 -1.952 . . . . 0.0 109.316 -179.136 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . 0.568 ' N ' ' CG2' ' A' ' 65' ' ' ILE . . . -43.19 -50.1 6.47 Favored Glycine 0 N--CA 1.493 2.482 0 N-CA-C 109.964 -1.254 . . . . 0.0 109.964 -179.34 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.574 ' O ' ' O ' ' A' ' 64' ' ' GLY . 6.4 p-10 -164.89 -147.8 0.1 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.41 -1.053 . . . . 0.0 109.278 179.71 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.655 ' CD1' ' HB3' ' A' ' 49' ' ' GLN . 2.5 p90 -159.8 -165.15 1.45 Allowed 'General case' 0 C--N 1.296 -1.751 0 O-C-N 120.501 -1.374 . . . . 0.0 109.352 -179.45 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.472 ' OG1' ' HB3' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -149.43 -177.48 5.88 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 107.324 -1.362 . . . . 0.0 107.324 178.989 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.7 m -139.61 -173.29 3.58 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 120.601 -1.312 . . . . 0.0 108.563 179.158 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.482 ' HB ' ' HB3' ' A' ' 60' ' ' HIS . 1.5 m -161.08 139.92 10.08 Favored 'General case' 0 C--N 1.292 -1.931 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 179.334 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 95.0 m -104.15 141.99 35.28 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.952 -1.093 . . . . 0.0 109.365 179.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.408 ' HB2' ' CE1' ' A' ' 76' ' ' PHE . . . -77.16 177.66 7.67 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.222 -0.924 . . . . 0.0 109.8 -179.756 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -80.56 102.34 9.71 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-O 123.399 1.571 . . . . 0.0 107.839 178.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . 0.632 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 127.27 25.58 1.17 Allowed Glycine 0 C--N 1.267 -3.302 0 CA-C-N 113.299 -1.773 . . . . 0.0 109.896 -179.556 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.632 ' CD1' ' C ' ' A' ' 75' ' ' GLY . 58.2 m-85 -141.37 159.88 41.28 Favored 'General case' 0 C--N 1.287 -2.115 0 O-C-N 121.174 -1.192 . . . . 0.0 110.05 -177.815 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . 0.498 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 2.5 mt-10 -150.36 175.21 12.04 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.172 -0.955 . . . . 0.0 110.239 -178.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 95.47 168.02 35.48 Favored Glycine 0 N--CA 1.491 2.327 0 N-CA-C 110.191 -1.164 . . . . 0.0 110.191 179.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.455 ' HD3' ' C ' ' A' ' 79' ' ' LYS . 4.6 tmtt? -55.86 -57.77 10.65 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.466 -1.02 . . . . 0.0 109.158 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ASN . . . . . 0.507 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 1.1 m-20 -94.43 25.86 3.69 Favored 'General case' 0 C--N 1.287 -2.113 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 179.418 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.527 ' HB2' ' HB2' ' A' ' 57' ' ' ASN . 4.1 m 66.36 14.85 9.89 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 120.818 -1.176 . . . . 0.0 108.41 -179.211 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -46.53 -42.44 15.77 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.769 -0.582 . . . . 0.0 112.122 -179.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.607 ' N ' ' CD1' ' A' ' 83' ' ' PHE . 0.8 OUTLIER -79.32 85.09 5.18 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.169 -0.957 . . . . 0.0 111.135 -178.035 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' SER . . . . . 0.546 ' CB ' ' OD1' ' A' ' 57' ' ' ASN . 0.4 OUTLIER -68.64 109.27 3.7 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 178.232 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.46 ' O ' ' C ' ' A' ' 86' ' ' ARG . 33.3 p -92.02 -32.91 15.03 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.997 -1.064 . . . . 0.0 109.807 -179.334 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ARG . . . . . 0.46 ' C ' ' O ' ' A' ' 85' ' ' THR . 0.1 OUTLIER . . . . . 0 C--N 1.289 -2.05 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.202 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.864 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 84.9 m . . . . . 0 N--CA 1.494 1.755 0 CA-C-O 121.382 0.61 . . . . 0.0 109.758 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.801 HD11 ' CG ' ' A' ' 48' ' ' ASP . 0.2 OUTLIER . . . . . 0 C--N 1.299 -1.622 0 CA-C-O 121.795 0.807 . . . . 0.0 110.018 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.864 ' HB3' ' HA ' ' A' ' 17' ' ' CYS . . . . . . . . 0 N--CA 1.489 1.505 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.419 ' SG ' ' C ' ' A' ' 21' ' ' ALA . 0.5 OUTLIER -151.98 -170.35 3.62 Favored 'General case' 0 C--N 1.289 -2.024 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.936 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 35.5 p -175.96 -35.27 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.771 ' O ' HD13 ' A' ' 24' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.303 -1.448 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 179.591 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.706 0 CA-C-O 121.426 0.631 . . . . 0.0 110.602 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.581 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 24.6 ptt180 . . . . . 0 C--N 1.3 -1.559 0 N-CA-C 106.634 -1.617 . . . . 0.0 106.634 177.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.4 t . . . . . 0 N--CA 1.485 1.278 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.7 ' CD1' ' N ' ' A' ' 31' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.306 -1.295 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.667 ' O ' HG23 ' A' ' 37' ' ' THR . 50.7 p-10 . . . . . 0 N--CA 1.479 0.98 0 CA-C-O 121.211 0.529 . . . . 0.0 111.559 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.407 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 N--CA 1.49 1.537 0 O-C-N 121.272 -0.892 . . . . 0.0 109.056 178.671 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.744 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 2.0 mt-30 . . . . . 0 C--O 1.2 -1.522 0 N-CA-C 105.907 -1.886 . . . . 0.0 105.907 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.753 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 40.7 p -41.37 -59.46 1.55 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 120.045 -1.659 . . . . 0.0 106.763 177.037 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.485 ' O ' ' O ' ' A' ' 41' ' ' TRP . 0.4 OUTLIER . . . . . 0 C--N 1.287 -2.109 0 O-C-N 121.166 -0.959 . . . . 0.0 109.745 177.152 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.744 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 12.5 t80 . . . . . 0 N--CA 1.489 1.476 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.753 ' CD1' ' O ' ' A' ' 37' ' ' THR . 7.6 m95 -80.63 -171.0 2.88 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 177.239 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.599 ' O ' ' CB ' ' A' ' 43' ' ' LYS . 54.8 p 42.13 87.74 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.874 0 O-C-N 120.577 -1.327 . . . . 0.0 109.904 179.098 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.933 ' HD2' HD13 ' A' ' 65' ' ' ILE . 4.9 ptpt 115.19 5.55 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 -179.27 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.633 ' HA ' HG22 ' A' ' 65' ' ' ILE . 0.7 OUTLIER -80.7 -95.34 0.04 OUTLIER 'General case' 0 C--O 1.206 -1.212 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 179.489 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.599 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.0 OUTLIER 12.61 55.3 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.597 0 CA-C-O 121.326 0.584 . . . . 0.0 111.17 179.346 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.599 ' N ' ' O ' ' A' ' 44' ' ' TYR . 11.6 t0 -143.98 16.76 1.76 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.325 -0.859 . . . . 0.0 108.979 -178.932 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.646 ' O ' HD21 ' A' ' 18' ' ' LEU . . . 75.29 2.86 68.53 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 107.86 -2.096 . . . . 0.0 107.86 -177.477 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.801 ' CG ' HD11 ' A' ' 18' ' ' LEU . 0.0 OUTLIER 88.55 7.16 0.16 Allowed 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -179.358 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.719 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 1.6 mt-30 72.47 -23.44 0.2 Allowed 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 120.403 -0.519 . . . . 0.0 112.275 178.788 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' CYS . . . . . 0.486 ' O ' ' HD3' ' A' ' 54' ' ' PRO . 17.1 t -93.55 -21.24 19.56 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 120.632 -1.292 . . . . 0.0 107.727 178.311 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -55.99 139.65 45.86 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 179.105 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 101.65 -13.04 58.1 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.427 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 31.7 t60 65.85 63.33 0.99 Allowed Pre-proline 0 N--CA 1.489 1.486 0 O-C-N 121.333 -1.098 . . . . 0.0 109.968 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.486 ' HD3' ' O ' ' A' ' 50' ' ' CYS . 3.5 Cg_exo -60.77 -39.35 63.6 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 C-N-CA 122.25 1.966 . . . . 0.0 110.167 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.469 ' SG ' ' O ' ' A' ' 60' ' ' HIS . 1.9 m -78.42 162.24 26.55 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.56 -0.712 . . . . 0.0 109.372 -179.466 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.528 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 6.0 mt -145.57 -173.85 4.24 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.994 -1.066 . . . . 0.0 110.658 -179.299 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.603 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 0.9 OUTLIER 43.83 64.51 1.25 Allowed 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 121.831 0.824 . . . . 0.0 108.99 -179.486 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.447 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 5.2 mm-40 51.14 31.02 6.13 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.226 177.715 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.433 ' HA2' ' O ' ' A' ' 71' ' ' THR . . . -83.05 141.61 20.9 Favored Glycine 0 N--CA 1.488 2.135 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.475 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 97.8 m-70 -79.23 -164.04 0.57 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.219 -1.165 . . . . 0.0 108.059 179.16 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.457 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 12.5 t -160.77 120.03 2.64 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.553 -1.342 . . . . 0.0 110.922 -179.393 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.494 1.762 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 178.132 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.608 ' O ' HD12 ' A' ' 65' ' ' ILE . . . . . . . . 0 N--CA 1.495 2.599 0 N-CA-C 111.459 -0.656 . . . . 0.0 111.459 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.933 HD13 ' HD2' ' A' ' 43' ' ' LYS . 2.4 pp 34.59 -165.22 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.511 2.585 0 CA-C-N 118.299 1.049 . . . . 0.0 109.964 -179.184 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.498 ' O ' ' CG ' ' A' ' 67' ' ' ASP . . . 47.51 30.67 6.38 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 106.326 -2.71 . . . . 0.0 106.326 -178.248 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.602 ' OD1' ' N ' ' A' ' 68' ' ' TYR . 0.4 OUTLIER 85.58 -171.75 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.507 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 -176.287 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.719 ' CD1' ' HB3' ' A' ' 49' ' ' GLN . 1.0 OUTLIER -137.67 -162.14 1.26 Allowed 'General case' 0 C--N 1.285 -2.229 0 O-C-N 120.345 -1.472 . . . . 0.0 108.376 -178.218 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -148.76 165.22 32.07 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 178.411 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 61' ' ' CYS . 22.6 m -132.05 -165.57 1.61 Allowed 'General case' 0 C--N 1.293 -1.856 0 O-C-N 120.637 -1.29 . . . . 0.0 108.019 179.274 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.475 ' HB ' ' HB2' ' A' ' 60' ' ' HIS . 0.7 OUTLIER -160.15 118.41 2.65 Favored 'General case' 0 C--N 1.297 -1.705 0 O-C-N 121.1 -1.0 . . . . 0.0 109.618 179.516 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.556 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 59.3 m -96.76 139.56 32.64 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.137 -0.977 . . . . 0.0 109.33 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.996 ' HB3' ' CE1' ' A' ' 76' ' ' PHE . . . -71.64 -176.05 1.5 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.114 -0.991 . . . . 0.0 110.467 -179.6 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -81.42 102.02 10.23 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-O 123.149 1.452 . . . . 0.0 108.152 178.334 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLY . . . . . 0.485 ' HA3' ' HD3' ' A' ' 86' ' ' ARG . . . 121.21 21.7 3.04 Favored Glycine 0 C--N 1.268 -3.236 0 CA-C-N 113.663 -1.608 . . . . 0.0 109.195 -179.122 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.996 ' CE1' ' HB3' ' A' ' 73' ' ' ALA . 4.7 m-85 -116.43 166.22 12.33 Favored 'General case' 0 C--N 1.295 -1.801 0 O-C-N 121.581 -0.952 . . . . 0.0 109.423 -178.225 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.476 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 3.6 mt-10 -159.95 170.76 20.69 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 120.775 -1.203 . . . . 0.0 110.458 -179.331 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.83 166.0 39.6 Favored Glycine 0 N--CA 1.489 2.2 0 N-CA-C 109.678 -1.369 . . . . 0.0 109.678 179.608 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.467 ' C ' ' HD3' ' A' ' 79' ' ' LYS . 2.3 tmtt? -55.77 -56.19 23.39 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.255 -1.144 . . . . 0.0 109.139 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.528 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.9 OUTLIER -94.06 30.19 1.95 Allowed 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 179.856 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 81' ' ' CYS . . . . . 0.486 ' O ' ' HB2' ' A' ' 57' ' ' ASN . 3.1 m 61.2 14.43 5.54 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.867 -1.146 . . . . 0.0 108.622 -179.527 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -44.5 -46.54 9.8 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.601 -0.687 . . . . 0.0 111.456 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.601 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.5 OUTLIER -81.16 84.45 6.55 Favored 'General case' 0 C--N 1.297 -1.687 0 O-C-N 121.401 -0.812 . . . . 0.0 110.751 -178.406 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.518 ' N ' ' OD1' ' A' ' 57' ' ' ASN . 0.1 OUTLIER -66.73 94.42 0.3 Allowed 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 178.473 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.459 ' OG1' ' HG3' ' A' ' 86' ' ' ARG . 20.0 p -49.05 -29.62 5.28 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.185 -0.947 . . . . 0.0 110.239 -178.729 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.485 ' HD3' ' HA3' ' A' ' 75' ' ' GLY . 9.4 mtp180 . . . . . 0 C--N 1.289 -2.055 0 CA-C-O 117.995 -1.003 . . . . 0.0 109.642 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.692 ' O ' ' HB2' ' A' ' 18' ' ' LEU . 9.9 p . . . . . 0 N--CA 1.501 2.112 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.692 ' HB2' ' O ' ' A' ' 17' ' ' CYS . 1.9 mm? . . . . . 0 N--CA 1.503 2.182 0 C-N-CA 124.059 0.943 . . . . 0.0 109.891 178.581 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.768 0 CA-C-O 121.912 0.863 . . . . 0.0 109.745 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 30.1 p -119.66 167.87 11.6 Favored 'General case' 0 C--N 1.292 -1.932 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.437 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.513 ' O ' ' CB ' ' A' ' 24' ' ' LEU . 42.3 t -87.76 1.33 54.14 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.214 -0.929 . . . . 0.0 109.082 179.201 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.513 ' CB ' ' O ' ' A' ' 23' ' ' SER . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.631 0 O-C-N 121.429 -0.794 . . . . 0.0 109.832 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.862 0 CA-C-O 120.774 0.321 . . . . 0.0 110.637 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.507 ' HG2' ' NH1' ' A' ' 28' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.423 0 O-C-N 120.766 -1.209 . . . . 0.0 111.571 -179.276 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.0 p . . . . . 0 N--CA 1.494 1.765 0 CA-C-O 121.36 0.6 . . . . 0.0 109.736 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 . . . . . 0 N--CA 1.492 1.632 0 O-C-N 121.351 -0.843 . . . . 0.0 109.944 -179.656 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.602 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 1.5 m-20 . . . . . 0 N--CA 1.485 1.325 0 CA-C-O 121.274 0.559 . . . . 0.0 110.752 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.515 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 N--CA 1.485 1.287 0 N-CA-C 107.494 -1.298 . . . . 0.0 107.494 178.381 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.635 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 13.2 mm100 . . . . . 0 C--O 1.206 -1.218 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.72 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -40.97 -58.43 1.72 Allowed 'General case' 0 N--CA 1.499 1.991 0 C-N-CA 117.743 -1.583 . . . . 0.0 107.33 178.569 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.465 ' O ' ' N ' ' A' ' 41' ' ' TRP . 0.6 OUTLIER . . . . . 0 C--N 1.298 -1.631 0 O-C-N 121.115 -0.99 . . . . 0.0 109.493 177.291 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.663 ' O ' ' HB2' ' A' ' 44' ' ' TYR . 9.6 t80 . . . . . 0 C--O 1.205 -1.265 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.72 ' CD1' ' O ' ' A' ' 37' ' ' THR . 7.1 m95 -79.46 -179.79 7.01 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 120.83 -1.169 . . . . 0.0 108.593 177.684 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.665 ' O ' ' CB ' ' A' ' 43' ' ' LYS . 1.5 t 36.84 92.86 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.659 -0.651 . . . . 0.0 110.2 179.259 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.665 ' CB ' ' O ' ' A' ' 42' ' ' SER . 0.0 OUTLIER 123.14 -33.33 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 106.235 -1.765 . . . . 0.0 106.235 -178.789 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.663 ' HB2' ' O ' ' A' ' 40' ' ' PHE . 0.1 OUTLIER -55.05 -73.66 0.05 Allowed 'General case' 0 C--N 1.299 -1.614 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.58 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.593 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -0.69 68.96 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.662 0 CA-C-O 121.457 0.646 . . . . 0.0 111.137 179.435 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.602 ' N ' ' O ' ' A' ' 44' ' ' TYR . 8.2 t70 -160.45 28.0 0.16 Allowed 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.381 -0.825 . . . . 0.0 109.204 -178.476 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.547 ' O ' HD11 ' A' ' 18' ' ' LEU . . . 67.31 12.1 60.33 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 108.272 -1.931 . . . . 0.0 108.272 -178.5 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.577 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 33.7 t70 71.72 21.4 4.32 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.817 -0.813 . . . . 0.0 109.611 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.61 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 52.9 mm-40 70.53 -10.63 0.68 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.843 -0.536 . . . . 0.0 112.142 178.473 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' CYS . . . . . 0.461 ' O ' ' HD3' ' A' ' 54' ' ' PRO . 52.9 t -114.6 -10.11 12.55 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.446 -1.409 . . . . 0.0 109.986 179.555 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.533 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 12.1 tm-20 -62.1 152.26 33.3 Favored 'General case' 0 N--CA 1.482 1.169 0 O-C-N 120.819 -1.176 . . . . 0.0 108.851 179.525 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.445 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . 93.52 -12.77 68.95 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 110.173 -1.171 . . . . 0.0 110.173 179.642 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.452 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 6.1 t60 68.84 66.08 0.52 Allowed Pre-proline 0 N--CA 1.492 1.651 0 O-C-N 120.982 -1.305 . . . . 0.0 109.234 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.461 ' HD3' ' O ' ' A' ' 50' ' ' CYS . 5.4 Cg_exo -60.86 -40.09 56.49 Favored 'Trans proline' 0 C--N 1.31 -1.494 0 C-N-CA 122.651 2.234 . . . . 0.0 111.302 -179.454 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.486 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 1.0 OUTLIER -83.61 174.05 10.87 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.118 -0.989 . . . . 0.0 109.947 -179.044 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.598 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.2 mt -147.07 -171.77 3.85 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.487 -0.758 . . . . 0.0 108.967 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.737 ' HB3' ' CD2' ' A' ' 76' ' ' PHE . 0.9 OUTLIER 48.71 57.14 6.66 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.419 -0.801 . . . . 0.0 110.055 179.727 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.45 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 0.7 OUTLIER 44.69 33.84 1.03 Allowed 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 178.17 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -83.3 153.7 30.76 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 -179.259 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.465 ' O ' ' SG ' ' A' ' 55' ' ' CYS . 0.1 OUTLIER -79.53 164.96 23.47 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.4 -1.059 . . . . 0.0 108.319 179.035 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.486 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 20.4 t -134.31 111.69 10.41 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.018 -1.051 . . . . 0.0 110.519 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.507 ' HB3' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.298 -1.656 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 177.46 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.427 ' O ' ' CG ' ' A' ' 49' ' ' GLN . . . . . . . . 0 N--CA 1.489 2.172 0 N-CA-C 107.618 -2.193 . . . . 0.0 107.618 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.63 HD12 ' HA ' ' A' ' 44' ' ' TYR . 10.2 mm -94.37 -67.42 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 120.619 -1.518 . . . . 0.0 110.014 179.806 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.5 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . -43.47 -26.94 0.72 Allowed Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.189 -1.565 . . . . 0.0 109.189 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.5 ' HB3' ' O ' ' A' ' 66' ' ' GLY . 6.6 p-10 175.54 -149.47 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.635 -0.921 . . . . 0.0 109.592 179.275 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.626 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 2.8 p90 -160.43 -165.1 1.36 Allowed 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 -179.399 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.507 ' OG1' ' HB3' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -147.82 179.26 7.85 Favored 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.535 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 3.8 m -141.23 -170.83 3.15 Favored 'General case' 0 C--N 1.297 -1.702 0 O-C-N 120.898 -1.126 . . . . 0.0 108.253 179.108 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.429 ' HB ' ' HB2' ' A' ' 60' ' ' HIS . 4.0 m -160.78 140.92 11.18 Favored 'General case' 0 C--N 1.292 -1.901 0 O-C-N 121.461 -0.775 . . . . 0.0 109.315 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 55.9 m -105.77 139.17 40.75 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.147 -0.971 . . . . 0.0 109.37 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.37 175.64 5.27 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.076 -1.015 . . . . 0.0 109.66 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -80.66 102.13 9.67 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 123.065 1.412 . . . . 0.0 107.668 178.392 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLY . . . . . 0.592 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 130.46 8.15 3.29 Favored Glycine 0 C--N 1.269 -3.17 0 CA-C-N 113.902 -1.499 . . . . 0.0 110.186 -179.352 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.737 ' CD2' ' HB3' ' A' ' 57' ' ' ASN . 13.8 m-85 -130.64 169.19 15.95 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 120.779 -1.424 . . . . 0.0 110.155 -178.547 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.473 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 2.3 mt-10 -160.56 174.52 13.92 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.104 -0.998 . . . . 0.0 110.046 -178.899 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 112.24 169.37 18.06 Favored Glycine 0 N--CA 1.493 2.47 0 N-CA-C 110.12 -1.192 . . . . 0.0 110.12 179.167 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.46 ' HD3' ' O ' ' A' ' 79' ' ' LYS . 3.1 tmtt? -56.98 -55.71 31.18 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.268 -1.137 . . . . 0.0 108.428 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.598 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.7 OUTLIER -99.75 26.97 5.73 Favored 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 178.183 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 81' ' ' CYS . . . . . 0.521 ' HB2' ' HB2' ' A' ' 57' ' ' ASN . 1.8 m 55.84 71.7 0.54 Allowed 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 105.389 -2.078 . . . . 0.0 105.389 -177.088 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.436 ' O ' ' HG3' ' A' ' 82' ' ' GLU . 0.5 OUTLIER -108.24 -30.9 8.12 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.373 -0.829 . . . . 0.0 110.266 -176.894 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.66 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -87.12 81.52 7.99 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.043 -1.035 . . . . 0.0 109.996 -179.792 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.22 108.88 0.46 Allowed 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 179.124 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.421 ' O ' ' OXT' ' A' ' 86' ' ' ARG . 5.0 p -85.89 -11.78 52.34 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.083 -1.011 . . . . 0.0 109.974 -179.29 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.554 ' NH1' ' HG3' ' A' ' 86' ' ' ARG . 0.3 OUTLIER . . . . . 0 C--N 1.297 -1.699 0 CA-C-O 118.104 -0.951 . . . . 0.0 109.467 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 1.027 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 42.1 m . . . . . 0 N--CA 1.49 1.536 0 CA-C-O 120.877 0.37 . . . . 0.0 110.435 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.5 HD22 ' HA ' ' A' ' 18' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.479 0 O-C-N 120.802 -1.186 . . . . 0.0 108.569 179.018 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 1.027 ' HB3' ' HA ' ' A' ' 17' ' ' CYS . . . . . . . . 0 N--CA 1.493 1.684 0 CA-C-O 121.678 0.752 . . . . 0.0 109.928 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.419 ' C ' ' OG ' ' A' ' 23' ' ' SER . 2.4 m -143.33 -44.35 0.29 Allowed 'General case' 0 C--N 1.289 -2.031 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 179.268 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.511 ' O ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER 61.28 -85.3 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.57 -0.706 . . . . 0.0 110.515 179.328 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.716 HD13 ' CZ2' ' A' ' 41' ' ' TRP . 0.9 OUTLIER . . . . . 0 N--CA 1.493 1.711 0 O-C-N 120.964 -1.085 . . . . 0.0 110.139 -179.059 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.694 0 CA-C-O 121.061 0.458 . . . . 0.0 110.175 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 28.7 mtt180 . . . . . 0 N--CA 1.489 1.496 0 O-C-N 121.114 -0.992 . . . . 0.0 110.523 -179.766 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.524 HG12 ' CD1' ' A' ' 31' ' ' PHE . 1.0 OUTLIER . . . . . 0 N--CA 1.492 1.645 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.556 ' CD2' ' CD ' ' A' ' 36' ' ' GLN . 69.1 m-85 . . . . . 0 N--CA 1.489 1.495 0 O-C-N 121.131 -0.981 . . . . 0.0 111.413 -179.326 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.559 ' CB ' ' HG2' ' A' ' 36' ' ' GLN . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 121.085 0.469 . . . . 0.0 110.974 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.469 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 C--N 1.303 -1.424 0 N-CA-C 106.368 -1.716 . . . . 0.0 106.368 177.252 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.636 ' NE2' ' CD1' ' A' ' 40' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.483 1.178 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.693 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -42.22 -59.6 1.74 Allowed 'General case' 0 N--CA 1.496 1.839 0 C-N-CA 117.63 -1.628 . . . . 0.0 106.694 178.46 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.575 ' O ' ' O ' ' A' ' 41' ' ' TRP . 0.7 OUTLIER . . . . . 0 C--N 1.297 -1.689 0 O-C-N 121.131 -0.981 . . . . 0.0 109.023 176.305 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.636 ' CD1' ' NE2' ' A' ' 36' ' ' GLN . 9.2 t80 . . . . . 0 N--CA 1.484 1.248 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.716 ' CZ2' HD13 ' A' ' 24' ' ' LEU . 8.7 m95 -81.34 -177.56 6.54 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 176.355 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.475 ' OG ' ' N ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER 73.05 -71.62 0.13 Allowed 'General case' 0 N--CA 1.496 1.848 0 CA-C-O 121.934 0.873 . . . . 0.0 111.646 177.168 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.475 ' N ' ' OG ' ' A' ' 42' ' ' SER . 0.1 OUTLIER -87.48 18.75 3.67 Favored 'General case' 0 C--N 1.278 -2.543 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 -179.903 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.519 ' OH ' ' HB3' ' A' ' 48' ' ' ASP . 0.3 OUTLIER -81.03 31.78 0.32 Allowed 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 119.764 -0.775 . . . . 0.0 110.6 -179.977 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 8.0 pttm -91.0 19.57 5.56 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 120.993 -1.067 . . . . 0.0 108.474 179.113 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -103.7 3.82 34.67 Favored 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.51 ' O ' ' CB ' ' A' ' 48' ' ' ASP . . . 91.72 -71.98 1.72 Allowed Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.252 -1.539 . . . . 0.0 109.252 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.548 ' O ' ' N ' ' A' ' 50' ' ' CYS . 1.5 p-10 159.59 37.24 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.554 -0.968 . . . . 0.0 109.136 179.66 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.618 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 21.9 mp0 51.96 -86.87 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.449 -0.782 . . . . 0.0 110.043 178.924 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' CYS . . . . . 0.548 ' N ' ' O ' ' A' ' 48' ' ' ASP . 2.7 t -39.6 -26.24 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.342 -0.849 . . . . 0.0 109.867 179.717 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.507 ' N ' ' O ' ' A' ' 49' ' ' GLN . 1.1 tt0 -53.64 134.77 41.45 Favored 'General case' 0 N--CA 1.484 1.254 0 O-C-N 120.562 -1.336 . . . . 0.0 108.466 179.522 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.471 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . 103.28 -14.07 54.94 Favored Glycine 0 N--CA 1.495 2.614 0 O-C-N 120.732 -1.23 . . . . 0.0 110.12 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.564 ' CE1' ' O ' ' A' ' 55' ' ' CYS . 0.9 OUTLIER 70.55 61.58 0.48 Allowed Pre-proline 0 N--CA 1.493 1.717 0 O-C-N 121.123 -1.222 . . . . 0.0 109.825 179.912 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.545 ' CB ' ' CE2' ' A' ' 68' ' ' TYR . 3.4 Cg_exo -58.83 -44.9 32.27 Favored 'Trans proline' 0 C--N 1.309 -1.502 0 C-N-CA 122.544 2.162 . . . . 0.0 111.205 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.564 ' O ' ' CE1' ' A' ' 53' ' ' HIS . 0.8 OUTLIER -85.52 165.12 17.37 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.235 -0.916 . . . . 0.0 109.447 -179.114 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.508 ' O ' ' HB2' ' A' ' 81' ' ' CYS . 5.9 mt -149.66 -173.93 4.55 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 120.99 -1.069 . . . . 0.0 110.739 -179.369 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.61 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 1.1 m120 43.77 63.46 1.58 Allowed 'General case' 0 C--N 1.3 -1.561 0 CA-C-O 121.812 0.815 . . . . 0.0 109.414 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.45 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 2.1 mm-40 53.93 29.19 9.56 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.641 -0.662 . . . . 0.0 110.19 177.618 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -84.32 145.65 22.28 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.38 -1.488 . . . . 0.0 109.38 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.467 ' O ' ' SG ' ' A' ' 55' ' ' CYS . 1.7 t-160 -79.05 173.23 12.78 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.047 -1.266 . . . . 0.0 108.094 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.449 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 13.5 t -140.65 105.74 5.0 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.83 -1.169 . . . . 0.0 110.922 -179.137 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.526 ' O ' ' HB2' ' A' ' 68' ' ' TYR . 3.2 mtmm . . . . . 0 C--N 1.296 -1.73 0 N-CA-C 106.072 -1.825 . . . . 0.0 106.072 177.134 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.559 ' O ' ' O ' ' A' ' 65' ' ' ILE . . . . . . . . 0 N--CA 1.492 2.418 0 N-CA-C 110.444 -1.062 . . . . 0.0 110.444 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.574 HG23 ' N ' ' A' ' 66' ' ' GLY . 0.0 OUTLIER 45.36 173.9 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.128 0 O-C-N 121.532 -0.981 . . . . 0.0 110.673 179.742 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.574 ' N ' HG23 ' A' ' 65' ' ' ILE . . . 58.96 -80.99 0.01 OUTLIER Glycine 0 N--CA 1.496 2.671 0 N-CA-C 108.98 -1.648 . . . . 0.0 108.98 -179.135 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.586 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 5.5 p-10 -135.29 -162.57 1.28 Allowed 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 178.378 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.688 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 4.5 p90 -150.76 -159.15 0.99 Allowed 'General case' 0 C--N 1.292 -1.915 0 O-C-N 120.904 -1.122 . . . . 0.0 109.709 -177.989 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -149.7 171.04 17.34 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 178.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 52.8 m -140.48 -169.1 2.7 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 120.847 -1.158 . . . . 0.0 108.726 179.19 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -160.46 124.68 3.64 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.538 -0.726 . . . . 0.0 109.318 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.52 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 66.9 m -100.93 142.05 32.95 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.038 -1.038 . . . . 0.0 109.518 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.935 ' HB3' ' CE1' ' A' ' 76' ' ' PHE . . . -73.49 -176.35 2.26 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.189 -0.945 . . . . 0.0 110.678 -179.639 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -81.23 102.44 10.35 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 123.139 1.447 . . . . 0.0 107.983 178.202 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLY . . . . . 0.466 ' HA2' ' OG1' ' A' ' 85' ' ' THR . . . 121.28 21.43 3.08 Favored Glycine 0 C--N 1.267 -3.293 0 N-CA-C 109.09 -1.604 . . . . 0.0 109.09 -179.048 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.935 ' CE1' ' HB3' ' A' ' 73' ' ' ALA . 6.0 m-85 -119.58 163.77 16.84 Favored 'General case' 0 C--N 1.294 -1.806 0 O-C-N 121.447 -1.031 . . . . 0.0 109.586 -178.369 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.493 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 1.8 mm-40 -157.21 174.41 15.51 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.956 -1.09 . . . . 0.0 110.317 -179.599 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.39 163.6 38.66 Favored Glycine 0 N--CA 1.489 2.198 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.44 -34.04 73.4 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.299 -1.118 . . . . 0.0 109.532 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.507 ' HB3' ' O ' ' A' ' 54' ' ' PRO . 0.1 OUTLIER -112.34 26.92 10.1 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 179.929 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 81' ' ' CYS . . . . . 0.508 ' HB2' ' O ' ' A' ' 56' ' ' LEU . 3.0 m 63.22 12.06 5.82 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 120.804 -1.185 . . . . 0.0 108.516 -179.03 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -47.88 -43.57 28.69 Favored 'General case' 0 C--N 1.308 -1.198 0 O-C-N 121.585 -0.697 . . . . 0.0 111.462 -179.247 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.565 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.8 OUTLIER -81.8 83.49 7.14 Favored 'General case' 0 C--N 1.297 -1.702 0 O-C-N 121.294 -0.879 . . . . 0.0 110.585 -178.838 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.467 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 89.7 p -65.0 94.62 0.14 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.152 -0.967 . . . . 0.0 108.586 178.753 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.466 ' H ' HG23 ' A' ' 85' ' ' THR . 12.0 p -58.84 -17.01 20.02 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.337 -0.852 . . . . 0.0 110.099 -179.163 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.48 ' HG2' ' NH1' ' A' ' 86' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.291 -1.969 0 CA-C-O 117.964 -1.017 . . . . 0.0 109.525 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.534 ' SG ' ' O ' ' A' ' 17' ' ' CYS . 28.7 t . . . . . 0 N--CA 1.494 1.773 0 CA-C-O 121.573 0.701 . . . . 0.0 109.51 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.824 HD11 ' OE1' ' A' ' 51' ' ' GLU . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.663 0 O-C-N 120.76 -1.212 . . . . 0.0 110.426 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 121.249 0.547 . . . . 0.0 109.606 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.563 ' O ' ' CB ' ' A' ' 23' ' ' SER . 12.8 t -111.4 -126.46 0.28 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.207 -0.933 . . . . 0.0 109.83 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.563 ' CB ' ' O ' ' A' ' 22' ' ' CYS . 1.9 t 153.86 -23.23 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.007 -1.058 . . . . 0.0 108.164 -179.682 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.519 ' CB ' ' O ' ' A' ' 23' ' ' SER . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.688 0 O-C-N 121.834 -0.541 . . . . 0.0 109.837 -179.801 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.702 ' HB1' ' CZ ' ' A' ' 31' ' ' PHE . . . . . . . . 0 N--CA 1.493 1.724 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.856 ' NH1' HG22 ' A' ' 37' ' ' THR . 0.8 OUTLIER . . . . . 0 C--N 1.297 -1.681 0 O-C-N 120.575 -1.328 . . . . 0.0 110.85 -179.792 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.432 ' HB ' ' CD1' ' A' ' 31' ' ' PHE . 79.7 t . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 120.877 0.37 . . . . 0.0 110.072 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.702 ' CZ ' ' HB1' ' A' ' 27' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.494 1.773 0 O-C-N 120.792 -1.192 . . . . 0.0 111.516 -179.459 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.526 ' HB3' ' HG2' ' A' ' 36' ' ' GLN . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.488 0 CA-C-O 121.578 0.704 . . . . 0.0 111.234 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.502 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 N--CA 1.489 1.522 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 179.375 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.791 ' NE2' ' CD1' ' A' ' 40' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.198 -1.634 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.856 HG22 ' NH1' ' A' ' 28' ' ' ARG . 0.0 OUTLIER -38.91 -57.71 1.2 Allowed 'General case' 0 N--CA 1.502 2.129 0 O-C-N 119.656 -1.903 . . . . 0.0 107.79 178.414 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.489 ' O ' ' N ' ' A' ' 41' ' ' TRP . 1.8 t70 . . . . . 0 C--N 1.295 -1.784 0 O-C-N 121.154 -0.966 . . . . 0.0 109.898 176.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.791 ' CD1' ' NE2' ' A' ' 36' ' ' GLN . 21.5 t80 . . . . . 0 N--CA 1.491 1.587 0 N-CA-C 107.294 -1.372 . . . . 0.0 107.294 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.684 ' CD1' ' O ' ' A' ' 37' ' ' THR . 11.3 m95 -80.65 -177.03 6.09 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 177.36 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.631 ' O ' ' CB ' ' A' ' 43' ' ' LYS . 0.4 OUTLIER 35.22 81.83 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.125 0 O-C-N 121.46 -0.775 . . . . 0.0 110.055 179.213 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.631 ' CB ' ' O ' ' A' ' 42' ' ' SER . 18.2 tptt 133.86 -26.0 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 105.708 -1.96 . . . . 0.0 105.708 -178.365 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.635 ' O ' ' N ' ' A' ' 46' ' ' ASP . 0.9 OUTLIER -46.55 -71.01 0.08 Allowed 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 115.263 -0.881 . . . . 0.0 108.66 179.035 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.544 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.1 OUTLIER -1.11 64.73 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.68 0 CA-C-O 121.459 0.647 . . . . 0.0 112.054 179.663 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.635 ' N ' ' O ' ' A' ' 44' ' ' TYR . 5.3 t0 -161.38 23.48 0.13 Allowed 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 -179.613 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.602 ' O ' ' HB3' ' A' ' 48' ' ' ASP . . . 82.78 -74.56 2.5 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 107.714 -2.154 . . . . 0.0 107.714 -178.058 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.602 ' HB3' ' O ' ' A' ' 47' ' ' GLY . 0.0 OUTLIER 168.25 13.58 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.02 0 O-C-N 122.239 -0.565 . . . . 0.0 109.75 178.129 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.587 ' HB2' ' O ' ' A' ' 48' ' ' ASP . 22.8 mp0 73.31 -27.27 0.19 Allowed 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.558 -0.714 . . . . 0.0 111.845 178.723 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 10.8 t -124.35 2.97 8.46 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 120.522 -1.361 . . . . 0.0 109.691 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.824 ' OE1' HD11 ' A' ' 18' ' ' LEU . 10.7 tt0 -57.62 -47.63 81.66 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.824 -1.172 . . . . 0.0 110.878 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -67.38 -0.34 10.94 Favored Glycine 0 N--CA 1.496 2.677 0 O-C-N 120.987 -1.07 . . . . 0.0 111.658 -178.313 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.532 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 2.2 t60 57.44 61.67 6.03 Favored Pre-proline 0 N--CA 1.492 1.657 0 O-C-N 120.656 -1.496 . . . . 0.0 109.105 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.532 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 1.3 Cg_endo -64.6 -45.77 8.3 Favored 'Trans proline' 0 C--N 1.31 -1.487 0 C-N-CA 122.561 2.174 . . . . 0.0 111.911 -178.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.464 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 2.1 m -63.73 161.12 15.7 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 120.901 -1.124 . . . . 0.0 109.378 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.495 ' HA ' HD23 ' A' ' 56' ' ' LEU . 4.9 mt -144.0 -174.94 4.41 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.141 -0.975 . . . . 0.0 109.927 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.61 ' O ' ' CD2' ' A' ' 76' ' ' PHE . 5.4 m-80 41.52 63.98 1.15 Allowed 'General case' 0 C--N 1.3 -1.551 0 CA-C-O 121.886 0.85 . . . . 0.0 109.56 -179.263 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.456 ' HG3' ' C ' ' A' ' 57' ' ' ASN . 0.7 OUTLIER 47.44 35.98 4.62 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.333 -0.854 . . . . 0.0 109.075 178.13 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -79.57 142.44 24.75 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.636 -1.386 . . . . 0.0 109.636 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.494 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 2.0 m80 -79.57 137.93 37.3 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.32 -1.106 . . . . 0.0 108.562 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.464 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 27.6 t -107.96 122.11 46.15 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.152 -0.967 . . . . 0.0 110.302 -179.026 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.489 ' HB2' ' OG1' ' A' ' 69' ' ' THR . 32.2 mmtt . . . . . 0 C--N 1.304 -1.382 0 N-CA-C 105.617 -1.994 . . . . 0.0 105.617 177.237 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.519 ' O ' ' OE1' ' A' ' 49' ' ' GLN . . . . . . . . 0 N--CA 1.488 2.134 0 N-CA-C 106.457 -2.657 . . . . 0.0 106.457 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.569 ' CG2' ' HG3' ' A' ' 43' ' ' LYS . 6.2 mm -98.6 -72.77 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 120.273 -1.722 . . . . 0.0 110.222 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.462 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . -42.54 -26.56 0.41 Allowed Glycine 0 N--CA 1.491 2.339 0 C-N-CA 119.553 -1.308 . . . . 0.0 110.263 -178.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.462 ' HB3' ' O ' ' A' ' 66' ' ' GLY . 2.3 p-10 179.93 -154.11 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.021 -1.282 . . . . 0.0 110.44 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.664 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 4.2 p90 -160.46 130.22 5.14 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 -178.328 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.489 ' OG1' ' HB2' ' A' ' 62' ' ' LYS . 43.5 p -98.79 117.15 32.61 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 120.71 -1.244 . . . . 0.0 109.333 -179.804 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 33.5 m -79.27 -169.24 1.79 Allowed 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.01 -1.056 . . . . 0.0 108.659 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.494 ' HB ' ' HB2' ' A' ' 60' ' ' HIS . 0.2 OUTLIER -160.48 149.82 17.34 Favored 'General case' 0 C--N 1.286 -2.159 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 179.94 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.547 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 92.8 m -114.06 118.39 33.94 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.146 -0.971 . . . . 0.0 108.945 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.864 ' HB3' ' CD1' ' A' ' 76' ' ' PHE . . . -48.26 -176.57 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.023 -1.048 . . . . 0.0 110.812 -179.223 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -80.29 101.85 9.17 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 123.278 1.513 . . . . 0.0 107.555 178.432 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLY . . . . . 0.531 ' HA2' ' HG3' ' A' ' 86' ' ' ARG . . . 118.3 20.44 4.36 Favored Glycine 0 C--N 1.268 -3.232 0 N-CA-C 108.91 -1.676 . . . . 0.0 108.91 -178.533 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.864 ' CD1' ' HB3' ' A' ' 73' ' ' ALA . 9.2 m-85 -119.55 156.04 31.06 Favored 'General case' 0 C--N 1.294 -1.827 0 O-C-N 121.621 -0.929 . . . . 0.0 109.462 -178.407 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.511 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 5.5 mm-40 -160.69 161.18 32.23 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.058 -1.026 . . . . 0.0 110.84 -179.33 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 109.97 169.7 19.96 Favored Glycine 0 N--CA 1.493 2.443 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.87 -58.87 5.2 Favored 'General case' 0 C--N 1.306 -1.324 0 O-C-N 121.094 -1.239 . . . . 0.0 109.033 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.485 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 19.2 m-20 -104.98 29.44 6.32 Favored 'General case' 0 C--N 1.289 -2.043 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 178.582 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' CYS . . . . . 0.511 ' HA ' ' O ' ' A' ' 77' ' ' GLU . 6.4 m 68.51 16.6 9.13 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.141 -0.975 . . . . 0.0 108.716 -179.306 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.443 ' C ' ' O ' ' A' ' 81' ' ' CYS . 83.2 tt0 -34.9 -32.92 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.328 0 O-C-N 121.739 -0.601 . . . . 0.0 111.763 -179.393 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.52 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.3 OUTLIER -104.35 -161.72 0.84 Allowed 'General case' 0 C--N 1.295 -1.786 0 CA-C-O 122.719 1.247 . . . . 0.0 109.379 -179.778 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.434 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 33.1 m -157.31 95.19 1.45 Allowed 'General case' 0 C--N 1.277 -2.583 0 CA-C-N 114.471 -1.241 . . . . 0.0 108.903 179.756 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.463 ' OG1' ' HA2' ' A' ' 75' ' ' GLY . 31.1 p -50.62 -35.7 31.67 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.321 -0.862 . . . . 0.0 110.234 -179.18 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.531 ' HG3' ' HA2' ' A' ' 75' ' ' GLY . 0.0 OUTLIER . . . . . 0 C--N 1.287 -2.144 0 CA-C-O 118.007 -0.996 . . . . 0.0 109.16 179.842 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.402 ' HB3' ' H ' ' A' ' 22' ' ' CYS . 84.7 m . . . . . 0 N--CA 1.5 2.059 0 CA-C-O 121.718 0.77 . . . . 0.0 109.546 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.422 HD12 ' OH ' ' A' ' 44' ' ' TYR . 0.2 OUTLIER . . . . . 0 N--CA 1.495 1.796 0 CA-C-O 121.491 0.662 . . . . 0.0 111.154 -178.705 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.419 ' C ' ' SG ' ' A' ' 22' ' ' CYS . . . . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 121.799 0.809 . . . . 0.0 109.544 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.419 ' SG ' ' C ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -152.22 -170.7 3.72 Favored 'General case' 0 C--N 1.29 -2.011 0 CA-C-O 121.52 0.676 . . . . 0.0 109.683 -179.816 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.667 ' C ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -102.34 24.55 10.12 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.913 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.672 HD22 ' N ' ' A' ' 24' ' ' LEU . 2.6 mm? . . . . . 0 N--CA 1.498 1.932 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.657 -179.699 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.403 ' HB1' ' HE1' ' A' ' 31' ' ' PHE . . . . . . . . 0 N--CA 1.494 1.758 0 CA-C-O 120.973 0.416 . . . . 0.0 110.605 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 8.5 mtt180 . . . . . 0 N--CA 1.489 1.497 0 O-C-N 120.735 -1.228 . . . . 0.0 109.589 179.592 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.522 HG12 ' CD1' ' A' ' 31' ' ' PHE . 2.8 p . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 121.404 0.621 . . . . 0.0 109.583 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.522 ' CD1' HG12 ' A' ' 30' ' ' VAL . 42.9 m-85 . . . . . 0 N--CA 1.493 1.684 0 O-C-N 121.38 -0.825 . . . . 0.0 109.491 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.56 ' HB2' ' HB2' ' A' ' 36' ' ' GLN . 23.0 m-20 . . . . . 0 C--O 1.191 -1.974 0 CA-C-O 120.422 0.154 . . . . 0.0 110.748 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.495 ' HA ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 N--CA 1.498 1.95 0 O-C-N 120.886 -1.134 . . . . 0.0 110.185 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.744 ' O ' ' HB3' ' A' ' 40' ' ' PHE . 42.6 mt-30 . . . . . 0 C--O 1.203 -1.359 0 N-CA-C 106.313 -1.736 . . . . 0.0 106.313 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.54 ' O ' ' HB3' ' A' ' 41' ' ' TRP . 1.4 m -35.94 -59.9 0.57 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.309 -0.869 . . . . 0.0 108.814 178.395 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.423 ' O ' ' N ' ' A' ' 42' ' ' SER . 5.7 m-20 . . . . . 0 C--N 1.298 -1.664 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 177.206 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.744 ' HB3' ' O ' ' A' ' 36' ' ' GLN . 7.7 t80 . . . . . 0 C--O 1.202 -1.411 0 CA-C-O 121.412 0.625 . . . . 0.0 110.259 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.556 ' CZ2' ' HD3' ' A' ' 45' ' ' LYS . 26.4 t-105 -82.32 -72.59 0.43 Allowed 'General case' 0 C--N 1.294 -1.844 0 O-C-N 121.353 -0.842 . . . . 0.0 112.499 -176.911 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.497 ' O ' ' HG3' ' A' ' 45' ' ' LYS . 35.4 p -47.96 -63.53 1.04 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.64 -1.288 . . . . 0.0 110.632 -178.313 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.7 tttm -52.32 -21.71 3.81 Favored 'General case' 0 C--N 1.291 -1.973 0 O-C-N 121.384 -0.822 . . . . 0.0 108.925 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.717 ' HB2' ' O ' ' A' ' 40' ' ' PHE . 25.2 t80 -80.19 -96.16 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 178.854 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.556 ' HD3' ' CZ2' ' A' ' 41' ' ' TRP . 4.4 mtmt 33.37 34.56 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.13 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -179.433 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.57 ' N ' ' O ' ' A' ' 44' ' ' TYR . 1.4 t70 -131.39 -21.71 2.54 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.804 -176.692 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.523 ' HA2' ' OH ' ' A' ' 44' ' ' TYR . . . 49.06 60.12 6.36 Favored Glycine 0 N--CA 1.492 2.418 0 N-CA-C 105.845 -2.902 . . . . 0.0 105.845 -177.03 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.429 ' C ' ' OE1' ' A' ' 49' ' ' GLN . 27.1 t0 -126.41 -129.87 0.24 Allowed 'General case' 0 C--N 1.307 -1.268 0 O-C-N 121.546 -0.973 . . . . 0.0 110.658 -176.743 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.599 ' CD ' ' N ' ' A' ' 49' ' ' GLN . 8.4 mp0 57.3 -86.12 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.333 -0.854 . . . . 0.0 110.445 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' CYS . . . . . 0.559 ' HA ' ' CG ' ' A' ' 54' ' ' PRO . 4.6 t -98.2 -1.58 41.75 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.03 -1.044 . . . . 0.0 111.188 -178.684 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.469 ' HG3' ' O ' ' A' ' 51' ' ' GLU . 0.6 OUTLIER -55.47 -26.01 39.95 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 120.961 -1.087 . . . . 0.0 111.527 -179.078 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.434 ' O ' ' C ' ' A' ' 53' ' ' HIS . . . -86.13 28.22 5.22 Favored Glycine 0 N--CA 1.494 2.506 0 O-C-N 120.545 -1.347 . . . . 0.0 110.921 -178.795 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.6 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 3.4 t-160 41.68 53.2 7.24 Favored Pre-proline 0 N--CA 1.493 1.715 0 O-C-N 121.108 -1.231 . . . . 0.0 109.775 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.6 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 4.0 Cg_exo -56.77 -37.17 98.54 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 C-N-CA 122.562 2.175 . . . . 0.0 111.299 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.535 ' SG ' ' CB ' ' A' ' 61' ' ' CYS . 0.6 OUTLIER -89.43 168.29 12.32 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.371 -0.831 . . . . 0.0 110.19 -178.218 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.521 ' HA ' HD23 ' A' ' 56' ' ' LEU . 5.8 mt -146.13 -173.66 4.23 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 122.08 0.943 . . . . 0.0 110.562 -179.397 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.615 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 51.0 m-80 40.29 64.56 0.9 Allowed 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 122.038 0.923 . . . . 0.0 110.124 -179.684 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.437 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 2.2 mm-40 51.35 33.4 9.89 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-O 121.561 0.696 . . . . 0.0 109.835 177.393 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -81.41 127.3 7.84 Favored Glycine 0 N--CA 1.487 2.057 0 N-CA-C 109.174 -1.57 . . . . 0.0 109.174 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -78.97 168.01 20.3 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.115 -1.227 . . . . 0.0 107.951 179.402 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.535 ' CB ' ' SG ' ' A' ' 55' ' ' CYS . 0.5 OUTLIER -156.53 126.99 6.62 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 118.323 -1.351 . . . . 0.0 111.175 -178.878 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.8 mmtm . . . . . 0 N--CA 1.487 1.422 0 N-CA-C 106.944 -1.502 . . . . 0.0 106.944 177.638 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.538 ' O ' ' O ' ' A' ' 67' ' ' ASP . . . . . . . . 0 N--CA 1.489 2.232 0 N-CA-C 108.221 -1.952 . . . . 0.0 108.221 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.834 ' O ' HD12 ' A' ' 65' ' ' ILE . 2.2 pp -38.0 160.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.504 2.253 0 CA-C-N 118.935 1.367 . . . . 0.0 110.13 -178.209 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.537 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . 95.46 -47.55 1.92 Allowed Glycine 0 C--N 1.294 -1.759 0 N-CA-C 106.07 -2.812 . . . . 0.0 106.07 -177.868 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.538 ' O ' ' O ' ' A' ' 64' ' ' GLY . 14.7 p-10 169.69 -145.61 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 178.267 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.619 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 4.1 p90 -160.53 -167.16 1.81 Allowed 'General case' 0 C--N 1.298 -1.646 0 O-C-N 120.691 -1.256 . . . . 0.0 108.926 -179.427 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.476 ' O ' ' HA ' ' A' ' 61' ' ' CYS . 0.1 OUTLIER -147.99 152.08 36.86 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 178.675 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 61' ' ' CYS . 85.0 m -116.98 -170.16 1.78 Allowed 'General case' 0 C--N 1.302 -1.481 0 O-C-N 120.496 -1.378 . . . . 0.0 109.197 179.749 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 1.8 m -161.27 108.21 1.44 Allowed 'General case' 0 C--N 1.294 -1.829 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.523 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 89.2 m -80.16 138.29 36.86 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.96 -1.087 . . . . 0.0 109.213 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.931 ' HB3' ' CE1' ' A' ' 76' ' ' PHE . . . -72.43 -174.4 1.34 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.074 -1.016 . . . . 0.0 111.25 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -81.57 102.36 10.57 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-O 123.035 1.398 . . . . 0.0 108.185 178.239 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 120.37 18.0 4.24 Favored Glycine 0 C--N 1.267 -3.294 0 N-CA-C 109.213 -1.555 . . . . 0.0 109.213 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.931 ' CE1' ' HB3' ' A' ' 73' ' ' ALA . 4.2 m-85 -115.82 163.99 15.05 Favored 'General case' 0 C--N 1.294 -1.838 0 O-C-N 121.476 -1.014 . . . . 0.0 109.622 -178.38 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.485 ' HB3' ' HB2' ' A' ' 83' ' ' PHE . 1.9 tt0 -157.38 167.15 31.11 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.146 -0.971 . . . . 0.0 110.051 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 96.4 162.86 32.95 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.636 -1.386 . . . . 0.0 109.636 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 7.4 tptt -60.19 -33.74 72.64 Favored 'General case' 0 C--N 1.306 -1.306 0 O-C-N 121.249 -1.147 . . . . 0.0 109.727 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.5 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.2 OUTLIER -113.97 22.12 14.21 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.877 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 81' ' ' CYS . . . . . 0.532 ' O ' ' ND2' ' A' ' 57' ' ' ASN . 5.0 m 70.34 7.02 6.05 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.035 -1.041 . . . . 0.0 108.85 -179.236 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.564 ' HA ' ' ND2' ' A' ' 57' ' ' ASN . 56.3 tt0 -37.6 -47.19 0.92 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.573 -0.704 . . . . 0.0 111.305 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.579 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.6 OUTLIER -82.96 83.63 7.74 Favored 'General case' 0 C--N 1.294 -1.811 0 O-C-N 121.136 -0.977 . . . . 0.0 110.55 -178.625 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.452 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 1.6 p -70.97 91.38 0.86 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.275 -0.891 . . . . 0.0 108.802 178.969 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 10.2 p -60.76 -14.97 24.72 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.311 -0.868 . . . . 0.0 110.014 -179.274 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.505 ' CD ' ' O ' ' A' ' 86' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.293 -1.852 0 CA-C-O 118.055 -0.974 . . . . 0.0 109.454 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.444 ' SG ' ' HB2' ' A' ' 27' ' ' ALA . 7.6 p . . . . . 0 N--CA 1.505 2.278 0 CA-C-O 122.106 0.955 . . . . 0.0 111.108 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.61 HD21 ' OH ' ' A' ' 44' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.289 -2.05 0 CA-C-O 121.346 0.593 . . . . 0.0 109.552 -179.38 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.409 ' O ' ' CB ' ' A' ' 22' ' ' CYS . . . . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 121.375 0.607 . . . . 0.0 110.014 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.505 ' O ' ' CB ' ' A' ' 23' ' ' SER . 0.0 OUTLIER 172.11 -29.4 0.0 OUTLIER 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.402 -0.811 . . . . 0.0 109.442 179.884 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.505 ' CB ' ' O ' ' A' ' 22' ' ' CYS . 1.7 m 77.11 -76.26 0.05 Allowed 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 -178.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.484 ' O ' ' CD1' ' A' ' 24' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.586 0 O-C-N 121.216 -0.927 . . . . 0.0 108.829 179.189 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.444 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . . . . . . . . 0 N--CA 1.5 2.041 0 CA-C-O 121.42 0.628 . . . . 0.0 109.565 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.43 ' CG ' HH11 ' A' ' 28' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.303 -1.442 0 CA-C-O 121.968 0.889 . . . . 0.0 110.831 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.619 HG12 ' CD2' ' A' ' 31' ' ' PHE . 0.4 OUTLIER . . . . . 0 N--CA 1.493 1.687 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.691 ' CZ ' ' CZ ' ' A' ' 40' ' ' PHE . 88.6 m-85 . . . . . 0 N--CA 1.494 1.765 0 O-C-N 121.227 -0.921 . . . . 0.0 110.243 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.578 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 121.334 0.588 . . . . 0.0 111.078 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.543 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 N--CA 1.491 1.605 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 179.062 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.63 ' O ' ' HB2' ' A' ' 40' ' ' PHE . 55.2 mt-30 . . . . . 0 C--O 1.204 -1.323 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.704 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -42.19 -60.61 1.4 Allowed 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 117.759 -1.577 . . . . 0.0 107.172 178.499 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.521 ' O ' ' N ' ' A' ' 41' ' ' TRP . 0.3 OUTLIER . . . . . 0 C--N 1.296 -1.753 0 O-C-N 120.844 -1.16 . . . . 0.0 109.693 177.357 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.691 ' CZ ' ' CZ ' ' A' ' 31' ' ' PHE . 7.3 t80 . . . . . 0 N--CA 1.487 1.391 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.704 ' CD1' ' O ' ' A' ' 37' ' ' THR . 9.1 m95 -77.36 -63.73 1.31 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.309 -0.869 . . . . 0.0 112.185 -179.504 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.523 ' OG ' ' N ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -42.43 -70.06 0.12 Allowed 'General case' 0 N--CA 1.499 2.008 0 O-C-N 120.843 -1.161 . . . . 0.0 112.517 -177.556 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.523 ' N ' ' OG ' ' A' ' 42' ' ' SER . 0.1 OUTLIER -79.15 32.36 0.22 Allowed 'General case' 0 C--N 1.288 -2.081 0 O-C-N 121.482 -0.761 . . . . 0.0 110.543 -178.55 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.614 ' CD1' ' O ' ' A' ' 44' ' ' TYR . 1.0 OUTLIER -80.91 33.9 0.34 Allowed 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.126 -0.984 . . . . 0.0 110.414 179.7 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.14 37.99 1.21 Allowed 'General case' 0 C--N 1.302 -1.459 0 O-C-N 120.557 -1.339 . . . . 0.0 107.702 178.569 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -126.58 -1.1 6.81 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.724 -0.61 . . . . 0.0 109.912 -178.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.543 ' O ' ' CB ' ' A' ' 48' ' ' ASP . . . 71.64 6.71 63.36 Favored Glycine 0 N--CA 1.495 2.579 0 N-CA-C 109.179 -1.569 . . . . 0.0 109.179 -179.195 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.642 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER 85.62 5.32 0.48 Allowed 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.743 -0.857 . . . . 0.0 109.907 179.746 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.715 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 36.3 mm-40 82.37 -47.52 0.18 Allowed 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.819 -0.55 . . . . 0.0 111.723 178.798 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 11.2 t -83.04 -0.44 48.96 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.946 -1.096 . . . . 0.0 109.757 -179.537 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.493 ' OE1' ' CA ' ' A' ' 47' ' ' GLY . 47.3 tt0 -74.81 148.2 40.53 Favored 'General case' 0 N--CA 1.484 1.257 0 O-C-N 121.09 -1.007 . . . . 0.0 108.425 179.339 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 91.65 0.07 73.07 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.38 -1.488 . . . . 0.0 109.38 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.452 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 0.8 OUTLIER 54.41 63.3 7.5 Favored Pre-proline 0 C--N 1.307 -1.263 0 O-C-N 121.225 -1.162 . . . . 0.0 109.762 179.39 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.452 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 4.6 Cg_exo -56.88 -38.48 95.8 Favored 'Trans proline' 0 C--N 1.309 -1.506 0 C-N-CA 122.448 2.099 . . . . 0.0 110.325 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.474 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 0.3 OUTLIER -86.37 169.59 12.78 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.365 -0.835 . . . . 0.0 109.59 -179.714 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.507 ' O ' ' HB2' ' A' ' 81' ' ' CYS . 4.8 mt -147.13 -174.52 4.53 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.31 -0.869 . . . . 0.0 109.594 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.598 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 1.4 m-80 41.56 63.2 1.33 Allowed 'General case' 0 C--N 1.301 -1.531 0 CA-C-O 121.778 0.799 . . . . 0.0 109.824 -179.633 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.452 ' HG3' ' C ' ' A' ' 57' ' ' ASN . 1.8 mt-30 45.84 35.92 2.56 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.372 -0.83 . . . . 0.0 109.374 177.757 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -80.38 151.78 33.3 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -79.36 166.03 22.5 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.276 -1.132 . . . . 0.0 108.895 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.474 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 37.7 t -139.36 128.03 23.22 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.06 -1.025 . . . . 0.0 110.212 -179.515 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.512 ' HB2' ' OG1' ' A' ' 69' ' ' THR . 9.1 mmmt . . . . . 0 C--N 1.304 -1.373 0 N-CA-C 106.332 -1.729 . . . . 0.0 106.332 177.693 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.512 ' O ' ' O ' ' A' ' 67' ' ' ASP . . . . . . . . 0 N--CA 1.488 2.119 0 N-CA-C 107.688 -2.165 . . . . 0.0 107.688 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.498 HG22 ' N ' ' A' ' 66' ' ' GLY . 0.5 OUTLIER -46.15 -59.43 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.555 0 O-C-N 120.578 -1.542 . . . . 0.0 109.164 -179.128 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.498 ' N ' HG22 ' A' ' 65' ' ' ILE . . . -44.64 -38.2 5.4 Favored Glycine 0 N--CA 1.493 2.448 0 N-CA-C 110.552 -1.019 . . . . 0.0 110.552 -178.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.512 ' O ' ' O ' ' A' ' 64' ' ' GLY . 9.0 p-10 177.59 -147.7 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.172 -1.193 . . . . 0.0 110.555 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.715 ' CD1' ' HB3' ' A' ' 49' ' ' GLN . 1.7 p90 -156.86 -170.89 3.45 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.924 -1.11 . . . . 0.0 109.741 -179.424 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.512 ' OG1' ' HB2' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -160.62 112.9 1.96 Allowed 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.296 -0.877 . . . . 0.0 109.815 -179.739 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 35.6 m -80.42 -171.09 2.86 Favored 'General case' 0 C--N 1.296 -1.758 0 O-C-N 120.976 -1.077 . . . . 0.0 110.107 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.444 ' O ' ' SG ' ' A' ' 81' ' ' CYS . 0.2 OUTLIER -160.67 166.97 27.91 Favored 'General case' 0 C--N 1.288 -2.086 0 CA-C-N 115.362 -0.836 . . . . 0.0 108.779 179.927 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.534 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 90.4 m -128.96 125.59 37.78 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.025 -1.047 . . . . 0.0 109.269 179.589 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.9 ' HB3' ' CD1' ' A' ' 76' ' ' PHE . . . -51.0 179.95 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.017 -1.052 . . . . 0.0 110.552 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -80.95 102.27 10.02 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 123.119 1.437 . . . . 0.0 107.735 178.278 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLY . . . . . 0.485 ' CA ' ' OG1' ' A' ' 85' ' ' THR . . . 118.68 23.04 3.49 Favored Glycine 0 C--N 1.268 -3.218 0 N-CA-C 108.756 -1.738 . . . . 0.0 108.756 -178.516 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.9 ' CD1' ' HB3' ' A' ' 73' ' ' ALA . 8.7 m-85 -119.14 159.35 24.14 Favored 'General case' 0 C--N 1.294 -1.817 0 O-C-N 121.67 -0.9 . . . . 0.0 109.451 -178.167 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.477 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 0.2 OUTLIER -156.16 165.7 35.63 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 120.879 -1.138 . . . . 0.0 110.59 -179.06 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 101.77 165.52 27.12 Favored Glycine 0 N--CA 1.493 2.47 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -58.01 -39.51 78.48 Favored 'General case' 0 C--N 1.307 -1.263 0 O-C-N 121.13 -1.218 . . . . 0.0 109.404 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.489 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 3.8 m-20 -113.56 24.42 12.2 Favored 'General case' 0 C--N 1.291 -1.946 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 179.577 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' CYS . . . . . 0.509 ' HB2' ' HB2' ' A' ' 57' ' ' ASN . 4.6 m 71.14 6.1 5.71 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 120.985 -1.072 . . . . 0.0 109.305 -179.848 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.462 ' C ' ' O ' ' A' ' 81' ' ' CYS . 15.0 tt0 -33.15 -46.81 0.17 Allowed 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.341 0.591 . . . . 0.0 111.579 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.613 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.2 OUTLIER -88.16 89.63 8.07 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.472 -0.767 . . . . 0.0 110.576 -178.517 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.486 ' N ' ' OD1' ' A' ' 57' ' ' ASN . 3.8 p -70.58 92.64 0.86 Allowed 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 178.588 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.485 ' OG1' ' CA ' ' A' ' 75' ' ' GLY . 16.6 p -42.87 -28.87 0.28 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.246 -0.909 . . . . 0.0 110.242 -178.819 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.593 ' CZ ' ' CB ' ' A' ' 86' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.289 -2.025 0 CA-C-O 118.029 -0.986 . . . . 0.0 109.526 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.482 ' O ' ' HB2' ' A' ' 18' ' ' LEU . 5.7 m . . . . . 0 N--CA 1.497 1.877 0 CA-C-O 121.155 0.503 . . . . 0.0 109.822 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.645 HD12 ' CB ' ' A' ' 48' ' ' ASP . 2.5 mm? . . . . . 0 N--CA 1.489 1.508 0 CA-C-O 121.873 0.844 . . . . 0.0 110.254 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.434 ' O ' ' CB ' ' A' ' 22' ' ' CYS . . . . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 121.587 0.708 . . . . 0.0 109.351 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.434 ' CB ' ' O ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER 172.63 -22.76 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.705 0 O-C-N 121.612 -0.68 . . . . 0.0 109.465 179.703 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.501 ' O ' ' HB2' ' A' ' 27' ' ' ALA . 5.9 p 53.81 -147.04 0.51 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.004 -1.06 . . . . 0.0 110.23 179.052 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.628 ' HG ' ' CZ2' ' A' ' 41' ' ' TRP . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.546 0 O-C-N 121.389 -0.82 . . . . 0.0 110.063 -179.669 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.58 ' O ' ' CD1' ' A' ' 31' ' ' PHE . . . . . . . . 0 N--CA 1.493 1.709 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.496 1.862 0 O-C-N 120.672 -1.268 . . . . 0.0 111.008 -179.085 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.61 HG12 ' CD1' ' A' ' 31' ' ' PHE . 1.2 t . . . . . 0 N--CA 1.494 1.775 0 CA-C-O 121.262 0.554 . . . . 0.0 109.678 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.61 ' CD1' HG12 ' A' ' 30' ' ' VAL . 7.4 m-85 . . . . . 0 C--N 1.295 -1.771 0 O-C-N 121.1 -1.0 . . . . 0.0 113.32 -177.239 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.495 ' HB3' ' HB2' ' A' ' 36' ' ' GLN . 69.7 m-20 . . . . . 0 N--CA 1.483 1.215 0 CA-C-O 121.093 0.473 . . . . 0.0 111.325 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.513 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 C--N 1.305 -1.357 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 177.556 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.672 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 22.4 mm-40 . . . . . 0 C--O 1.202 -1.427 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.66 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -47.14 -60.23 2.61 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 119.506 -1.996 . . . . 0.0 107.082 177.76 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.43 ' O ' ' N ' ' A' ' 41' ' ' TRP . 0.5 OUTLIER . . . . . 0 N--CA 1.493 1.693 0 O-C-N 121.331 -0.856 . . . . 0.0 109.655 177.336 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.672 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 19.8 t80 . . . . . 0 N--CA 1.493 1.714 0 N-CA-C 107.259 -1.386 . . . . 0.0 107.259 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.66 ' CD1' ' O ' ' A' ' 37' ' ' THR . 7.9 m95 -80.73 178.61 8.26 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 177.419 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.523 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 23.2 t 63.63 105.31 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.821 -1.175 . . . . 0.0 110.757 179.092 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.65 ' HD2' HG22 ' A' ' 65' ' ' ILE . 0.0 OUTLIER 79.21 14.17 1.1 Allowed 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.667 0.746 . . . . 0.0 108.988 179.514 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.529 ' CD1' ' O ' ' A' ' 44' ' ' TYR . 1.1 t80 -81.38 34.14 0.37 Allowed 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.417 -0.802 . . . . 0.0 110.208 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 2.1 mmmt -92.72 32.81 1.19 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 120.932 -1.105 . . . . 0.0 109.217 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -116.33 3.39 13.34 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.329 -0.857 . . . . 0.0 109.539 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.575 ' O ' ' CB ' ' A' ' 48' ' ' ASP . . . 88.4 -40.04 3.09 Favored Glycine 0 N--CA 1.494 2.547 0 N-CA-C 108.937 -1.665 . . . . 0.0 108.937 -179.418 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.645 ' CB ' HD12 ' A' ' 18' ' ' LEU . 5.5 p30 152.04 15.83 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.036 0 O-C-N 122.11 -0.641 . . . . 0.0 110.027 179.184 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.571 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 68.2 mm-40 69.72 -11.39 0.53 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.229 -0.919 . . . . 0.0 111.1 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' CYS . . . . . 0.472 ' SG ' ' HD2' ' A' ' 54' ' ' PRO . 49.3 t -135.26 10.69 3.52 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 120.749 -1.22 . . . . 0.0 109.729 179.123 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.492 ' HB2' ' OD1' ' A' ' 48' ' ' ASP . 3.2 tt0 -58.58 -53.14 61.69 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.834 -1.166 . . . . 0.0 110.199 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.478 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . -68.37 -3.81 34.09 Favored Glycine 0 N--CA 1.492 2.426 0 C-N-CA 120.257 -0.973 . . . . 0.0 110.776 -179.043 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.478 ' HB3' ' O ' ' A' ' 52' ' ' GLY . 1.5 t-80 68.32 70.18 0.43 Allowed Pre-proline 0 N--CA 1.492 1.657 0 O-C-N 120.942 -1.328 . . . . 0.0 109.363 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.495 ' CB ' ' CE2' ' A' ' 68' ' ' TYR . 5.8 Cg_exo -60.29 -38.25 76.74 Favored 'Trans proline' 0 C--N 1.308 -1.568 0 C-N-CA 122.599 2.199 . . . . 0.0 111.35 -179.701 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.482 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 1.8 m -78.07 172.52 13.39 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.217 -0.927 . . . . 0.0 109.891 -178.815 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.5 mt -149.47 -173.41 4.39 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.061 -1.024 . . . . 0.0 110.373 -179.434 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.597 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 2.1 m-80 41.79 63.55 1.28 Allowed 'General case' 0 C--N 1.303 -1.452 0 CA-C-O 121.855 0.836 . . . . 0.0 110.132 -179.619 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.5 mm100 47.98 33.53 3.49 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.376 -0.828 . . . . 0.0 109.856 177.498 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -78.74 143.67 26.95 Favored Glycine 0 N--CA 1.488 2.105 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.479 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 68.6 m80 -78.84 123.33 27.11 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 179.037 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.482 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 41.2 t -101.12 113.46 26.51 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.187 -0.946 . . . . 0.0 111.507 -177.635 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.507 ' HB3' ' OG1' ' A' ' 69' ' ' THR . 0.1 OUTLIER . . . . . 0 C--N 1.301 -1.534 0 N-CA-C 105.955 -1.869 . . . . 0.0 105.955 176.762 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.528 ' O ' ' CG ' ' A' ' 49' ' ' GLN . . . . . . . . 0 N--CA 1.488 2.103 0 N-CA-C 107.479 -2.249 . . . . 0.0 107.479 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.65 HG22 ' HD2' ' A' ' 43' ' ' LYS . 19.3 mm -93.63 -61.6 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 120.609 -1.524 . . . . 0.0 109.8 -179.905 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.492 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . -47.63 -25.0 3.08 Favored Glycine 0 N--CA 1.488 2.111 0 N-CA-C 108.645 -1.782 . . . . 0.0 108.645 179.446 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.492 ' HB3' ' O ' ' A' ' 66' ' ' GLY . 3.3 p-10 176.78 -149.36 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.645 -0.915 . . . . 0.0 109.69 179.255 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.641 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 4.3 p90 -160.31 -167.09 1.82 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.37 -0.831 . . . . 0.0 109.248 -179.065 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.507 ' OG1' ' HB3' ' A' ' 62' ' ' LYS . 0.1 OUTLIER -144.96 171.63 14.18 Favored 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 178.651 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 20.6 m -136.27 -174.5 3.7 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 120.843 -1.161 . . . . 0.0 108.313 179.253 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.479 ' HB ' ' HB2' ' A' ' 60' ' ' HIS . 0.2 OUTLIER -160.54 150.85 18.1 Favored 'General case' 0 C--N 1.292 -1.909 0 O-C-N 121.518 -0.739 . . . . 0.0 109.249 179.478 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.53 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 88.3 m -120.95 124.86 45.94 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.114 -0.991 . . . . 0.0 109.133 179.712 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.868 ' HB3' ' CE1' ' A' ' 76' ' ' PHE . . . -57.13 -179.81 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.019 -1.051 . . . . 0.0 111.103 -179.27 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.26 100.97 6.04 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 123.425 1.583 . . . . 0.0 108.702 178.633 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLY . . . . . 0.487 ' HA2' ' OG1' ' A' ' 85' ' ' THR . . . 119.5 20.42 3.91 Favored Glycine 0 C--N 1.266 -3.309 0 CA-C-N 113.21 -1.814 . . . . 0.0 108.834 -178.672 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.868 ' CE1' ' HB3' ' A' ' 73' ' ' ALA . 6.5 m-85 -117.51 158.03 25.26 Favored 'General case' 0 C--N 1.296 -1.749 0 O-C-N 121.61 -0.935 . . . . 0.0 109.89 -178.036 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.607 ' HG2' HG23 ' A' ' 85' ' ' THR . 0.9 OUTLIER -160.08 163.33 33.97 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.18 -0.95 . . . . 0.0 110.487 -179.505 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 108.23 166.33 21.24 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.14 -39.42 72.24 Favored 'General case' 0 C--N 1.308 -1.216 0 O-C-N 121.167 -1.196 . . . . 0.0 109.17 179.716 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.514 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 70.8 m-20 -119.03 29.5 7.66 Favored 'General case' 0 C--N 1.292 -1.933 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 179.315 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' CYS . . . . . 0.521 ' HB2' ' HB2' ' A' ' 57' ' ' ASN . 6.8 m 68.41 10.73 8.03 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.035 -1.041 . . . . 0.0 108.575 -179.13 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.461 ' C ' ' O ' ' A' ' 81' ' ' CYS . 22.1 tt0 -29.47 -45.45 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 121.186 0.517 . . . . 0.0 112.232 -179.543 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.468 ' HB2' ' HG3' ' A' ' 77' ' ' GLU . 0.4 OUTLIER -101.41 -161.06 0.83 Allowed 'General case' 0 C--N 1.294 -1.832 0 CA-C-O 122.84 1.305 . . . . 0.0 109.834 -178.895 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.416 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 1.5 p -147.94 115.04 6.16 Favored 'General case' 0 C--N 1.278 -2.518 0 CA-C-N 114.23 -1.35 . . . . 0.0 108.877 179.713 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.607 HG23 ' HG2' ' A' ' 77' ' ' GLU . 18.2 p -63.44 -18.24 63.54 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.128 -0.983 . . . . 0.0 109.729 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.1 ptt180 . . . . . 0 C--N 1.293 -1.87 0 CA-C-O 118.01 -0.995 . . . . 0.0 109.504 -179.987 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.561 ' HA ' ' HB3' ' A' ' 22' ' ' CYS . 1.7 m . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 121.375 0.607 . . . . 0.0 110.194 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 1.043 HD13 ' O ' ' A' ' 18' ' ' LEU . 2.8 tm? . . . . . 0 C--N 1.298 -1.667 0 CA-C-O 121.943 0.878 . . . . 0.0 108.709 178.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 121.059 0.457 . . . . 0.0 109.918 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.561 ' HB3' ' HA ' ' A' ' 17' ' ' CYS . 7.0 t 179.33 158.87 0.64 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.116 -0.99 . . . . 0.0 109.259 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.538 ' O ' ' CB ' ' A' ' 17' ' ' CYS . 3.1 m -99.62 -161.5 0.88 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.964 -1.085 . . . . 0.0 110.721 -178.461 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.915 HD12 ' CZ3' ' A' ' 41' ' ' TRP . 3.9 mm? . . . . . 0 N--CA 1.488 1.463 0 O-C-N 121.541 -0.724 . . . . 0.0 109.5 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.652 ' O ' ' CE1' ' A' ' 31' ' ' PHE . . . . . . . . 0 N--CA 1.492 1.657 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.449 ' CG ' HH11 ' A' ' 28' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.691 0 O-C-N 120.658 -1.277 . . . . 0.0 109.752 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 53.3 t . . . . . 0 N--CA 1.488 1.434 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.652 ' CE1' ' O ' ' A' ' 27' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.57 0 O-C-N 120.848 -1.158 . . . . 0.0 110.38 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.566 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 0.8 OUTLIER . . . . . 0 N--CA 1.482 1.159 0 CA-C-O 121.067 0.46 . . . . 0.0 110.442 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.522 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 N--CA 1.491 1.603 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.683 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 3.4 mm100 . . . . . 0 C--O 1.203 -1.37 0 N-CA-C 107.834 -1.173 . . . . 0.0 107.834 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.688 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -40.28 -59.82 1.21 Allowed 'General case' 0 N--CA 1.502 2.133 0 O-C-N 120.203 -1.561 . . . . 0.0 107.787 178.812 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.453 ' O ' ' N ' ' A' ' 41' ' ' TRP . 0.5 OUTLIER . . . . . 0 C--N 1.297 -1.714 0 O-C-N 120.969 -1.082 . . . . 0.0 109.46 177.847 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.683 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 14.9 t80 . . . . . 0 C--O 1.203 -1.386 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.915 ' CZ3' HD12 ' A' ' 24' ' ' LEU . 10.2 m95 -81.22 -68.78 0.66 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.933 -1.104 . . . . 0.0 112.427 -179.156 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.527 ' O ' ' CG ' ' A' ' 45' ' ' LYS . 0.3 OUTLIER -49.16 -53.25 21.94 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.65 -1.281 . . . . 0.0 111.476 -177.377 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.545 ' HG2' ' HB ' ' A' ' 65' ' ' ILE . 0.4 OUTLIER -62.74 -27.35 69.21 Favored 'General case' 0 C--N 1.283 -2.3 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 179.793 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.612 ' CA ' HG21 ' A' ' 65' ' ' ILE . 25.4 t80 -81.35 -95.63 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.381 0 O-C-N 121.425 -0.797 . . . . 0.0 108.857 179.368 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.556 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.0 OUTLIER 29.32 38.2 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.365 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 -178.782 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.601 ' N ' ' O ' ' A' ' 44' ' ' TYR . 19.7 t0 -127.91 -18.89 4.13 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.672 -176.44 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.472 ' HA2' ' OH ' ' A' ' 44' ' ' TYR . . . 49.73 49.36 34.52 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 105.897 -2.881 . . . . 0.0 105.897 -177.338 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.502 ' O ' ' C ' ' A' ' 49' ' ' GLN . 15.1 t0 -117.31 -138.18 0.36 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 122.089 -0.653 . . . . 0.0 110.625 -177.245 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.64 ' O ' ' CB ' ' A' ' 50' ' ' CYS . 7.3 mt-30 24.0 80.15 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.893 0 CA-C-O 121.617 0.722 . . . . 0.0 111.487 -179.654 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' CYS . . . . . 0.64 ' CB ' ' O ' ' A' ' 49' ' ' GLN . 50.5 t 112.8 -30.59 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 115.279 -0.873 . . . . 0.0 108.863 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.457 ' CB ' ' O ' ' A' ' 47' ' ' GLY . 1.4 tm-20 -61.47 -53.17 59.95 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.359 -0.838 . . . . 0.0 109.985 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.56 ' O ' ' CB ' ' A' ' 53' ' ' HIS . . . -61.28 -9.61 17.25 Favored Glycine 0 N--CA 1.493 2.474 0 N-CA-C 110.035 -1.226 . . . . 0.0 110.035 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.703 ' CE1' HD23 ' A' ' 56' ' ' LEU . 1.0 OUTLIER 80.74 53.73 0.1 Allowed Pre-proline 0 N--CA 1.486 1.355 0 O-C-N 121.372 -1.076 . . . . 0.0 110.193 179.563 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.548 ' CD ' ' N ' ' A' ' 53' ' ' HIS . 3.4 Cg_exo -57.91 -38.16 93.41 Favored 'Trans proline' 0 C--N 1.312 -1.377 0 C-N-CA 122.457 2.105 . . . . 0.0 109.731 178.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.45 ' O ' ' ND1' ' A' ' 53' ' ' HIS . 1.6 m -96.1 174.29 6.99 Favored 'General case' 0 C--N 1.298 -1.657 0 CA-C-O 121.157 0.503 . . . . 0.0 109.844 -178.669 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.703 HD23 ' CE1' ' A' ' 53' ' ' HIS . 5.1 mt -149.6 -174.78 4.78 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.114 -0.991 . . . . 0.0 110.309 -179.568 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.624 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 4.2 m-20 45.54 62.18 2.29 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-O 121.769 0.795 . . . . 0.0 109.929 -179.578 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.45 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 1.8 mm100 49.94 28.04 2.68 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.55 -0.719 . . . . 0.0 110.653 177.193 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -65.57 132.77 35.2 Favored Glycine 0 N--CA 1.489 2.201 0 N-CA-C 109.012 -1.635 . . . . 0.0 109.012 179.555 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 57.7 t60 -79.07 136.28 37.12 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.106 -1.232 . . . . 0.0 108.288 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 70' ' ' CYS . 1.1 p -120.52 150.85 40.19 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 120.969 -1.082 . . . . 0.0 111.344 -178.373 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.502 ' HB2' ' OG1' ' A' ' 69' ' ' THR . 8.3 mttp . . . . . 0 C--N 1.299 -1.614 0 N-CA-C 105.364 -2.087 . . . . 0.0 105.364 177.037 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.521 ' O ' ' O ' ' A' ' 65' ' ' ILE . . . . . . . . 0 N--CA 1.483 1.797 0 N-CA-C 107.031 -2.428 . . . . 0.0 107.031 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.824 ' O ' HD12 ' A' ' 65' ' ' ILE . 2.4 pp -35.63 154.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 CA-C-N 118.322 1.061 . . . . 0.0 110.016 -177.819 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.499 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . 103.47 -44.42 1.49 Allowed Glycine 0 N--CA 1.483 1.812 0 N-CA-C 104.432 -3.467 . . . . 0.0 104.432 -176.104 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.499 ' HB3' ' O ' ' A' ' 66' ' ' GLY . 5.2 p-10 171.81 -152.35 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 176.508 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.61 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 6.4 p90 -158.43 115.05 2.79 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 -179.359 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.502 ' OG1' ' HB2' ' A' ' 62' ' ' LYS . 76.8 p -79.67 115.11 19.1 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 120.659 -1.275 . . . . 0.0 109.438 -178.969 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 61' ' ' CYS . 0.0 OUTLIER -103.12 -172.54 2.13 Favored 'General case' 0 C--N 1.304 -1.384 0 O-C-N 121.195 -0.94 . . . . 0.0 109.303 179.814 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 7.8 m -162.03 131.4 4.49 Favored 'General case' 0 C--N 1.291 -1.976 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 179.339 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.537 ' HB3' ' CB ' ' A' ' 76' ' ' PHE . 94.1 m -82.05 116.49 21.67 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.832 -1.167 . . . . 0.0 108.569 179.152 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.887 ' HB3' ' CD1' ' A' ' 76' ' ' PHE . . . -43.67 172.56 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.014 -1.054 . . . . 0.0 111.319 -179.075 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.02 100.41 3.57 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-O 123.583 1.659 . . . . 0.0 108.586 178.625 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLY . . . . . 0.552 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 118.96 28.96 1.92 Allowed Glycine 0 C--N 1.264 -3.47 0 N-CA-C 108.066 -2.013 . . . . 0.0 108.066 -178.284 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.887 ' CD1' ' HB3' ' A' ' 73' ' ' ALA . 17.7 m-85 -128.0 148.78 50.54 Favored 'General case' 0 C--N 1.296 -1.759 0 O-C-N 121.833 -0.804 . . . . 0.0 110.367 -178.218 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.757 ' HB2' HG23 ' A' ' 85' ' ' THR . 0.7 OUTLIER -152.58 166.55 31.69 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.252 -0.905 . . . . 0.0 110.514 -179.73 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 109.24 163.97 20.15 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.476 -1.45 . . . . 0.0 109.476 179.599 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.6 tptt -57.84 -33.61 68.83 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.113 -1.228 . . . . 0.0 109.106 179.641 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.506 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.4 OUTLIER -121.9 27.76 7.93 Favored 'General case' 0 C--N 1.291 -1.963 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 179.644 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 81' ' ' CYS . . . . . 0.515 ' O ' ' HB2' ' A' ' 57' ' ' ASN . 4.7 m 62.53 14.24 6.87 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 -178.453 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.448 ' C ' ' O ' ' A' ' 81' ' ' CYS . 45.9 tt0 -33.54 -36.94 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.323 0 O-C-N 121.666 -0.646 . . . . 0.0 111.923 -179.101 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.623 ' O ' ' ND2' ' A' ' 57' ' ' ASN . 1.3 m-85 -106.19 -166.49 1.2 Allowed 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 122.809 1.29 . . . . 0.0 109.492 -179.309 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.498 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 0.7 OUTLIER -138.82 107.27 5.83 Favored 'General case' 0 C--N 1.275 -2.659 0 CA-C-N 114.415 -1.266 . . . . 0.0 109.113 -179.871 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.757 HG23 ' HB2' ' A' ' 77' ' ' GLU . 2.4 p -62.36 96.49 0.08 Allowed 'General case' 0 C--N 1.302 -1.464 0 O-C-N 120.913 -1.117 . . . . 0.0 110.032 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.527 ' HG2' ' NH1' ' A' ' 86' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.294 -1.829 0 CA-C-O 118.052 -0.975 . . . . 0.0 110.099 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.831 ' O ' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.691 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.619 ' C ' HD12 ' A' ' 18' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--N 1.301 -1.539 0 O-C-N 121.394 -0.816 . . . . 0.0 109.998 179.864 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.831 ' HB3' ' O ' ' A' ' 17' ' ' CYS . . . . . . . . 0 N--CA 1.487 1.395 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.517 ' HB3' ' HB2' ' A' ' 17' ' ' CYS . 1.0 OUTLIER -113.37 173.98 6.14 Favored 'General case' 0 N--CA 1.496 1.827 0 C-N-CA 119.656 -0.818 . . . . 0.0 109.412 179.281 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.614 ' O ' ' HB2' ' A' ' 24' ' ' LEU . 29.7 t -121.84 14.33 10.8 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.227 -0.92 . . . . 0.0 109.461 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.702 HD22 ' N ' ' A' ' 24' ' ' LEU . 3.5 mm? . . . . . 0 N--CA 1.503 2.195 0 O-C-N 122.162 -0.336 . . . . 0.0 110.61 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.664 ' O ' HG12 ' A' ' 30' ' ' VAL . . . . . . . . 0 N--CA 1.49 1.573 0 CA-C-O 121.216 0.531 . . . . 0.0 109.626 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.44 ' CG ' HH11 ' A' ' 28' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 122.309 1.052 . . . . 0.0 110.105 -179.568 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.664 HG12 ' O ' ' A' ' 27' ' ' ALA . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 120.49 0.186 . . . . 0.0 110.763 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.648 ' CE2' ' CE2' ' A' ' 40' ' ' PHE . 0.1 OUTLIER . . . . . 0 N--CA 1.495 1.808 0 O-C-N 120.474 -1.391 . . . . 0.0 111.626 -179.784 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.574 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 6.8 m-20 . . . . . 0 N--CA 1.482 1.134 0 CA-C-O 121.433 0.635 . . . . 0.0 111.417 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.507 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 N--CA 1.487 1.413 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 178.582 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.662 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 11.1 mm100 . . . . . 0 C--O 1.203 -1.37 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.64 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.1 OUTLIER -40.88 -59.1 1.51 Allowed 'General case' 0 N--CA 1.498 1.943 0 C-N-CA 118.23 -1.388 . . . . 0.0 108.631 179.31 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.4 ' O ' ' N ' ' A' ' 41' ' ' TRP . 0.8 OUTLIER . . . . . 0 N--CA 1.493 1.718 0 O-C-N 121.043 -1.036 . . . . 0.0 110.196 178.796 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.662 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 10.0 t80 . . . . . 0 N--CA 1.485 1.284 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.64 ' CD1' ' O ' ' A' ' 37' ' ' THR . 9.4 m95 -81.3 -69.32 0.62 Allowed 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.522 -0.736 . . . . 0.0 112.802 -178.759 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.489 ' OG ' ' N ' ' A' ' 43' ' ' LYS . 0.1 OUTLIER -42.89 -73.74 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.026 0 O-C-N 120.831 -1.168 . . . . 0.0 112.646 -176.906 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.55 ' HD2' ' CG2' ' A' ' 65' ' ' ILE . 1.4 ptpt -78.2 31.88 0.18 Allowed 'General case' 0 C--N 1.287 -2.113 0 O-C-N 121.649 -0.657 . . . . 0.0 110.57 -178.509 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.59 ' HB2' ' O ' ' A' ' 40' ' ' PHE . 0.8 OUTLIER -80.26 23.37 0.49 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.014 -1.054 . . . . 0.0 110.693 179.747 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -90.21 31.92 0.97 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 120.776 -1.202 . . . . 0.0 108.619 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.52 ' OD2' ' NE2' ' A' ' 49' ' ' GLN . 1.6 t0 -111.12 4.12 19.09 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.464 -0.773 . . . . 0.0 109.827 -179.235 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.546 ' O ' ' CB ' ' A' ' 48' ' ' ASP . . . 69.42 16.13 71.17 Favored Glycine 0 N--CA 1.492 2.395 0 N-CA-C 108.577 -1.809 . . . . 0.0 108.577 -179.086 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.584 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER 83.58 7.96 0.64 Allowed 'General case' 0 N--CA 1.501 2.106 0 O-C-N 121.779 -0.836 . . . . 0.0 109.527 -179.815 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.631 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 33.7 mm-40 72.33 -21.91 0.22 Allowed 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.462 -0.774 . . . . 0.0 111.838 179.273 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' CYS . . . . . 0.497 ' O ' ' HD3' ' A' ' 54' ' ' PRO . 25.1 t -105.97 -20.05 13.55 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.426 -1.421 . . . . 0.0 109.436 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.486 ' HB2' ' O ' ' A' ' 47' ' ' GLY . 72.5 tt0 -49.83 136.45 17.97 Favored 'General case' 0 N--CA 1.485 1.281 0 O-C-N 121.088 -1.007 . . . . 0.0 109.073 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 100.0 -11.9 60.59 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 110.094 -1.203 . . . . 0.0 110.094 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.425 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 1.9 t-80 60.82 65.74 1.96 Allowed Pre-proline 0 N--CA 1.491 1.582 0 O-C-N 121.088 -1.242 . . . . 0.0 109.436 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.497 ' HD3' ' O ' ' A' ' 50' ' ' CYS . 5.7 Cg_exo -58.86 -38.57 87.78 Favored 'Trans proline' 0 C--N 1.308 -1.558 0 C-N-CA 122.415 2.077 . . . . 0.0 110.751 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.466 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 1.8 m -72.4 172.45 10.39 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.353 -0.842 . . . . 0.0 109.233 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.487 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 4.7 mt -144.88 -174.99 4.5 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.238 -0.914 . . . . 0.0 109.934 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.614 ' O ' ' CD2' ' A' ' 76' ' ' PHE . 4.0 m-20 44.76 61.9 2.29 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-O 121.666 0.746 . . . . 0.0 109.538 -179.857 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.455 ' HG3' ' C ' ' A' ' 57' ' ' ASN . 1.4 mt-30 45.18 33.84 1.24 Allowed 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.232 -0.917 . . . . 0.0 109.387 177.868 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -80.27 152.28 34.12 Favored Glycine 0 N--CA 1.489 2.182 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.467 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 0.0 OUTLIER -79.85 169.31 18.1 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.337 -1.096 . . . . 0.0 108.631 179.502 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.466 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 19.2 t -140.72 125.87 18.51 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.024 -1.047 . . . . 0.0 110.125 -179.389 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.529 ' O ' ' HB2' ' A' ' 68' ' ' TYR . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.375 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 178.148 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.557 ' O ' ' N ' ' A' ' 66' ' ' GLY . . . . . . . . 0 N--CA 1.49 2.262 0 N-CA-C 110.026 -1.23 . . . . 0.0 110.026 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.698 HG22 ' N ' ' A' ' 66' ' ' GLY . 2.2 mm 47.67 -86.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 121.432 -1.04 . . . . 0.0 110.081 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.698 ' N ' HG22 ' A' ' 65' ' ' ILE . . . -31.26 -38.24 0.03 OUTLIER Glycine 0 N--CA 1.5 2.938 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.517 ' N ' ' O ' ' A' ' 65' ' ' ILE . 5.0 p-10 -175.29 -150.42 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.393 -1.063 . . . . 0.0 109.549 178.722 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.644 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 1.8 p90 -160.38 139.16 10.43 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.198 -0.939 . . . . 0.0 109.606 -178.755 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.494 ' O ' ' HD3' ' A' ' 62' ' ' LYS . 50.1 p -104.64 120.14 40.63 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.11 -0.994 . . . . 0.0 109.341 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 6.9 m -79.33 -166.64 0.99 Allowed 'General case' 0 C--N 1.303 -1.419 0 O-C-N 120.663 -1.273 . . . . 0.0 108.82 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.467 ' HB ' ' HB2' ' A' ' 60' ' ' HIS . 4.7 m -160.37 159.3 30.97 Favored 'General case' 0 C--N 1.288 -2.084 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.55 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 87.2 m -125.65 123.04 38.1 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.026 -1.046 . . . . 0.0 109.484 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.835 ' HB3' ' CD1' ' A' ' 76' ' ' PHE . . . -50.34 -176.15 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.073 -1.017 . . . . 0.0 110.757 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -81.03 102.11 9.98 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-O 123.067 1.413 . . . . 0.0 107.869 178.344 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLY . . . . . 0.495 ' HA2' ' OG1' ' A' ' 85' ' ' THR . . . 117.37 21.21 4.47 Favored Glycine 0 C--N 1.267 -3.283 0 N-CA-C 108.583 -1.807 . . . . 0.0 108.583 -178.653 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.835 ' CD1' ' HB3' ' A' ' 73' ' ' ALA . 8.3 m-85 -119.8 157.32 28.88 Favored 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.632 -0.922 . . . . 0.0 110.156 -177.793 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.553 ' HG2' ' N ' ' A' ' 85' ' ' THR . 0.6 OUTLIER -160.17 163.03 33.98 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.048 -1.032 . . . . 0.0 110.955 -179.25 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 109.84 166.03 19.83 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.352 -1.499 . . . . 0.0 109.352 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.64 -34.82 69.74 Favored 'General case' 0 C--N 1.306 -1.313 0 O-C-N 121.155 -1.203 . . . . 0.0 109.12 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.487 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.7 OUTLIER -121.84 27.07 8.32 Favored 'General case' 0 C--N 1.291 -1.962 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 179.363 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 81' ' ' CYS . . . . . 0.513 ' HA ' ' O ' ' A' ' 77' ' ' GLU . 7.1 m 65.99 10.63 7.13 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.23 -0.919 . . . . 0.0 109.198 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.542 ' HB3' ' CE1' ' A' ' 83' ' ' PHE . 28.5 tt0 -32.78 -43.03 0.09 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.868 -0.52 . . . . 0.0 111.821 -179.499 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.562 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -99.6 -160.3 0.79 Allowed 'General case' 0 C--N 1.296 -1.742 0 CA-C-O 122.864 1.316 . . . . 0.0 109.738 -179.043 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.522 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 1.0 OUTLIER -148.43 123.02 9.8 Favored 'General case' 0 C--N 1.278 -2.53 0 CA-C-N 114.314 -1.312 . . . . 0.0 109.051 179.603 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.553 ' N ' ' HG2' ' A' ' 77' ' ' GLU . 14.2 p -69.38 -16.23 63.47 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.205 -0.934 . . . . 0.0 109.656 -179.56 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.406 ' OXT' ' O ' ' A' ' 85' ' ' THR . 1.5 mtt180 . . . . . 0 C--N 1.295 -1.798 0 CA-C-O 118.03 -0.986 . . . . 0.0 109.588 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.548 ' HA ' ' HB3' ' A' ' 22' ' ' CYS . 1.6 t . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 121.717 0.77 . . . . 0.0 109.52 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.74 HD21 ' HB2' ' A' ' 48' ' ' ASP . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 O-C-N 120.526 -1.359 . . . . 0.0 110.197 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.475 0 CA-C-O 120.71 0.29 . . . . 0.0 110.804 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.548 ' HB3' ' HA ' ' A' ' 17' ' ' CYS . 11.9 p -139.68 -150.62 0.33 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.704 -1.247 . . . . 0.0 110.803 -179.64 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.913 ' O ' HD22 ' A' ' 24' ' ' LEU . 47.1 t -166.52 -70.5 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.646 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.913 HD22 ' O ' ' A' ' 23' ' ' SER . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.544 0 O-C-N 121.276 -0.89 . . . . 0.0 109.726 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.595 ' O ' ' CE1' ' A' ' 31' ' ' PHE . . . . . . . . 0 N--CA 1.492 1.668 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.683 HH22 HD12 ' A' ' 24' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.907 0 O-C-N 120.59 -1.318 . . . . 0.0 110.396 179.569 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 58.8 t . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 120.703 0.287 . . . . 0.0 110.833 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.595 ' CE1' ' O ' ' A' ' 27' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.874 0 O-C-N 120.713 -1.242 . . . . 0.0 112.233 -178.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.828 ' O ' HG23 ' A' ' 37' ' ' THR . 51.3 p-10 . . . . . 0 N--CA 1.476 0.829 0 CA-C-O 121.759 0.79 . . . . 0.0 111.795 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.563 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 N--CA 1.489 1.479 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 178.143 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.647 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 81.1 mt-30 . . . . . 0 C--O 1.203 -1.393 0 N-CA-C 108.299 -1.001 . . . . 0.0 108.299 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.828 HG23 ' O ' ' A' ' 33' ' ' ASP . 1.0 OUTLIER -42.26 -57.46 2.54 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.292 -1.505 . . . . 0.0 107.774 179.061 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.441 ' O ' ' N ' ' A' ' 41' ' ' TRP . 1.9 t70 . . . . . 0 N--CA 1.494 1.743 0 O-C-N 120.875 -1.141 . . . . 0.0 108.666 176.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.647 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 14.2 t80 . . . . . 0 N--CA 1.488 1.454 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.676 ' CD1' ' O ' ' A' ' 37' ' ' THR . 7.7 m95 -77.64 -66.0 0.89 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.563 -0.71 . . . . 0.0 112.648 -178.58 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.496 ' OG ' ' N ' ' A' ' 43' ' ' LYS . 0.1 OUTLIER -42.55 -73.4 0.05 OUTLIER 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.738 -1.226 . . . . 0.0 112.223 -177.344 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.602 ' HD2' HG23 ' A' ' 65' ' ' ILE . 0.0 OUTLIER -81.32 35.9 0.4 Allowed 'General case' 0 C--N 1.286 -2.162 0 O-C-N 121.544 -0.723 . . . . 0.0 109.814 -178.874 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.578 ' CE1' ' OD1' ' A' ' 48' ' ' ASP . 0.6 OUTLIER -80.03 12.9 2.5 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.135 -0.978 . . . . 0.0 110.695 -179.709 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 4.6 mttm -86.77 55.01 3.37 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 120.964 -1.085 . . . . 0.0 108.377 179.107 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -131.64 4.5 4.25 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.501 -0.749 . . . . 0.0 110.128 -178.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.558 ' O ' ' CB ' ' A' ' 51' ' ' GLU . . . 72.49 29.23 66.21 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 108.606 -1.798 . . . . 0.0 108.606 -179.308 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.74 ' HB2' HD21 ' A' ' 18' ' ' LEU . 0.0 OUTLIER 46.58 21.57 0.14 Allowed 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.482 -1.01 . . . . 0.0 110.329 -179.868 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.639 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 33.2 mm-40 59.06 -92.29 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.453 0 O-C-N 120.973 -1.079 . . . . 0.0 111.157 178.036 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' CYS . . . . . 0.499 ' O ' ' HD3' ' A' ' 54' ' ' PRO . 36.5 t -45.87 -25.64 0.56 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.183 -0.948 . . . . 0.0 110.862 -178.768 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.558 ' CB ' ' O ' ' A' ' 47' ' ' GLY . 20.1 tt0 -49.43 148.55 2.67 Favored 'General case' 0 N--CA 1.485 1.312 0 O-C-N 120.577 -1.327 . . . . 0.0 108.708 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.465 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . 90.8 -15.92 59.47 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 110.078 -1.209 . . . . 0.0 110.078 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.472 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 30.7 t60 65.03 64.26 1.06 Allowed Pre-proline 0 N--CA 1.493 1.72 0 O-C-N 121.144 -1.209 . . . . 0.0 109.599 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.499 ' HD3' ' O ' ' A' ' 50' ' ' CYS . 4.9 Cg_exo -61.19 -39.5 58.08 Favored 'Trans proline' 0 C--N 1.31 -1.5 0 C-N-CA 122.604 2.203 . . . . 0.0 110.604 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.464 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 1.8 m -71.51 173.05 8.48 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.381 -0.824 . . . . 0.0 109.304 -179.576 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.565 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.6 mt -146.6 -176.84 5.34 Favored 'General case' 0 N--CA 1.492 1.635 0 CA-C-O 122.231 1.015 . . . . 0.0 109.906 179.466 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.615 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 1.6 m120 45.84 61.33 2.7 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.513 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.447 ' NE2' ' HZ ' ' A' ' 76' ' ' PHE . 4.2 mt-30 46.54 33.36 1.96 Allowed 'General case' 0 C--N 1.299 -1.591 0 C-N-CA 119.468 -0.893 . . . . 0.0 109.384 177.828 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -73.93 145.71 35.53 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.669 -1.373 . . . . 0.0 109.669 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.468 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 1.3 t60 -79.91 115.8 19.7 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.208 -1.172 . . . . 0.0 109.021 179.701 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.464 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 44.5 t -91.92 134.37 34.85 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.102 -0.999 . . . . 0.0 110.092 -179.438 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.508 ' HB2' ' O ' ' A' ' 69' ' ' THR . 2.1 tttp . . . . . 0 N--CA 1.486 1.342 0 N-CA-C 106.919 -1.511 . . . . 0.0 106.919 178.237 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.513 ' O ' ' O ' ' A' ' 67' ' ' ASP . . . . . . . . 0 N--CA 1.488 2.161 0 N-CA-C 107.71 -2.156 . . . . 0.0 107.71 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.602 HG23 ' HD2' ' A' ' 43' ' ' LYS . 0.4 OUTLIER -53.31 -61.98 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 O-C-N 120.461 -1.611 . . . . 0.0 109.216 -179.088 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.58 ' N ' HG22 ' A' ' 65' ' ' ILE . . . -43.68 -38.46 4.26 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 110.029 -1.228 . . . . 0.0 110.029 -179.469 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.523 ' OD1' ' N ' ' A' ' 68' ' ' TYR . 1.6 p30 179.29 -157.16 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.255 -1.144 . . . . 0.0 110.094 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.647 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 3.1 p90 -150.66 124.84 9.39 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.121 -0.987 . . . . 0.0 108.919 -178.82 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.508 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 70.3 p -95.34 119.33 33.67 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 120.898 -1.126 . . . . 0.0 109.201 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 9.5 m -79.11 -171.46 2.67 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.664 -1.273 . . . . 0.0 108.382 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.468 ' HB ' ' HB3' ' A' ' 60' ' ' HIS . 5.1 m -161.19 145.1 13.21 Favored 'General case' 0 C--N 1.285 -2.198 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 179.801 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.5 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 73.8 m -109.06 118.34 36.53 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.176 -0.953 . . . . 0.0 108.974 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.908 ' HB3' ' CD1' ' A' ' 76' ' ' PHE . . . -47.89 -178.02 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.066 -1.021 . . . . 0.0 110.42 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -80.51 100.67 8.67 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-O 123.2 1.476 . . . . 0.0 108.065 178.63 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLY . . . . . 0.46 ' O ' ' OG1' ' A' ' 85' ' ' THR . . . 119.17 18.5 4.58 Favored Glycine 0 C--N 1.269 -3.148 0 CA-C-N 113.575 -1.648 . . . . 0.0 108.994 -179.208 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.908 ' CD1' ' HB3' ' A' ' 73' ' ' ALA . 4.8 m-85 -115.58 160.07 20.46 Favored 'General case' 0 C--N 1.294 -1.813 0 O-C-N 121.372 -1.076 . . . . 0.0 109.726 -178.373 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.647 ' OE2' HG22 ' A' ' 85' ' ' THR . 19.3 pt-20 -160.72 167.26 27.26 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.158 -0.964 . . . . 0.0 110.304 -179.332 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 108.28 166.68 21.22 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 110.105 -1.198 . . . . 0.0 110.105 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.39 -47.49 72.66 Favored 'General case' 0 C--N 1.307 -1.251 0 O-C-N 121.371 -1.076 . . . . 0.0 109.638 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.565 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 2.9 m-20 -111.79 32.57 5.36 Favored 'General case' 0 C--N 1.287 -2.129 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 179.272 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' CYS . . . . . 0.492 ' O ' ' HB2' ' A' ' 57' ' ' ASN . 3.3 m 52.27 67.82 0.92 Allowed 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 105.67 -1.974 . . . . 0.0 105.67 -177.215 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.433 ' C ' ' OD1' ' A' ' 57' ' ' ASN . 37.9 tt0 -103.52 -25.2 13.31 Favored 'General case' 0 C--N 1.306 -1.29 0 O-C-N 121.589 -0.694 . . . . 0.0 111.067 -176.558 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.632 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -99.53 74.84 1.91 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.898 -1.126 . . . . 0.0 109.212 -179.827 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.444 ' C ' ' O ' ' A' ' 83' ' ' PHE . 0.3 OUTLIER -43.66 94.97 0.01 OUTLIER 'General case' 0 C--N 1.293 -1.862 0 C-N-CA 119.697 -0.801 . . . . 0.0 109.521 -179.82 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.647 HG22 ' OE2' ' A' ' 77' ' ' GLU . 5.8 p -68.38 -11.69 59.98 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.339 -0.851 . . . . 0.0 109.822 -179.639 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.439 ' OXT' ' O ' ' A' ' 85' ' ' THR . 3.5 mtp180 . . . . . 0 C--N 1.299 -1.605 0 CA-C-O 118.034 -0.984 . . . . 0.0 109.936 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.515 ' O ' ' HB2' ' A' ' 22' ' ' CYS . 0.6 OUTLIER . . . . . 0 N--CA 1.489 1.514 0 N-CA-C 108.091 -1.078 . . . . 0.0 108.091 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.525 ' CD1' ' OH ' ' A' ' 44' ' ' TYR . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.568 0 O-C-N 121.873 -0.517 . . . . 0.0 110.011 -179.713 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.414 ' O ' ' HA ' ' A' ' 17' ' ' CYS . . . . . . . . 0 N--CA 1.488 1.472 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.826 ' SG ' ' HB2' ' A' ' 27' ' ' ALA . 1.7 t -130.67 173.24 11.1 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.397 -0.814 . . . . 0.0 109.379 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.525 ' O ' ' CB ' ' A' ' 24' ' ' LEU . 30.4 t -135.91 -0.74 2.52 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.217 -0.927 . . . . 0.0 109.934 179.581 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.525 ' CB ' ' O ' ' A' ' 23' ' ' SER . 0.1 OUTLIER . . . . . 0 N--CA 1.495 1.811 0 O-C-N 121.212 -0.93 . . . . 0.0 110.465 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.826 ' HB2' ' SG ' ' A' ' 22' ' ' CYS . . . . . . . . 0 N--CA 1.494 1.735 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.489 1.479 0 CA-C-O 122.19 0.995 . . . . 0.0 110.394 -179.651 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.3 t . . . . . 0 N--CA 1.492 1.667 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.584 ' CE2' ' CE2' ' A' ' 40' ' ' PHE . 1.9 m-85 . . . . . 0 N--CA 1.488 1.45 0 O-C-N 120.885 -1.134 . . . . 0.0 109.831 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.596 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 22.6 m-20 . . . . . 0 N--CA 1.482 1.164 0 CA-C-O 121.255 0.55 . . . . 0.0 110.69 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.52 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 N--CA 1.487 1.375 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 178.611 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.661 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 5.8 mm100 . . . . . 0 C--O 1.203 -1.376 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.614 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -41.55 -60.09 1.42 Allowed 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.164 -1.585 . . . . 0.0 107.926 179.056 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.432 ' O ' ' N ' ' A' ' 41' ' ' TRP . 1.8 t70 . . . . . 0 N--CA 1.494 1.731 0 O-C-N 121.337 -0.852 . . . . 0.0 109.263 177.581 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.661 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 20.6 t80 . . . . . 0 N--CA 1.489 1.521 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.614 ' CD1' ' O ' ' A' ' 37' ' ' THR . 9.5 m95 -80.94 -71.85 0.45 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.778 -0.576 . . . . 0.0 112.101 -179.176 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.52 ' OG ' ' N ' ' A' ' 43' ' ' LYS . 1.1 p -53.77 -60.34 3.45 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.435 -1.416 . . . . 0.0 110.711 -178.113 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.52 ' N ' ' OG ' ' A' ' 42' ' ' SER . 0.3 OUTLIER -62.38 -13.71 32.21 Favored 'General case' 0 C--N 1.284 -2.246 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 -179.738 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.707 ' O ' ' N ' ' A' ' 46' ' ' ASP . 0.9 OUTLIER -43.23 -65.72 0.46 Allowed 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.31 -0.869 . . . . 0.0 109.0 -179.769 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.543 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.2 OUTLIER -15.58 73.34 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.719 0 CA-C-O 121.203 0.525 . . . . 0.0 111.272 -179.938 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.707 ' N ' ' O ' ' A' ' 44' ' ' TYR . 2.6 t0 -161.71 -30.26 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.215 -0.928 . . . . 0.0 110.414 -178.602 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.491 ' O ' ' OD2' ' A' ' 48' ' ' ASP . . . 105.34 16.15 17.19 Favored Glycine 0 N--CA 1.486 1.999 0 N-CA-C 108.15 -1.98 . . . . 0.0 108.15 -178.199 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.658 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER 72.21 9.23 5.93 Favored 'General case' 0 N--CA 1.504 2.244 0 O-C-N 121.777 -0.837 . . . . 0.0 109.988 -179.704 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.658 ' HB2' ' O ' ' A' ' 48' ' ' ASP . 32.5 mm-40 79.42 -25.13 0.19 Allowed 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.77 -0.581 . . . . 0.0 111.807 178.609 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 19.2 t -111.8 -14.49 13.55 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.676 -1.265 . . . . 0.0 110.349 -179.529 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.487 ' CB ' ' O ' ' A' ' 47' ' ' GLY . 13.9 tt0 -54.98 -20.39 9.0 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 120.943 -1.098 . . . . 0.0 111.514 -179.34 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.415 ' O ' ' C ' ' A' ' 53' ' ' HIS . . . -95.94 21.74 43.31 Favored Glycine 0 N--CA 1.497 2.708 0 O-C-N 120.701 -1.25 . . . . 0.0 111.244 -178.518 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.582 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 13.2 t60 42.94 54.66 10.27 Favored Pre-proline 0 N--CA 1.493 1.717 0 O-C-N 120.956 -1.32 . . . . 0.0 109.721 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.582 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 6.3 Cg_exo -57.89 -39.43 86.71 Favored 'Trans proline' 0 C--N 1.309 -1.542 0 C-N-CA 122.537 2.158 . . . . 0.0 111.846 -179.633 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.464 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 1.0 OUTLIER -83.84 158.84 21.52 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.083 -1.011 . . . . 0.0 110.348 -178.405 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.531 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.4 mt -144.69 -172.84 3.9 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.434 -0.791 . . . . 0.0 109.516 -179.83 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.646 ' HB3' ' CD2' ' A' ' 76' ' ' PHE . 8.1 m-80 46.78 58.81 4.38 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-O 121.827 0.822 . . . . 0.0 110.363 178.662 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.566 ' OE1' ' CZ ' ' A' ' 76' ' ' PHE . 8.4 mt-30 52.64 30.16 8.31 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-O 121.489 0.662 . . . . 0.0 109.54 177.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.438 ' HA2' ' O ' ' A' ' 71' ' ' THR . . . -82.31 141.32 21.29 Favored Glycine 0 N--CA 1.489 2.217 0 N-CA-C 109.728 -1.349 . . . . 0.0 109.728 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -79.39 149.71 31.57 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.193 -1.18 . . . . 0.0 108.036 179.137 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.464 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 41.0 t -119.55 113.79 21.26 Favored 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 119.027 -1.069 . . . . 0.0 111.254 -178.529 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.429 ' HB3' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.299 -1.589 0 N-CA-C 105.454 -2.054 . . . . 0.0 105.454 176.595 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.503 ' O ' ' O ' ' A' ' 67' ' ' ASP . . . . . . . . 0 N--CA 1.488 2.142 0 N-CA-C 107.438 -2.265 . . . . 0.0 107.438 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.595 HG22 ' N ' ' A' ' 66' ' ' GLY . 0.0 OUTLIER -45.53 -56.21 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 120.662 -1.493 . . . . 0.0 109.132 -178.826 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.595 ' N ' HG22 ' A' ' 65' ' ' ILE . . . -44.04 -43.58 7.09 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.503 ' O ' ' O ' ' A' ' 64' ' ' GLY . 2.1 p-10 178.44 -154.87 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.408 -1.054 . . . . 0.0 109.686 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.648 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 1.9 p90 -144.82 157.73 44.06 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 120.859 -1.151 . . . . 0.0 109.962 -179.211 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.429 ' OG1' ' HB3' ' A' ' 62' ' ' LYS . 73.7 p -122.52 115.15 21.69 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.429 -0.795 . . . . 0.0 109.181 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 65.8 m -84.63 -167.61 1.87 Allowed 'General case' 0 C--N 1.298 -1.643 0 O-C-N 120.889 -1.132 . . . . 0.0 108.937 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.438 ' O ' ' HA2' ' A' ' 59' ' ' GLY . 1.3 m -160.85 120.93 2.74 Favored 'General case' 0 C--N 1.29 -2.011 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.442 ' O ' ' O ' ' A' ' 73' ' ' ALA . 91.4 m -89.56 115.88 27.29 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.126 -0.983 . . . . 0.0 109.437 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.442 ' O ' ' O ' ' A' ' 72' ' ' CYS . . . -49.51 -179.42 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.481 0 O-C-N 120.915 -1.116 . . . . 0.0 110.162 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -81.03 101.3 9.47 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-O 122.97 1.367 . . . . 0.0 107.799 178.407 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLY . . . . . 0.583 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 130.99 5.11 3.97 Favored Glycine 0 C--N 1.269 -3.149 0 CA-C-N 114.003 -1.453 . . . . 0.0 110.003 -179.315 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.646 ' CD2' ' HB3' ' A' ' 57' ' ' ASN . 45.4 m-85 -133.45 154.16 51.02 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.111 -1.229 . . . . 0.0 110.606 -177.941 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.467 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 0.0 OUTLIER -155.92 168.22 27.91 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.247 -0.908 . . . . 0.0 110.206 -179.233 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 116.79 171.99 16.11 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 109.452 -1.459 . . . . 0.0 109.452 179.882 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.469 ' C ' ' HD3' ' A' ' 79' ' ' LYS . 0.4 OUTLIER -50.98 -56.26 13.32 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.152 -1.205 . . . . 0.0 108.65 179.687 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.531 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 1.3 m-20 -108.39 26.87 9.95 Favored 'General case' 0 C--N 1.287 -2.122 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.941 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' CYS . . . . . 0.538 ' O ' ' ND2' ' A' ' 57' ' ' ASN . 4.1 m 63.87 14.63 8.49 Favored 'General case' 0 C--N 1.305 -1.342 0 O-C-N 121.083 -1.01 . . . . 0.0 108.372 -178.998 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 36.8 tt0 -38.24 -25.5 0.01 OUTLIER 'General case' 0 C--N 1.309 -1.179 0 O-C-N 121.861 -0.525 . . . . 0.0 111.71 -179.53 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.551 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.4 OUTLIER -97.43 -161.44 0.87 Allowed 'General case' 0 C--N 1.299 -1.599 0 CA-C-O 122.836 1.303 . . . . 0.0 109.597 -179.743 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.469 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 54.7 m -161.44 93.1 0.92 Allowed 'General case' 0 C--N 1.277 -2.555 0 CA-C-N 114.302 -1.317 . . . . 0.0 109.098 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.439 ' C ' ' HG3' ' A' ' 86' ' ' ARG . 82.7 p -51.92 -58.81 5.4 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.191 -0.943 . . . . 0.0 109.885 -179.519 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.444 ' O ' ' HA3' ' A' ' 75' ' ' GLY . 2.5 ppt_? . . . . . 0 C--N 1.285 -2.225 0 CA-C-O 117.997 -1.002 . . . . 0.0 109.445 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.71 ' HA ' ' HB3' ' A' ' 22' ' ' CYS . 44.6 t . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 122.227 1.013 . . . . 0.0 109.287 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.854 HD11 ' O ' ' A' ' 48' ' ' ASP . 0.1 OUTLIER . . . . . 0 C--N 1.298 -1.636 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.146 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.694 0 CA-C-O 120.827 0.346 . . . . 0.0 110.801 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.71 ' HB3' ' HA ' ' A' ' 17' ' ' CYS . 18.1 p -134.5 -163.59 1.39 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.842 -1.161 . . . . 0.0 110.491 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.427 ' O ' ' C ' ' A' ' 24' ' ' LEU . 84.4 p -170.62 137.8 1.38 Allowed 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 179.317 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.846 HD22 ' O ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.616 0 O-C-N 121.227 -0.92 . . . . 0.0 111.042 -179.278 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.702 ' HB3' ' CZ2' ' A' ' 41' ' ' TRP . . . . . . . . 0 N--CA 1.488 1.471 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.548 ' HG3' ' O ' ' A' ' 24' ' ' LEU . 4.1 mtp180 . . . . . 0 N--CA 1.491 1.578 0 O-C-N 121.252 -0.905 . . . . 0.0 110.801 -179.345 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.9 t . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.653 ' HZ ' ' HB1' ' A' ' 27' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.611 0 C-N-CA 119.138 -1.025 . . . . 0.0 110.014 178.265 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.595 ' HB2' ' CG ' ' A' ' 36' ' ' GLN . 4.8 m-20 . . . . . 0 N--CA 1.484 1.229 0 CA-C-O 121.561 0.696 . . . . 0.0 111.44 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.526 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 C--N 1.305 -1.364 0 N-CA-C 106.12 -1.808 . . . . 0.0 106.12 177.078 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.691 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.202 -1.417 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.604 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -41.89 -61.89 1.03 Allowed 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 117.548 -1.661 . . . . 0.0 106.969 178.698 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.554 ' O ' ' N ' ' A' ' 41' ' ' TRP . 0.4 OUTLIER . . . . . 0 N--CA 1.493 1.679 0 O-C-N 121.358 -0.839 . . . . 0.0 109.544 176.397 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.763 ' O ' ' HB2' ' A' ' 44' ' ' TYR . 21.0 t80 . . . . . 0 C--O 1.189 -2.103 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.702 ' CZ2' ' HB3' ' A' ' 27' ' ' ALA . 16.2 m95 -80.94 -66.06 0.93 Allowed 'General case' 0 C--N 1.294 -1.817 0 O-C-N 120.656 -1.278 . . . . 0.0 112.019 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.55 ' O ' ' CB ' ' A' ' 43' ' ' LYS . 0.6 OUTLIER -71.85 79.62 0.88 Allowed 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 122.334 1.064 . . . . 0.0 109.565 -178.81 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.55 ' CB ' ' O ' ' A' ' 42' ' ' SER . 0.0 OUTLIER 153.68 -26.69 0.0 OUTLIER 'General case' 0 C--N 1.283 -2.324 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 -179.46 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.976 ' HA ' HD11 ' A' ' 65' ' ' ILE . 22.1 t80 -80.38 -97.55 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 179.034 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.551 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.1 OUTLIER 35.84 33.41 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 -179.057 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.563 ' HB2' ' O ' ' A' ' 44' ' ' TYR . 7.4 t0 -134.21 -17.59 2.08 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.712 -176.308 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.524 ' HA2' ' CE1' ' A' ' 44' ' ' TYR . . . 45.06 60.88 3.75 Favored Glycine 0 N--CA 1.496 2.685 0 N-CA-C 106.328 -2.709 . . . . 0.0 106.328 -177.31 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.854 ' O ' HD11 ' A' ' 18' ' ' LEU . 13.0 t70 -129.18 -129.22 0.21 Allowed 'General case' 0 C--N 1.308 -1.228 0 O-C-N 121.445 -1.032 . . . . 0.0 111.434 -176.166 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.542 ' HG3' ' N ' ' A' ' 67' ' ' ASP . 0.1 OUTLIER 52.04 -86.0 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.425 -0.797 . . . . 0.0 111.343 -179.385 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 50' ' ' CYS . . . . . 0.502 ' HA ' ' CG ' ' A' ' 54' ' ' PRO . 46.1 t -101.33 12.63 37.1 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.948 -1.095 . . . . 0.0 111.221 -178.542 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -70.19 146.05 51.02 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 120.714 -1.241 . . . . 0.0 109.008 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 90.94 -1.85 78.62 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 110.107 -1.197 . . . . 0.0 110.107 179.594 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.43 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 10.2 t60 62.59 66.52 1.3 Allowed Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.114 -1.227 . . . . 0.0 109.411 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.502 ' CG ' ' HA ' ' A' ' 50' ' ' CYS . 3.0 Cg_exo -61.97 -52.93 2.4 Favored 'Trans proline' 0 C--N 1.309 -1.502 0 C-N-CA 122.42 2.08 . . . . 0.0 111.259 -179.666 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.491 ' SG ' ' CB ' ' A' ' 61' ' ' CYS . 1.8 m -65.76 160.72 22.35 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.093 -1.005 . . . . 0.0 109.178 -179.349 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.502 ' HA ' HD23 ' A' ' 56' ' ' LEU . 5.3 mt -145.21 -173.83 4.21 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.195 -0.941 . . . . 0.0 110.026 -179.573 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.658 ' HB3' ' CD2' ' A' ' 76' ' ' PHE . 2.4 m120 45.68 59.7 3.51 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-O 121.995 0.902 . . . . 0.0 110.281 178.819 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.443 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 2.2 mm-40 53.66 30.18 10.58 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-O 121.521 0.677 . . . . 0.0 109.709 177.678 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.498 ' HA2' ' O ' ' A' ' 71' ' ' THR . . . -81.58 131.13 10.17 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.435 -1.466 . . . . 0.0 109.435 179.752 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -79.63 123.48 27.67 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.116 -1.226 . . . . 0.0 109.019 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.491 ' CB ' ' SG ' ' A' ' 55' ' ' CYS . 39.0 t -91.96 148.98 21.79 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.383 -0.823 . . . . 0.0 110.397 -179.046 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 69' ' ' THR . 0.9 OUTLIER . . . . . 0 C--N 1.305 -1.369 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 178.446 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.556 ' O ' ' O ' ' A' ' 65' ' ' ILE . . . . . . . . 0 N--CA 1.488 2.106 0 N-CA-C 110.95 -0.86 . . . . 0.0 110.95 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.976 HD11 ' HA ' ' A' ' 44' ' ' TYR . 0.1 OUTLIER 54.97 143.34 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.258 -1.142 . . . . 0.0 109.975 179.776 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 85.07 -43.47 3.26 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 108.223 -1.951 . . . . 0.0 108.223 -178.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.542 ' N ' ' HG3' ' A' ' 49' ' ' GLN . 1.8 p-10 -176.15 -157.46 0.05 Allowed 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.488 -1.007 . . . . 0.0 109.162 178.51 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.704 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 4.0 p90 -160.71 125.46 3.69 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.303 -0.873 . . . . 0.0 108.759 -177.724 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.473 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 73.3 p -85.48 128.21 34.66 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 120.492 -1.38 . . . . 0.0 109.66 179.691 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 31.0 m -92.89 -170.91 2.56 Favored 'General case' 0 C--N 1.306 -1.287 0 O-C-N 120.972 -1.08 . . . . 0.0 108.422 179.37 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.498 ' O ' ' HA2' ' A' ' 59' ' ' GLY . 9.0 m -161.34 112.65 1.76 Allowed 'General case' 0 C--N 1.289 -2.06 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.571 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 99.6 m -79.74 121.19 25.03 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 120.96 -1.088 . . . . 0.0 108.766 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -52.05 175.34 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.403 0 O-C-N 120.937 -1.102 . . . . 0.0 109.732 -179.653 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -80.75 101.33 9.25 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-O 123.022 1.391 . . . . 0.0 107.788 178.731 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLY . . . . . 0.553 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 131.45 5.99 3.53 Favored Glycine 0 C--N 1.27 -3.126 0 CA-C-N 113.905 -1.498 . . . . 0.0 110.184 -179.374 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.658 ' CD2' ' HB3' ' A' ' 57' ' ' ASN . 27.1 m-85 -130.64 160.78 33.22 Favored 'General case' 0 C--N 1.299 -1.626 0 O-C-N 121.041 -1.27 . . . . 0.0 110.6 -178.238 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.482 ' C ' ' HA ' ' A' ' 81' ' ' CYS . 0.8 OUTLIER -159.44 169.23 24.37 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.119 -0.988 . . . . 0.0 110.494 -179.387 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 115.83 173.49 17.35 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 109.322 -1.511 . . . . 0.0 109.322 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.55 -57.47 7.02 Favored 'General case' 0 C--N 1.306 -1.301 0 O-C-N 121.088 -1.242 . . . . 0.0 109.018 179.76 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.488 ' O ' ' CB ' ' A' ' 81' ' ' CYS . 2.7 m-20 -108.51 23.94 13.78 Favored 'General case' 0 C--N 1.29 -2.013 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 178.762 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' CYS . . . . . 0.589 ' HB2' ' HB2' ' A' ' 57' ' ' ASN . 3.3 m 72.05 15.47 5.55 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.078 -1.014 . . . . 0.0 108.566 -179.451 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 34.8 tt0 -39.42 -25.13 0.02 OUTLIER 'General case' 0 C--N 1.308 -1.239 0 O-C-N 121.772 -0.58 . . . . 0.0 112.348 -179.266 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.52 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.4 OUTLIER -101.96 -161.84 0.88 Allowed 'General case' 0 C--N 1.299 -1.608 0 CA-C-O 122.91 1.338 . . . . 0.0 110.092 -179.079 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.505 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 8.0 m -156.36 99.07 1.89 Allowed 'General case' 0 C--N 1.278 -2.515 0 CA-C-N 114.13 -1.396 . . . . 0.0 109.069 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 77.9 p -58.29 -55.48 34.46 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.085 -1.009 . . . . 0.0 109.764 -179.623 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.517 ' HG2' ' HA2' ' A' ' 75' ' ' GLY . 0.0 OUTLIER . . . . . 0 C--N 1.285 -2.208 0 CA-C-O 117.984 -1.008 . . . . 0.0 109.411 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.775 ' HB3' ' C ' ' A' ' 21' ' ' ALA . 3.6 m . . . . . 0 N--CA 1.481 1.118 0 CA-C-O 123.024 1.392 . . . . 0.0 107.891 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.902 HD21 ' CG ' ' A' ' 48' ' ' ASP . 0.4 OUTLIER . . . . . 0 C--N 1.286 -2.176 0 CA-C-N 114.43 -1.259 . . . . 0.0 107.62 177.488 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.775 ' C ' ' HB3' ' A' ' 17' ' ' CYS . . . . . . . . 0 C--O 1.215 -0.761 0 CA-C-O 122.746 1.26 . . . . 0.0 108.698 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.483 ' C ' ' O ' ' A' ' 21' ' ' ALA . 17.0 p 20.14 -142.2 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 CA-C-N 113.342 -1.754 . . . . 0.0 112.397 177.599 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 32.2 t -127.21 58.47 1.45 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.849 -1.157 . . . . 0.0 111.168 -178.4 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.596 ' HA ' ' CH2' ' A' ' 41' ' ' TRP . 0.2 OUTLIER . . . . . 0 N--CA 1.493 1.688 0 O-C-N 121.234 -0.916 . . . . 0.0 111.229 178.372 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.61 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . . . . . . . . 0 N--CA 1.493 1.689 0 CA-C-O 121.011 0.434 . . . . 0.0 110.427 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.3 ptm180 . . . . . 0 N--CA 1.494 1.763 0 O-C-N 120.929 -1.107 . . . . 0.0 110.077 -179.305 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.482 HG12 ' O ' ' A' ' 27' ' ' ALA . 1.7 p . . . . . 0 N--CA 1.491 1.625 0 CA-C-O 120.932 0.396 . . . . 0.0 109.954 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.595 ' CE1' ' O ' ' A' ' 27' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.494 1.729 0 O-C-N 120.922 -1.111 . . . . 0.0 111.025 -179.854 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.592 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 0.8 OUTLIER . . . . . 0 N--CA 1.48 1.06 0 CA-C-O 121.472 0.653 . . . . 0.0 111.583 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.468 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 C--N 1.306 -1.296 0 N-CA-C 106.477 -1.675 . . . . 0.0 106.477 177.432 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.632 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 19.1 mt-30 . . . . . 0 C--O 1.205 -1.289 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.67 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -43.11 -59.35 2.08 Favored 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 117.709 -1.596 . . . . 0.0 107.317 178.502 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.481 ' O ' ' N ' ' A' ' 41' ' ' TRP . 1.0 OUTLIER . . . . . 0 N--CA 1.493 1.715 0 O-C-N 121.277 -0.89 . . . . 0.0 109.405 177.195 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.632 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 10.9 t80 . . . . . 0 N--CA 1.486 1.364 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.67 ' CD1' ' O ' ' A' ' 37' ' ' THR . 9.9 m95 -77.07 177.35 7.88 Favored 'General case' 0 C--N 1.306 -1.304 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 176.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' SER . . . . . 0.567 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 0.1 OUTLIER 62.65 110.97 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.345 0 O-C-N 120.506 -1.371 . . . . 0.0 108.625 -179.992 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.567 ' CG ' ' O ' ' A' ' 42' ' ' SER . 0.0 OUTLIER 84.59 -25.48 0.13 Allowed 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 -178.617 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.714 ' O ' ' N ' ' A' ' 46' ' ' ASP . 1.0 OUTLIER -40.6 -63.72 0.61 Allowed 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.545 -179.948 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.513 ' C ' ' O ' ' A' ' 44' ' ' TYR . 5.6 ptmt -20.84 74.35 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.557 0 CA-C-O 121.238 0.542 . . . . 0.0 111.185 -179.469 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.714 ' N ' ' O ' ' A' ' 44' ' ' TYR . 3.8 t70 -161.82 18.46 0.1 Allowed 'General case' 0 N--CA 1.486 1.341 0 O-C-N 121.238 -0.914 . . . . 0.0 109.709 -178.382 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.552 ' O ' HD11 ' A' ' 18' ' ' LEU . . . 67.35 11.44 59.31 Favored Glycine 0 N--CA 1.492 2.403 0 N-CA-C 107.906 -2.078 . . . . 0.0 107.906 -177.685 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.902 ' CG ' HD21 ' A' ' 18' ' ' LEU . 0.3 OUTLIER 71.61 5.89 5.53 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.612 -0.934 . . . . 0.0 109.785 -179.644 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.595 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 2.9 mm100 78.09 -18.38 0.51 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.312 -0.867 . . . . 0.0 111.255 178.254 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' CYS . . . . . 0.484 ' O ' ' HD3' ' A' ' 54' ' ' PRO . 0.1 OUTLIER -108.38 -18.27 13.79 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 120.756 -1.215 . . . . 0.0 110.157 -179.683 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.44 ' HG3' ' O ' ' A' ' 51' ' ' GLU . 1.9 tt0 -50.62 -20.07 1.1 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.173 -0.954 . . . . 0.0 111.238 -179.247 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.416 ' O ' ' C ' ' A' ' 53' ' ' HIS . . . -85.63 19.94 21.58 Favored Glycine 0 N--CA 1.495 2.585 0 O-C-N 120.813 -1.179 . . . . 0.0 110.867 -178.848 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.56 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 20.3 t-160 45.03 59.55 14.02 Favored Pre-proline 0 N--CA 1.492 1.647 0 O-C-N 120.892 -1.358 . . . . 0.0 109.086 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.56 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 5.5 Cg_exo -57.74 -53.11 4.88 Favored 'Trans proline' 0 C--N 1.309 -1.541 0 C-N-CA 122.658 2.239 . . . . 0.0 111.869 -179.568 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.559 ' SG ' ' CB ' ' A' ' 61' ' ' CYS . 3.6 m -60.32 175.41 0.43 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 120.836 -1.165 . . . . 0.0 110.046 -178.958 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.509 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 4.9 mt -148.87 -174.98 4.77 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-O 121.647 0.737 . . . . 0.0 109.121 179.198 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.634 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 22.5 m120 39.14 64.01 0.87 Allowed 'General case' 0 C--N 1.299 -1.591 0 CA-C-O 121.886 0.851 . . . . 0.0 109.662 -179.664 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.449 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 1.9 mm-40 51.75 35.74 16.02 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 121.667 0.746 . . . . 0.0 109.328 178.148 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -86.99 131.12 10.38 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.775 -1.33 . . . . 0.0 109.775 -179.76 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.484 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 88.9 m-70 -79.43 142.26 36.07 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.309 -1.112 . . . . 0.0 108.561 179.499 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.576 ' HA ' ' HA ' ' A' ' 70' ' ' CYS . 0.1 OUTLIER -116.13 127.23 54.66 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.075 -1.016 . . . . 0.0 110.137 -179.039 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.548 ' HB3' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.36 0 N-CA-C 106.595 -1.632 . . . . 0.0 106.595 177.569 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.523 0 N-CA-C 108.389 -1.884 . . . . 0.0 108.389 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.692 HG23 ' HA ' ' A' ' 44' ' ' TYR . 35.9 mm -86.68 -66.59 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 120.744 -1.444 . . . . 0.0 110.341 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.425 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . -61.19 -12.57 31.55 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 -179.544 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.496 ' HA ' HE21 ' A' ' 49' ' ' GLN . 1.5 p-10 -178.1 -157.3 0.04 OUTLIER 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.201 -1.176 . . . . 0.0 110.357 179.378 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.697 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 2.0 p90 -156.15 -160.37 1.0 Allowed 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -178.632 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.548 ' OG1' ' HB3' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -151.04 177.67 9.94 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 177.955 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 70' ' ' CYS . . . . . 0.576 ' HA ' ' HA ' ' A' ' 61' ' ' CYS . 1.3 m -137.09 -174.47 3.75 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 120.674 -1.266 . . . . 0.0 109.4 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.484 ' HB ' ' HB2' ' A' ' 60' ' ' HIS . 0.7 OUTLIER -161.09 123.63 3.14 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 179.362 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.513 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 84.7 m -97.84 140.34 32.36 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.93 -1.106 . . . . 0.0 109.571 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.851 ' HB3' ' CE1' ' A' ' 76' ' ' PHE . . . -73.76 -176.39 2.39 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.073 -1.017 . . . . 0.0 110.659 -179.621 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -81.45 102.31 10.45 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-O 123.119 1.438 . . . . 0.0 108.265 178.362 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLY . . . . . 0.464 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 123.31 17.57 3.24 Favored Glycine 0 C--N 1.268 -3.238 0 CA-C-N 113.765 -1.561 . . . . 0.0 109.459 -179.332 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.851 ' CE1' ' HB3' ' A' ' 73' ' ' ALA . 4.8 m-85 -119.92 167.79 11.79 Favored 'General case' 0 C--N 1.294 -1.805 0 O-C-N 121.44 -1.035 . . . . 0.0 109.578 -178.316 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.51 ' CB ' ' HB2' ' A' ' 83' ' ' PHE . 3.7 mt-10 -160.41 171.01 19.83 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.038 -1.039 . . . . 0.0 110.355 -179.658 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.33 169.01 40.41 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 179.573 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.441 ' C ' ' HD3' ' A' ' 79' ' ' LYS . 1.0 OUTLIER -57.89 -55.81 30.1 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.303 -1.116 . . . . 0.0 109.318 179.897 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.509 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.2 OUTLIER -95.56 25.46 4.5 Favored 'General case' 0 C--N 1.287 -2.119 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.585 179.999 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 81' ' ' CYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 77' ' ' GLU . 6.6 m 69.7 11.6 7.9 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.84 -1.163 . . . . 0.0 109.021 -179.619 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -42.06 -47.4 4.49 Favored 'General case' 0 N--CA 1.489 1.517 0 CA-C-O 121.446 0.641 . . . . 0.0 111.39 -179.71 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.619 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.6 OUTLIER -79.77 84.63 5.54 Favored 'General case' 0 C--N 1.295 -1.794 0 O-C-N 121.223 -0.923 . . . . 0.0 110.66 -178.328 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.598 ' HB3' ' ND2' ' A' ' 57' ' ' ASN . 3.9 p -67.42 94.5 0.4 Allowed 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.583 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.457 ' H ' HG23 ' A' ' 85' ' ' THR . 18.5 p -54.92 -21.38 11.44 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.172 -0.955 . . . . 0.0 109.924 -179.041 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.417 ' HD2' ' HA3' ' A' ' 75' ' ' GLY . 14.4 ptm180 . . . . . 0 C--N 1.289 -2.044 0 CA-C-O 118.033 -0.985 . . . . 0.0 109.556 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.81 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 28.2 m . . . . . 0 N--CA 1.493 1.697 0 CA-C-O 120.499 0.19 . . . . 0.0 111.199 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.423 ' C ' ' O ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.505 0 C-N-CA 118.641 -1.224 . . . . 0.0 108.061 179.252 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.81 ' HB3' ' HA ' ' A' ' 17' ' ' CYS . . . . . . . . 0 N--CA 1.496 1.865 0 CA-C-O 121.503 0.668 . . . . 0.0 110.07 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.504 ' HB2' ' HB3' ' A' ' 17' ' ' CYS . 1.4 m -149.57 168.59 23.11 Favored 'General case' 0 C--N 1.292 -1.909 0 O-C-N 121.549 -0.719 . . . . 0.0 109.178 178.892 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.548 ' O ' ' CB ' ' A' ' 24' ' ' LEU . 0.7 OUTLIER -85.29 31.62 0.57 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.158 -0.964 . . . . 0.0 110.502 -178.986 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.548 ' CB ' ' O ' ' A' ' 23' ' ' SER . 0.1 OUTLIER . . . . . 0 N--CA 1.495 1.809 0 O-C-N 121.409 -0.807 . . . . 0.0 110.31 179.665 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 121.311 0.577 . . . . 0.0 110.213 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.516 ' O ' ' CG ' ' A' ' 28' ' ' ARG . 26.3 ptt180 . . . . . 0 C--N 1.3 -1.577 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 178.416 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.1 t . . . . . 0 N--CA 1.485 1.292 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.693 ' CD1' ' N ' ' A' ' 31' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.304 -1.397 0 O-C-N 121.381 -0.825 . . . . 0.0 109.772 -179.695 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.64 ' HB2' ' CD2' ' A' ' 31' ' ' PHE . 0.9 OUTLIER . . . . . 0 N--CA 1.488 1.442 0 CA-C-O 121.379 0.609 . . . . 0.0 110.57 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.471 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 N--CA 1.486 1.361 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 179.172 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.68 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 65.8 mt-30 . . . . . 0 C--O 1.202 -1.41 0 N-CA-C 108.261 -1.015 . . . . 0.0 108.261 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.647 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -42.54 -59.3 1.94 Allowed 'General case' 0 N--CA 1.499 2.014 0 O-C-N 119.797 -1.814 . . . . 0.0 107.571 178.4 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ASP . . . . . 0.477 ' O ' ' O ' ' A' ' 41' ' ' TRP . 2.0 t70 . . . . . 0 N--CA 1.491 1.619 0 O-C-N 121.43 -0.794 . . . . 0.0 109.305 177.354 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.68 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 18.5 t80 . . . . . 0 N--CA 1.493 1.685 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.647 ' CD1' ' O ' ' A' ' 37' ' ' THR . 9.1 m95 -80.99 172.02 14.26 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.878 -0.514 . . . . 0.0 109.857 178.505 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 76.47 -59.8 0.49 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.532 -0.73 . . . . 0.0 112.254 177.632 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.74 11.05 39.43 Favored 'General case' 0 C--N 1.28 -2.432 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 178.489 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.607 ' O ' ' N ' ' A' ' 46' ' ' ASP . 0.8 OUTLIER -56.9 -76.22 0.04 OUTLIER 'General case' 0 C--N 1.307 -1.248 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 179.589 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.549 ' C ' ' O ' ' A' ' 44' ' ' TYR . 7.1 mttt 9.85 55.55 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.419 0 CA-C-O 121.172 0.511 . . . . 0.0 112.144 179.095 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.607 ' N ' ' O ' ' A' ' 44' ' ' TYR . 0.9 OUTLIER -156.35 8.55 0.22 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.131 -0.981 . . . . 0.0 110.056 -179.667 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.571 ' O ' ' CB ' ' A' ' 48' ' ' ASP . . . 86.03 -48.46 3.95 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 108.636 -1.785 . . . . 0.0 108.636 -179.147 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.571 ' CB ' ' O ' ' A' ' 47' ' ' GLY . 16.1 p-10 140.42 -10.04 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.247 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 179.561 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.594 ' NE2' ' O ' ' A' ' 65' ' ' ILE . 0.0 OUTLIER 77.78 -15.99 0.7 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.754 -0.591 . . . . 0.0 110.858 -179.547 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 50' ' ' CYS . . . . . 0.48 ' HB3' ' OD2' ' A' ' 48' ' ' ASP . 20.2 t -99.23 -21.09 16.26 Favored 'General case' 0 N--CA 1.487 1.403 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 176.97 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.489 ' HB2' ' OD1' ' A' ' 48' ' ' ASP . 21.9 tt0 -58.93 148.89 28.74 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 121.319 -0.863 . . . . 0.0 108.899 179.248 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.462 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . 102.2 -22.25 38.57 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 109.357 -1.497 . . . . 0.0 109.357 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.546 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 0.6 OUTLIER 68.8 58.24 0.64 Allowed Pre-proline 0 N--CA 1.49 1.56 0 O-C-N 121.456 -1.026 . . . . 0.0 109.847 -179.954 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.546 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 3.2 Cg_exo -57.05 -35.09 98.8 Favored 'Trans proline' 0 C--N 1.31 -1.494 0 C-N-CA 122.36 2.04 . . . . 0.0 110.317 179.327 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.538 ' O ' ' CE1' ' A' ' 53' ' ' HIS . 0.2 OUTLIER -75.28 164.2 26.69 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.576 -0.703 . . . . 0.0 109.197 -179.617 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.505 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.8 mt -145.0 -175.34 4.65 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.241 -0.912 . . . . 0.0 110.037 179.724 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.602 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 0.9 OUTLIER 42.59 63.63 1.38 Allowed 'General case' 0 C--N 1.299 -1.605 0 CA-C-O 121.931 0.872 . . . . 0.0 109.143 -179.965 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.433 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 2.2 mm100 51.61 32.66 9.45 Favored 'General case' 0 C--N 1.301 -1.532 0 C-N-CA 119.934 -0.706 . . . . 0.0 109.771 177.938 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -82.2 139.35 19.66 Favored Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.367 -1.493 . . . . 0.0 109.367 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -79.76 149.69 31.03 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.264 -1.139 . . . . 0.0 109.095 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.446 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 44.3 t -116.12 124.78 51.21 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.106 -0.996 . . . . 0.0 110.144 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.546 ' HB2' ' OG1' ' A' ' 69' ' ' THR . 80.5 mttt . . . . . 0 C--N 1.302 -1.482 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 177.882 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.651 ' O ' ' N ' ' A' ' 66' ' ' GLY . . . . . . . . 0 N--CA 1.492 2.385 0 N-CA-C 109.121 -1.592 . . . . 0.0 109.121 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.892 HD12 ' H ' ' A' ' 66' ' ' GLY . 0.6 OUTLIER 19.74 -71.01 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.511 2.611 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -178.726 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.892 ' H ' HD12 ' A' ' 65' ' ' ILE . . . -32.7 -36.33 0.04 OUTLIER Glycine 0 N--CA 1.502 3.05 0 N-CA-C 109.222 -1.551 . . . . 0.0 109.222 -179.295 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.556 ' HA ' ' OE1' ' A' ' 49' ' ' GLN . 3.1 p-10 175.84 -162.87 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 177.584 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.644 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 1.0 OUTLIER -131.18 -176.48 4.03 Favored 'General case' 0 C--N 1.291 -1.971 0 O-C-N 121.01 -1.056 . . . . 0.0 108.341 179.934 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.546 ' OG1' ' HB2' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -148.5 109.83 4.39 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 120.821 -1.174 . . . . 0.0 109.537 179.342 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 66.8 m -84.47 -174.15 5.12 Favored 'General case' 0 C--N 1.292 -1.904 0 CA-C-O 122.149 0.976 . . . . 0.0 109.608 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 10.3 m -161.35 144.21 12.41 Favored 'General case' 0 C--N 1.286 -2.195 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.31 179.785 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' CYS . . . . . 0.542 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 99.1 m -106.81 134.31 50.15 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.144 -0.973 . . . . 0.0 108.991 179.522 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.916 ' HB3' ' CE1' ' A' ' 76' ' ' PHE . . . -64.92 -175.12 0.17 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.943 -1.098 . . . . 0.0 111.076 -179.092 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -81.5 101.56 10.0 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-O 123.114 1.435 . . . . 0.0 108.307 178.452 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLY . . . . . 0.437 ' O ' ' OG1' ' A' ' 85' ' ' THR . . . 120.3 16.54 4.71 Favored Glycine 0 C--N 1.269 -3.192 0 N-CA-C 109.146 -1.581 . . . . 0.0 109.146 -179.23 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.916 ' CE1' ' HB3' ' A' ' 73' ' ' ALA . 4.2 m-85 -113.31 164.38 13.64 Favored 'General case' 0 C--N 1.293 -1.856 0 O-C-N 121.443 -1.034 . . . . 0.0 109.23 -178.434 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.487 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 0.0 OUTLIER -160.52 170.11 21.59 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.004 -1.06 . . . . 0.0 110.335 -179.372 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 97.2 173.36 34.19 Favored Glycine 0 N--CA 1.488 2.14 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 179.749 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.3 tmtt? -60.2 -57.8 11.24 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.343 -1.092 . . . . 0.0 109.234 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.505 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 1.0 OUTLIER -98.59 27.47 4.81 Favored 'General case' 0 C--N 1.287 -2.113 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 179.428 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 81' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 57' ' ' ASN . 4.6 m 71.71 7.83 6.0 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.99 -1.069 . . . . 0.0 109.422 -179.898 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.424 ' C ' ' O ' ' A' ' 81' ' ' CYS . 41.1 tt0 -36.34 -44.62 0.43 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.542 -0.724 . . . . 0.0 111.489 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.607 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.9 OUTLIER -80.47 86.82 5.73 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.269 -0.894 . . . . 0.0 110.424 -178.607 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.544 ' CB ' ' OD1' ' A' ' 57' ' ' ASN . 0.2 OUTLIER -74.66 92.2 2.42 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.416 -0.802 . . . . 0.0 109.164 179.345 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.437 ' OG1' ' O ' ' A' ' 75' ' ' GLY . 10.5 p -72.61 -14.4 61.6 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.22 -0.925 . . . . 0.0 109.694 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.466 ' HD3' ' CZ ' ' A' ' 76' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.78 0 CA-C-O 117.995 -1.002 . . . . 0.0 109.633 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.751 ' SG ' ' HB2' ' A' ' 27' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 124.013 1.863 . . . . 0.0 107.991 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.789 HD11 ' HB3' ' A' ' 48' ' ' ASP . 0.2 OUTLIER . . . . . 0 C--N 1.29 -1.987 0 O-C-N 120.857 -1.152 . . . . 0.0 109.319 178.868 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.44 0 CA-C-O 121.205 0.526 . . . . 0.0 109.766 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 22' ' ' CYS . . . . . 0.598 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 11.5 t -150.82 -47.67 0.12 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.334 -0.854 . . . . 0.0 110.341 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.558 ' O ' ' CB ' ' A' ' 24' ' ' LEU . 7.8 t 84.26 -2.46 1.03 Allowed 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 -178.827 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.558 ' CB ' ' O ' ' A' ' 23' ' ' SER . 0.4 OUTLIER . . . . . 0 N--CA 1.495 1.806 0 O-C-N 121.614 -0.679 . . . . 0.0 110.436 179.667 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.751 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . . . . . . . . 0 N--CA 1.493 1.703 0 CA-C-O 121.11 0.481 . . . . 0.0 109.814 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 . . . . . 0 N--CA 1.494 1.738 0 O-C-N 120.934 -1.104 . . . . 0.0 110.654 -179.27 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.464 ' O ' ' CG1' ' A' ' 30' ' ' VAL . 0.9 OUTLIER . . . . . 0 N--CA 1.495 1.824 0 CA-C-O 120.881 0.372 . . . . 0.0 110.125 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.59 ' CD1' ' O ' ' A' ' 27' ' ' ALA . 25.7 m-85 . . . . . 0 C--N 1.301 -1.535 0 O-C-N 120.893 -1.129 . . . . 0.0 111.055 -178.866 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.562 ' O ' HG23 ' A' ' 37' ' ' THR . 3.9 m-20 . . . . . 0 N--CA 1.482 1.157 0 CA-C-O 121.151 0.501 . . . . 0.0 110.325 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.521 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 N--CA 1.488 1.426 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 178.865 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.799 HE21 ' N ' ' A' ' 36' ' ' GLN . 1.6 mm-40 . . . . . 0 C--O 1.205 -1.278 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.671 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.2 OUTLIER -46.12 -59.0 3.14 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.259 -1.526 . . . . 0.0 107.797 178.952 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.0 t70 . . . . . 0 C--N 1.298 -1.665 0 O-C-N 121.17 -0.956 . . . . 0.0 109.91 178.733 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.639 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 6.4 t80 . . . . . 0 N--CA 1.485 1.325 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.671 ' CD1' ' O ' ' A' ' 37' ' ' THR . 6.8 m95 -80.35 -67.5 0.76 Allowed 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.452 -0.78 . . . . 0.0 112.304 -178.611 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -57.34 -50.08 74.08 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.516 -1.365 . . . . 0.0 110.356 -177.883 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LYS . . . . . 0.789 ' HD3' HG23 ' A' ' 65' ' ' ILE . 0.7 OUTLIER -81.87 2.14 31.75 Favored 'General case' 0 C--N 1.287 -2.136 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 179.624 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 44' ' ' TYR . . . . . 0.687 ' O ' ' N ' ' A' ' 46' ' ' ASP . 1.0 OUTLIER -46.43 -70.39 0.1 Allowed 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.379 -0.826 . . . . 0.0 109.182 -179.913 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.542 ' C ' ' O ' ' A' ' 44' ' ' TYR . 3.1 ptmt -9.75 69.05 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.647 0 CA-C-O 121.366 0.603 . . . . 0.0 111.797 -179.481 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.687 ' N ' ' O ' ' A' ' 44' ' ' TYR . 2.4 t0 -162.13 -30.44 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.4 -0.813 . . . . 0.0 110.077 -179.109 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.48 ' O ' ' OD2' ' A' ' 48' ' ' ASP . . . 98.61 13.97 39.23 Favored Glycine 0 N--CA 1.486 2.003 0 N-CA-C 107.83 -2.108 . . . . 0.0 107.83 -177.754 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.789 ' HB3' HD11 ' A' ' 18' ' ' LEU . 0.0 OUTLIER 74.6 11.35 3.94 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.784 -0.833 . . . . 0.0 109.358 -179.628 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.66 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 34.5 mm-40 73.85 -10.79 1.04 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.807 -0.558 . . . . 0.0 111.125 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 15.0 t -114.83 -11.45 12.24 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.665 -1.272 . . . . 0.0 110.088 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.471 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 53.5 tt0 -74.12 152.73 39.81 Favored 'General case' 0 N--CA 1.483 1.223 0 O-C-N 120.888 -1.132 . . . . 0.0 109.135 179.884 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.463 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . 94.27 -14.07 66.05 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' HIS . . . . . 0.463 ' HB3' ' O ' ' A' ' 52' ' ' GLY . 1.2 t60 68.42 69.6 0.44 Allowed Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.336 -1.096 . . . . 0.0 109.343 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' PRO . . . . . 0.45 ' HG2' ' SG ' ' A' ' 61' ' ' CYS . 5.7 Cg_exo -59.67 -39.83 70.35 Favored 'Trans proline' 0 C--N 1.31 -1.479 0 C-N-CA 122.45 2.1 . . . . 0.0 110.61 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.494 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 0.6 OUTLIER -84.77 177.89 7.85 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.338 -0.851 . . . . 0.0 109.302 -179.863 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.518 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.5 mt -140.08 -175.37 4.22 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 179.199 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ASN . . . . . 0.586 ' HB3' ' CD2' ' A' ' 76' ' ' PHE . 4.9 m-80 48.49 56.43 7.53 Favored 'General case' 0 C--N 1.296 -1.729 0 CA-C-O 121.718 0.771 . . . . 0.0 110.943 178.013 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 47.06 30.15 1.25 Allowed 'General case' 0 C--N 1.301 -1.507 0 CA-C-O 121.439 0.638 . . . . 0.0 109.873 177.455 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -79.08 150.92 34.49 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.198 -1.561 . . . . 0.0 109.198 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.518 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 3.1 t60 -79.64 156.47 27.6 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.98 -1.306 . . . . 0.0 108.772 179.585 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' CYS . . . . . 0.494 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 0.6 OUTLIER -124.56 116.98 23.32 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.18 -0.95 . . . . 0.0 109.948 -179.082 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.503 ' HB3' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.301 -1.523 0 N-CA-C 106.91 -1.515 . . . . 0.0 106.91 177.755 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLY . . . . . 0.574 ' O ' ' O ' ' A' ' 67' ' ' ASP . . . . . . . . 0 N--CA 1.493 2.479 0 N-CA-C 108.079 -2.008 . . . . 0.0 108.079 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ILE . . . . . 0.789 HG23 ' HD3' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -51.76 -61.94 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 119.881 -1.952 . . . . 0.0 109.316 -179.136 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.69 ' N ' HG22 ' A' ' 65' ' ' ILE . . . -43.19 -50.1 6.47 Favored Glycine 0 N--CA 1.493 2.482 0 N-CA-C 109.964 -1.254 . . . . 0.0 109.964 -179.34 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ASP . . . . . 0.574 ' O ' ' O ' ' A' ' 64' ' ' GLY . 6.4 p-10 -164.89 -147.8 0.1 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.41 -1.053 . . . . 0.0 109.278 179.71 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.66 ' CD1' ' HB3' ' A' ' 49' ' ' GLN . 2.5 p90 -159.8 -165.15 1.45 Allowed 'General case' 0 C--N 1.296 -1.751 0 O-C-N 120.501 -1.374 . . . . 0.0 109.352 -179.45 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.503 ' OG1' ' HB3' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -149.43 -177.48 5.88 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 107.324 -1.362 . . . . 0.0 107.324 178.989 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.7 m -139.61 -173.29 3.58 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 120.601 -1.312 . . . . 0.0 108.563 179.158 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.518 ' HB ' ' HB3' ' A' ' 60' ' ' HIS . 1.5 m -161.08 139.92 10.08 Favored 'General case' 0 C--N 1.292 -1.931 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 179.334 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 95.0 m -104.15 141.99 35.28 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.952 -1.093 . . . . 0.0 109.365 179.697 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.557 ' HB3' ' CD1' ' A' ' 76' ' ' PHE . . . -77.16 177.66 7.67 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.222 -0.924 . . . . 0.0 109.8 -179.756 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -80.56 102.34 9.71 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-O 123.399 1.571 . . . . 0.0 107.839 178.526 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLY . . . . . 0.632 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 127.27 25.58 1.17 Allowed Glycine 0 C--N 1.267 -3.302 0 CA-C-N 113.299 -1.773 . . . . 0.0 109.896 -179.556 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.632 ' CD1' ' C ' ' A' ' 75' ' ' GLY . 58.2 m-85 -141.37 159.88 41.28 Favored 'General case' 0 C--N 1.287 -2.115 0 O-C-N 121.174 -1.192 . . . . 0.0 110.05 -177.815 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLU . . . . . 0.503 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 2.5 mt-10 -150.36 175.21 12.04 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.172 -0.955 . . . . 0.0 110.239 -178.929 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 95.47 168.02 35.48 Favored Glycine 0 N--CA 1.491 2.327 0 N-CA-C 110.191 -1.164 . . . . 0.0 110.191 179.348 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.469 ' C ' ' HD3' ' A' ' 79' ' ' LYS . 4.6 tmtt? -55.86 -57.77 10.65 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.466 -1.02 . . . . 0.0 109.158 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ASN . . . . . 0.518 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 1.1 m-20 -94.43 25.86 3.69 Favored 'General case' 0 C--N 1.287 -2.113 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 179.418 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' CYS . . . . . 0.579 ' HB2' ' HB2' ' A' ' 57' ' ' ASN . 4.1 m 66.36 14.85 9.89 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 120.818 -1.176 . . . . 0.0 108.41 -179.211 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -46.53 -42.44 15.77 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.769 -0.582 . . . . 0.0 112.122 -179.284 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.607 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.8 OUTLIER -79.32 85.09 5.18 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.169 -0.957 . . . . 0.0 111.135 -178.035 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 84' ' ' SER . . . . . 0.546 ' CB ' ' OD1' ' A' ' 57' ' ' ASN . 0.4 OUTLIER -68.64 109.27 3.7 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 178.232 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.46 ' O ' ' C ' ' A' ' 86' ' ' ARG . 33.3 p -92.02 -32.91 15.03 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.997 -1.064 . . . . 0.0 109.807 -179.334 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ARG . . . . . 0.46 ' C ' ' O ' ' A' ' 85' ' ' THR . 0.1 OUTLIER . . . . . 0 C--N 1.289 -2.05 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.202 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.427 ' O ' ' OG ' ' A' ' 3' ' ' SER . 40.6 m-20 -108.8 115.07 29.38 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.223 -0.923 . . . . 0.0 109.384 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.427 ' OG ' ' O ' ' A' ' 2' ' ' ASN . 2.2 m -167.06 -135.35 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.258 -0.901 . . . . 0.0 109.458 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.681 ' CE2' HD12 ' A' ' 5' ' ' LEU . 50.3 p90 -55.52 -16.92 4.39 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.927 -1.108 . . . . 0.0 109.49 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.681 HD12 ' CE2' ' A' ' 4' ' ' PHE . 0.0 OUTLIER -76.56 -42.09 44.1 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.187 -0.946 . . . . 0.0 109.791 -179.912 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' CGU . . . . . 0.528 ' C ' ' O ' ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' CGU . . . . . 0.664 ' H ' ' C ' ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.835 HG11 OE11 ' A' ' 26' ' ' CGU . 20.6 m -39.93 96.06 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.307 -1.255 0 CA-C-O 122.166 0.984 . . . . 0.0 109.895 -178.587 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.513 ' N ' ' O ' ' A' ' 7' ' ' CGU . 1.0 OUTLIER -44.73 -28.37 0.61 Allowed 'General case' 0 C--N 1.284 -2.257 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 179.123 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.5 ' HB2' ' O ' ' A' ' 9' ' ' LYS . 0.3 OUTLIER 168.03 130.98 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 179.441 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -108.39 122.4 6.65 Favored Glycine 0 N--CA 1.491 2.348 0 C-N-CA 119.84 -1.171 . . . . 0.0 110.186 -179.441 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.579 ' HB3' ' CB ' ' A' ' 16' ' ' CGU . 15.7 t30 -109.93 -172.63 2.08 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.225 -1.162 . . . . 0.0 108.847 179.469 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.684 ' N ' HD23 ' A' ' 13' ' ' LEU . 0.9 OUTLIER -77.18 -125.69 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.211 0 O-C-N 120.836 -1.165 . . . . 0.0 109.4 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 14' ' ' CGU . . . . . 0.731 ' O ' HD12 ' A' ' 18' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 65.7 mtm180 -76.73 -45.62 28.57 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.108 -0.995 . . . . 0.0 110.229 -179.17 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' CGU . . . . . 0.589 ' CD1' ' C ' ' A' ' 16' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.864 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 84.9 m -84.56 42.51 0.91 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.103 -0.998 . . . . 0.0 109.758 -179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.801 HD11 ' CG ' ' A' ' 48' ' ' ASP . 0.2 OUTLIER -81.75 -19.07 42.13 Favored 'General case' 0 C--N 1.299 -1.622 0 CA-C-O 121.795 0.807 . . . . 0.0 110.018 -179.677 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 20' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.864 ' HB3' ' HA ' ' A' ' 17' ' ' CYS . . . -48.82 -54.11 16.51 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 179.207 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.49 ' HB3' ' HB2' ' A' ' 26' ' ' CGU . 0.5 OUTLIER -151.98 -170.35 3.62 Favored 'General case' 0 C--N 1.289 -2.024 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.936 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 35.5 p -175.96 -35.27 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.771 ' O ' HD13 ' A' ' 24' ' ' LEU . 0.4 OUTLIER -165.21 -36.99 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 179.591 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' CGU . . . . . 0.514 ' O ' ' HG2' ' A' ' 28' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' CGU . . . . . 0.835 OE11 HG11 ' A' ' 8' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.31 55.18 2.79 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.977 -1.077 . . . . 0.0 110.602 -179.3 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.581 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 24.6 ptt180 -153.21 121.44 6.21 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 106.634 -1.617 . . . . 0.0 106.634 177.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' CGU . . . . . 0.533 ' CB ' ' O ' ' A' ' 28' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.4 t -78.96 -22.28 12.76 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 179.074 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.7 ' CD1' ' N ' ' A' ' 31' ' ' PHE . 0.0 OUTLIER -123.92 154.94 39.02 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' CGU . . . . . 0.541 ' O ' ' N ' ' A' ' 34' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.667 ' O ' HG23 ' A' ' 37' ' ' THR . 50.7 p-10 -37.71 88.45 0.0 OUTLIER 'General case' 0 C--N 1.299 -1.613 0 CA-C-O 121.211 0.529 . . . . 0.0 111.559 -178.553 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.541 ' N ' ' O ' ' A' ' 32' ' ' CGU . . . -81.05 -54.92 5.13 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.272 -0.892 . . . . 0.0 109.056 178.671 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' CGU . . . . . 0.454 ' C ' ' N ' ' A' ' 37' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.744 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 2.0 mt-30 -51.19 -28.12 10.53 Favored 'General case' 0 C--O 1.2 -1.522 0 N-CA-C 105.907 -1.886 . . . . 0.0 105.907 177.759 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.753 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 40.7 p -41.37 -59.46 1.55 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 120.045 -1.659 . . . . 0.0 106.763 177.037 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.582 ' O ' ' C ' ' A' ' 39' ' ' CGU . 0.4 OUTLIER -82.22 -65.06 1.06 Allowed 'General case' 0 C--N 1.287 -2.109 0 O-C-N 121.166 -0.959 . . . . 0.0 109.745 177.152 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 39' ' ' CGU . . . . . 0.582 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.744 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 12.5 t80 -41.51 -57.55 2.19 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 177.731 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.753 ' CD1' ' O ' ' A' ' 37' ' ' THR . 7.6 m95 -80.63 -171.0 2.88 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 177.239 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.599 ' O ' ' CB ' ' A' ' 43' ' ' LYS . 54.8 p 42.13 87.74 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.874 0 O-C-N 120.577 -1.327 . . . . 0.0 109.904 179.098 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.933 ' HD2' HD13 ' A' ' 65' ' ' ILE . 4.9 ptpt 115.19 5.55 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 -179.27 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.66 ' CE1' ' CD2' ' A' ' 14' ' ' CGU . 0.7 OUTLIER -80.7 -95.34 0.04 OUTLIER 'General case' 0 C--O 1.206 -1.212 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 179.489 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.599 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.0 OUTLIER 12.61 55.3 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.597 0 CA-C-O 121.326 0.584 . . . . 0.0 111.17 179.346 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.599 ' N ' ' O ' ' A' ' 44' ' ' TYR . 11.6 t0 -143.98 16.76 1.76 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.325 -0.859 . . . . 0.0 108.979 -178.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.646 ' O ' HD21 ' A' ' 18' ' ' LEU . . . 75.29 2.86 68.53 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 107.86 -2.096 . . . . 0.0 107.86 -177.477 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.801 ' CG ' HD11 ' A' ' 18' ' ' LEU . 0.0 OUTLIER 88.55 7.16 0.16 Allowed 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -179.358 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.719 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 1.6 mt-30 72.47 -23.44 0.2 Allowed 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 120.403 -0.519 . . . . 0.0 112.275 178.788 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.52 ' HB2' ' OB ' ' A' ' 63' ' ' BHD . 17.1 t -93.55 -21.24 19.56 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 120.632 -1.292 . . . . 0.0 107.727 178.311 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -55.99 139.65 45.86 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 179.105 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 101.65 -13.04 58.1 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.427 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 31.7 t60 65.85 63.33 0.99 Allowed Pre-proline 0 N--CA 1.489 1.486 0 O-C-N 121.333 -1.098 . . . . 0.0 109.968 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.486 ' HD3' ' O ' ' A' ' 50' ' ' CYS . 3.5 Cg_exo -60.77 -39.35 63.6 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 C-N-CA 122.25 1.966 . . . . 0.0 110.167 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.469 ' SG ' ' O ' ' A' ' 60' ' ' HIS . 1.9 m -78.42 162.24 26.55 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.56 -0.712 . . . . 0.0 109.372 -179.466 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.528 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 6.0 mt -145.57 -173.85 4.24 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.994 -1.066 . . . . 0.0 110.658 -179.299 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.603 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 0.9 OUTLIER 43.83 64.51 1.25 Allowed 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 121.831 0.824 . . . . 0.0 108.99 -179.486 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.447 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 5.2 mm-40 51.14 31.02 6.13 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.226 177.715 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.433 ' HA2' ' O ' ' A' ' 71' ' ' THR . . . -83.05 141.61 20.9 Favored Glycine 0 N--CA 1.488 2.135 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.475 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 97.8 m-70 -79.23 -164.04 0.57 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.219 -1.165 . . . . 0.0 108.059 179.16 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.457 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 12.5 t -160.77 120.03 2.64 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.553 -1.342 . . . . 0.0 110.922 -179.393 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.29 102.49 11.79 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 178.132 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' BHD . . . . . 0.52 ' OB ' ' HB2' ' A' ' 50' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.608 ' O ' HD12 ' A' ' 65' ' ' ILE . . . 132.04 43.84 0.16 Allowed Glycine 0 N--CA 1.495 2.599 0 C-N-CA 120.404 -0.903 . . . . 0.0 111.459 179.314 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.933 HD13 ' HD2' ' A' ' 43' ' ' LYS . 2.4 pp 34.59 -165.22 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.511 2.585 0 CA-C-N 118.299 1.049 . . . . 0.0 109.964 -179.184 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.498 ' O ' ' CG ' ' A' ' 67' ' ' ASP . . . 47.51 30.67 6.38 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 106.326 -2.71 . . . . 0.0 106.326 -178.248 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.602 ' OD1' ' N ' ' A' ' 68' ' ' TYR . 0.4 OUTLIER 85.58 -171.75 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.507 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 -176.287 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.719 ' CD1' ' HB3' ' A' ' 49' ' ' GLN . 1.0 OUTLIER -137.67 -162.14 1.26 Allowed 'General case' 0 C--N 1.285 -2.229 0 O-C-N 120.345 -1.472 . . . . 0.0 108.376 -178.218 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -148.76 165.22 32.07 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 178.411 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 61' ' ' CYS . 22.6 m -132.05 -165.57 1.61 Allowed 'General case' 0 C--N 1.293 -1.856 0 O-C-N 120.637 -1.29 . . . . 0.0 108.019 179.274 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.475 ' HB ' ' HB2' ' A' ' 60' ' ' HIS . 0.7 OUTLIER -160.15 118.41 2.65 Favored 'General case' 0 C--N 1.297 -1.705 0 O-C-N 121.1 -1.0 . . . . 0.0 109.618 179.516 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.556 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 59.3 m -96.76 139.56 32.64 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.137 -0.977 . . . . 0.0 109.33 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.996 ' HB3' ' CE1' ' A' ' 76' ' ' PHE . . . -71.64 -176.05 1.5 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.114 -0.991 . . . . 0.0 110.467 -179.6 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -81.42 102.02 10.23 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-O 123.149 1.452 . . . . 0.0 108.152 178.334 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLY . . . . . 0.485 ' HA3' ' HD3' ' A' ' 86' ' ' ARG . . . 121.21 21.7 3.04 Favored Glycine 0 C--N 1.268 -3.236 0 CA-C-N 113.663 -1.608 . . . . 0.0 109.195 -179.122 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.996 ' CE1' ' HB3' ' A' ' 73' ' ' ALA . 4.7 m-85 -116.43 166.22 12.33 Favored 'General case' 0 C--N 1.295 -1.801 0 O-C-N 121.581 -0.952 . . . . 0.0 109.423 -178.225 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.476 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 3.6 mt-10 -159.95 170.76 20.69 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 120.775 -1.203 . . . . 0.0 110.458 -179.331 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.83 166.0 39.6 Favored Glycine 0 N--CA 1.489 2.2 0 N-CA-C 109.678 -1.369 . . . . 0.0 109.678 179.608 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.467 ' C ' ' HD3' ' A' ' 79' ' ' LYS . 2.3 tmtt? -55.77 -56.19 23.39 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.255 -1.144 . . . . 0.0 109.139 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.528 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.9 OUTLIER -94.06 30.19 1.95 Allowed 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 179.856 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.486 ' O ' ' HB2' ' A' ' 57' ' ' ASN . 3.1 m 61.2 14.43 5.54 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.867 -1.146 . . . . 0.0 108.622 -179.527 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -44.5 -46.54 9.8 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.601 -0.687 . . . . 0.0 111.456 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.601 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.5 OUTLIER -81.16 84.45 6.55 Favored 'General case' 0 C--N 1.297 -1.687 0 O-C-N 121.401 -0.812 . . . . 0.0 110.751 -178.406 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.518 ' N ' ' OD1' ' A' ' 57' ' ' ASN . 0.1 OUTLIER -66.73 94.42 0.3 Allowed 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 178.473 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.459 ' OG1' ' HG3' ' A' ' 86' ' ' ARG . 20.0 p -49.05 -29.62 5.28 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.185 -0.947 . . . . 0.0 110.239 -178.729 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.485 ' HD3' ' HA3' ' A' ' 75' ' ' GLY . 9.4 mtp180 . . . . . 0 C--N 1.289 -2.055 0 CA-C-O 117.995 -1.003 . . . . 0.0 109.642 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 11.2 p30 -102.38 -29.46 11.63 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.277 -0.889 . . . . 0.0 109.419 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -47.74 133.27 13.97 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.229 -0.92 . . . . 0.0 109.538 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.485 ' C ' ' CD1' ' A' ' 4' ' ' PHE . 0.1 OUTLIER -80.3 9.34 5.88 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.156 -0.965 . . . . 0.0 110.212 -179.752 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.567 ' O ' HG13 ' A' ' 8' ' ' VAL . 0.4 OUTLIER -61.16 -40.36 93.59 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 120.946 -1.096 . . . . 0.0 109.568 -179.761 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 6' ' ' CGU . . . . . 0.507 ' C ' ' O ' ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' CGU . . . . . 0.461 ' O ' ' C ' ' A' ' 8' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.793 HG23 ' O ' ' A' ' 8' ' ' VAL . 11.7 m -39.59 99.12 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.309 -1.177 0 CA-C-O 122.516 1.15 . . . . 0.0 109.634 -178.917 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.59 ' O ' ' CB ' ' A' ' 10' ' ' GLN . 2.3 tttp -50.3 -18.85 0.68 Allowed 'General case' 0 C--N 1.286 -2.166 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.57 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.59 ' CB ' ' O ' ' A' ' 9' ' ' LYS . 30.6 tt0 89.76 58.26 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.863 0 CA-C-O 121.247 0.546 . . . . 0.0 109.569 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -142.02 17.74 2.55 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.589 -1.405 . . . . 0.0 109.589 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.567 ' O ' ' CE1' ' A' ' 31' ' ' PHE . 5.0 m-80 -88.87 51.99 2.3 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.247 -1.149 . . . . 0.0 109.622 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.53 ' C ' ' CE2' ' A' ' 31' ' ' PHE . 0.1 OUTLIER -125.1 8.27 7.96 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-O 121.769 0.795 . . . . 0.0 109.373 179.915 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 14' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.603 ' C ' ' H ' ' A' ' 17' ' ' CYS . 50.1 mtm180 -82.31 99.12 9.15 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 177.121 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' CGU . . . . . 0.613 ' O ' ' CB ' ' A' ' 17' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.692 ' O ' ' HB2' ' A' ' 18' ' ' LEU . 9.9 p 115.9 -45.41 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.112 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 -178.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.692 ' HB2' ' O ' ' A' ' 17' ' ' CYS . 1.9 mm? 113.67 -103.43 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.182 0 C-N-CA 124.059 0.943 . . . . 0.0 109.891 178.581 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' CGU . . . . . 0.642 ' CD1' ' N ' ' A' ' 19' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' CGU . . . . . 0.535 ' C ' ' N ' ' A' ' 22' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.457 ' C ' ' O ' ' A' ' 20' ' ' CGU . . . -35.22 -32.18 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.768 0 CA-C-O 121.912 0.863 . . . . 0.0 109.745 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.535 ' N ' ' C ' ' A' ' 20' ' ' CGU . 30.1 p -119.66 167.87 11.6 Favored 'General case' 0 C--N 1.292 -1.932 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.437 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.513 ' O ' ' CB ' ' A' ' 24' ' ' LEU . 42.3 t -87.76 1.33 54.14 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.214 -0.929 . . . . 0.0 109.082 179.201 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.513 ' CB ' ' O ' ' A' ' 23' ' ' SER . 0.2 OUTLIER 77.74 -5.27 2.14 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.429 -0.794 . . . . 0.0 109.832 -179.858 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 25' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 26' ' ' CGU . . . . . 0.542 ' O ' ' HB ' ' A' ' 30' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.568 ' HB3' OE12 ' A' ' 16' ' ' CGU . . . -58.28 -8.94 1.28 Allowed 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.789 -1.194 . . . . 0.0 110.637 -179.287 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.507 ' HG2' ' NH1' ' A' ' 28' ' ' ARG . 0.0 OUTLIER -79.94 -78.21 0.17 Allowed 'General case' 0 N--CA 1.487 1.423 0 O-C-N 120.766 -1.209 . . . . 0.0 111.571 -179.276 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 29' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.542 ' HB ' ' O ' ' A' ' 26' ' ' CGU . 2.0 p -83.98 -29.15 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 120.358 -1.464 . . . . 0.0 109.736 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.567 ' CE1' ' O ' ' A' ' 12' ' ' ASN . 42.4 m-85 -78.87 92.81 4.92 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.351 -0.843 . . . . 0.0 109.944 -179.656 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.602 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 1.5 m-20 -41.45 117.68 0.94 Allowed 'General case' 0 C--N 1.304 -1.41 0 CA-C-O 121.274 0.559 . . . . 0.0 110.752 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.515 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -78.38 -30.64 48.02 Favored 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 107.494 -1.298 . . . . 0.0 107.494 178.381 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' CGU . . . . . 0.4 ' O ' ' C ' ' A' ' 36' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.635 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 13.2 mm100 -50.36 -35.65 28.9 Favored 'General case' 0 C--O 1.206 -1.218 0 C-N-CA 118.261 -1.376 . . . . 0.0 108.023 178.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.72 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -40.97 -58.43 1.72 Allowed 'General case' 0 N--CA 1.499 1.991 0 C-N-CA 117.743 -1.583 . . . . 0.0 107.33 178.569 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.596 ' O ' ' C ' ' A' ' 39' ' ' CGU . 0.6 OUTLIER -81.58 -67.32 0.79 Allowed 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.115 -0.99 . . . . 0.0 109.493 177.291 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 39' ' ' CGU . . . . . 0.596 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.663 ' O ' ' HB2' ' A' ' 44' ' ' TYR . 9.6 t80 -42.81 -54.7 4.0 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 178.37 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.72 ' CD1' ' O ' ' A' ' 37' ' ' THR . 7.1 m95 -79.46 -179.79 7.01 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 120.83 -1.169 . . . . 0.0 108.593 177.684 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.665 ' O ' ' CB ' ' A' ' 43' ' ' LYS . 1.5 t 36.84 92.86 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.659 -0.651 . . . . 0.0 110.2 179.259 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.665 ' CB ' ' O ' ' A' ' 42' ' ' SER . 0.0 OUTLIER 123.14 -33.33 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 106.235 -1.765 . . . . 0.0 106.235 -178.789 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.663 ' HB2' ' O ' ' A' ' 40' ' ' PHE . 0.1 OUTLIER -55.05 -73.66 0.05 Allowed 'General case' 0 C--N 1.299 -1.614 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.58 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.593 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -0.69 68.96 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.662 0 CA-C-O 121.457 0.646 . . . . 0.0 111.137 179.435 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.602 ' N ' ' O ' ' A' ' 44' ' ' TYR . 8.2 t70 -160.45 28.0 0.16 Allowed 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.381 -0.825 . . . . 0.0 109.204 -178.476 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.547 ' O ' HD11 ' A' ' 18' ' ' LEU . . . 67.31 12.1 60.33 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 108.272 -1.931 . . . . 0.0 108.272 -178.5 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.577 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 33.7 t70 71.72 21.4 4.32 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.817 -0.813 . . . . 0.0 109.611 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.61 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 52.9 mm-40 70.53 -10.63 0.68 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.843 -0.536 . . . . 0.0 112.142 178.473 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.493 ' HB2' ' OB ' ' A' ' 63' ' ' BHD . 52.9 t -114.6 -10.11 12.55 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.446 -1.409 . . . . 0.0 109.986 179.555 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.533 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 12.1 tm-20 -62.1 152.26 33.3 Favored 'General case' 0 N--CA 1.482 1.169 0 O-C-N 120.819 -1.176 . . . . 0.0 108.851 179.525 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.445 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . 93.52 -12.77 68.95 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 110.173 -1.171 . . . . 0.0 110.173 179.642 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.452 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 6.1 t60 68.84 66.08 0.52 Allowed Pre-proline 0 N--CA 1.492 1.651 0 O-C-N 120.982 -1.305 . . . . 0.0 109.234 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.461 ' HD3' ' O ' ' A' ' 50' ' ' CYS . 5.4 Cg_exo -60.86 -40.09 56.49 Favored 'Trans proline' 0 C--N 1.31 -1.494 0 C-N-CA 122.651 2.234 . . . . 0.0 111.302 -179.454 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.486 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 1.0 OUTLIER -83.61 174.05 10.87 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.118 -0.989 . . . . 0.0 109.947 -179.044 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.598 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.2 mt -147.07 -171.77 3.85 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.487 -0.758 . . . . 0.0 108.967 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.737 ' HB3' ' CD2' ' A' ' 76' ' ' PHE . 0.9 OUTLIER 48.71 57.14 6.66 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.419 -0.801 . . . . 0.0 110.055 179.727 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.45 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 0.7 OUTLIER 44.69 33.84 1.03 Allowed 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 178.17 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -83.3 153.7 30.76 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 -179.259 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.465 ' O ' ' SG ' ' A' ' 55' ' ' CYS . 0.1 OUTLIER -79.53 164.96 23.47 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.4 -1.059 . . . . 0.0 108.319 179.035 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.486 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 20.4 t -134.31 111.69 10.41 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.018 -1.051 . . . . 0.0 110.519 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.507 ' HB3' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER -80.38 176.79 9.46 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 177.46 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 63' ' ' BHD . . . . . 0.513 ' HA ' ' CB ' ' A' ' 68' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.427 ' O ' ' CG ' ' A' ' 49' ' ' GLN . . . 153.39 -175.36 31.83 Favored Glycine 0 N--CA 1.489 2.172 0 N-CA-C 107.618 -2.193 . . . . 0.0 107.618 -179.11 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.63 HD12 ' HA ' ' A' ' 44' ' ' TYR . 10.2 mm -94.37 -67.42 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 120.619 -1.518 . . . . 0.0 110.014 179.806 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.5 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . -43.47 -26.94 0.72 Allowed Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.189 -1.565 . . . . 0.0 109.189 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.5 ' HB3' ' O ' ' A' ' 66' ' ' GLY . 6.6 p-10 175.54 -149.47 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.635 -0.921 . . . . 0.0 109.592 179.275 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.626 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 2.8 p90 -160.43 -165.1 1.36 Allowed 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 -179.399 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.507 ' OG1' ' HB3' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -147.82 179.26 7.85 Favored 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.535 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 3.8 m -141.23 -170.83 3.15 Favored 'General case' 0 C--N 1.297 -1.702 0 O-C-N 120.898 -1.126 . . . . 0.0 108.253 179.108 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.429 ' HB ' ' HB2' ' A' ' 60' ' ' HIS . 4.0 m -160.78 140.92 11.18 Favored 'General case' 0 C--N 1.292 -1.901 0 O-C-N 121.461 -0.775 . . . . 0.0 109.315 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 55.9 m -105.77 139.17 40.75 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.147 -0.971 . . . . 0.0 109.37 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.37 175.64 5.27 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.076 -1.015 . . . . 0.0 109.66 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -80.66 102.13 9.67 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 123.065 1.412 . . . . 0.0 107.668 178.392 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLY . . . . . 0.592 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 130.46 8.15 3.29 Favored Glycine 0 C--N 1.269 -3.17 0 CA-C-N 113.902 -1.499 . . . . 0.0 110.186 -179.352 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.737 ' CD2' ' HB3' ' A' ' 57' ' ' ASN . 13.8 m-85 -130.64 169.19 15.95 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 120.779 -1.424 . . . . 0.0 110.155 -178.547 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.473 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 2.3 mt-10 -160.56 174.52 13.92 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.104 -0.998 . . . . 0.0 110.046 -178.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 112.24 169.37 18.06 Favored Glycine 0 N--CA 1.493 2.47 0 N-CA-C 110.12 -1.192 . . . . 0.0 110.12 179.167 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.46 ' HD3' ' O ' ' A' ' 79' ' ' LYS . 3.1 tmtt? -56.98 -55.71 31.18 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.268 -1.137 . . . . 0.0 108.428 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.598 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.7 OUTLIER -99.75 26.97 5.73 Favored 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 178.183 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.521 ' HB2' ' HB2' ' A' ' 57' ' ' ASN . 1.8 m 55.84 71.7 0.54 Allowed 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 105.389 -2.078 . . . . 0.0 105.389 -177.088 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.436 ' O ' ' HG3' ' A' ' 82' ' ' GLU . 0.5 OUTLIER -108.24 -30.9 8.12 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.373 -0.829 . . . . 0.0 110.266 -176.894 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.66 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -87.12 81.52 7.99 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.043 -1.035 . . . . 0.0 109.996 -179.792 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.22 108.88 0.46 Allowed 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 179.124 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.421 ' O ' ' OXT' ' A' ' 86' ' ' ARG . 5.0 p -85.89 -11.78 52.34 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.083 -1.011 . . . . 0.0 109.974 -179.29 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.554 ' NH1' ' HG3' ' A' ' 86' ' ' ARG . 0.3 OUTLIER . . . . . 0 C--N 1.297 -1.699 0 CA-C-O 118.104 -0.951 . . . . 0.0 109.467 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -159.75 134.34 7.76 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.26 -0.9 . . . . 0.0 109.297 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 6.2 t -155.18 143.15 20.03 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.199 -0.938 . . . . 0.0 109.584 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.583 ' CZ ' ' O ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -71.71 -20.41 61.91 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.389 -0.82 . . . . 0.0 109.24 179.895 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.793 ' O ' HG13 ' A' ' 8' ' ' VAL . 0.2 OUTLIER -80.21 0.58 31.89 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.11 -0.993 . . . . 0.0 109.735 -179.807 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 6' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 7' ' ' CGU . . . . . 0.528 ' O ' ' CG ' ' A' ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.797 HG23 ' O ' ' A' ' 8' ' ' VAL . 13.3 m -40.06 96.8 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.307 -1.27 0 CA-C-O 122.469 1.128 . . . . 0.0 110.047 -179.216 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.562 ' O ' ' CB ' ' A' ' 10' ' ' GLN . 1.3 ptpm? -48.84 -34.5 12.61 Favored 'General case' 0 C--N 1.283 -2.313 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.562 ' CB ' ' O ' ' A' ' 9' ' ' LYS . 36.4 tt0 151.75 -27.41 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 179.409 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.79 ' HA3' HG21 ' A' ' 30' ' ' VAL . . . 79.19 147.62 4.04 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.234 -1.546 . . . . 0.0 109.234 -179.727 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.549 ' HB2' ' HB2' ' A' ' 16' ' ' CGU . 42.2 t30 -103.97 -168.77 1.54 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.088 -1.242 . . . . 0.0 109.723 -179.728 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.624 ' O ' ' CB ' ' A' ' 14' ' ' CGU . 0.1 OUTLIER -77.44 -10.82 59.69 Favored 'General case' 0 C--O 1.2 -1.551 0 O-C-N 120.847 -1.158 . . . . 0.0 110.4 -178.877 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 14' ' ' CGU . . . . . 0.624 ' CB ' ' O ' ' A' ' 13' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.503 ' NH1' ' CB ' ' A' ' 50' ' ' CYS . 0.0 OUTLIER -73.26 -33.13 65.1 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.975 -1.078 . . . . 0.0 111.237 -178.189 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 16' ' ' CGU . . . . . 0.549 ' HB2' ' HB2' ' A' ' 12' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 1.027 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 42.1 m -104.1 10.31 35.99 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.795 -1.191 . . . . 0.0 110.435 -179.627 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.5 HD22 ' HA ' ' A' ' 18' ' ' LEU . 0.2 OUTLIER -61.8 -14.97 37.79 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 120.802 -1.186 . . . . 0.0 108.569 179.018 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 19' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 20' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 1.027 ' HB3' ' HA ' ' A' ' 17' ' ' CYS . . . -52.36 -50.02 63.2 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.072 -1.017 . . . . 0.0 109.928 -179.582 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.53 ' HB3' ' CB ' ' A' ' 26' ' ' CGU . 2.4 m -143.33 -44.35 0.29 Allowed 'General case' 0 C--N 1.289 -2.031 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 179.268 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.511 ' O ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER 61.28 -85.3 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.57 -0.706 . . . . 0.0 110.515 179.328 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.716 HD13 ' CZ2' ' A' ' 41' ' ' TRP . 0.9 OUTLIER -124.94 -27.61 3.57 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.964 -1.085 . . . . 0.0 110.139 -179.059 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' CGU . . . . . 0.634 OE21 HD13 ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' CGU . . . . . 0.53 ' CB ' ' HB3' ' A' ' 22' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -80.06 8.47 7.06 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 120.482 -1.386 . . . . 0.0 110.175 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 28.7 mtt180 -111.13 -56.38 2.38 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.114 -0.992 . . . . 0.0 110.523 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.79 HG21 ' HA3' ' A' ' 11' ' ' GLY . 1.0 OUTLIER -84.13 -6.94 10.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 120.76 -1.213 . . . . 0.0 108.894 179.78 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.622 ' CE2' ' O ' ' A' ' 13' ' ' LEU . 69.1 m-85 -110.49 113.45 26.1 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.131 -0.981 . . . . 0.0 111.413 -179.326 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.559 ' CB ' ' HG2' ' A' ' 36' ' ' GLN . 0.5 OUTLIER -60.31 114.59 2.99 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 121.822 -0.549 . . . . 0.0 110.974 -179.109 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.469 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -78.26 -27.75 47.56 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 106.368 -1.716 . . . . 0.0 106.368 177.252 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.636 ' NE2' ' CD1' ' A' ' 40' ' ' PHE . 0.0 OUTLIER -54.72 -34.29 62.25 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 117.911 -1.515 . . . . 0.0 107.543 179.413 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.693 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -42.22 -59.6 1.74 Allowed 'General case' 0 N--CA 1.496 1.839 0 C-N-CA 117.63 -1.628 . . . . 0.0 106.694 178.46 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.625 ' O ' ' C ' ' A' ' 39' ' ' CGU . 0.7 OUTLIER -82.12 -70.78 0.52 Allowed 'General case' 0 C--N 1.297 -1.689 0 O-C-N 121.131 -0.981 . . . . 0.0 109.023 176.305 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 39' ' ' CGU . . . . . 0.625 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.636 ' CD1' ' NE2' ' A' ' 36' ' ' GLN . 9.2 t80 -41.75 -60.04 1.48 Allowed 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 178.013 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.716 ' CZ2' HD13 ' A' ' 24' ' ' LEU . 8.7 m95 -81.34 -177.56 6.54 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 176.355 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.475 ' OG ' ' N ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER 73.05 -71.62 0.13 Allowed 'General case' 0 N--CA 1.496 1.848 0 CA-C-O 121.934 0.873 . . . . 0.0 111.646 177.168 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.475 ' N ' ' OG ' ' A' ' 42' ' ' SER . 0.1 OUTLIER -87.48 18.75 3.67 Favored 'General case' 0 C--N 1.278 -2.543 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 -179.903 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.519 ' OH ' ' HB3' ' A' ' 48' ' ' ASP . 0.3 OUTLIER -81.03 31.78 0.32 Allowed 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 119.764 -0.775 . . . . 0.0 110.6 -179.977 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 8.0 pttm -91.0 19.57 5.56 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 120.993 -1.067 . . . . 0.0 108.474 179.113 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -103.7 3.82 34.67 Favored 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.51 ' O ' ' CB ' ' A' ' 48' ' ' ASP . . . 91.72 -71.98 1.72 Allowed Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.252 -1.539 . . . . 0.0 109.252 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.548 ' O ' ' N ' ' A' ' 50' ' ' CYS . 1.5 p-10 159.59 37.24 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.554 -0.968 . . . . 0.0 109.136 179.66 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.618 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 21.9 mp0 51.96 -86.87 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.449 -0.782 . . . . 0.0 110.043 178.924 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.548 ' N ' ' O ' ' A' ' 48' ' ' ASP . 2.7 t -39.6 -26.24 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.342 -0.849 . . . . 0.0 109.867 179.717 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.507 ' N ' ' O ' ' A' ' 49' ' ' GLN . 1.1 tt0 -53.64 134.77 41.45 Favored 'General case' 0 N--CA 1.484 1.254 0 O-C-N 120.562 -1.336 . . . . 0.0 108.466 179.522 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.471 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . 103.28 -14.07 54.94 Favored Glycine 0 N--CA 1.495 2.614 0 O-C-N 120.732 -1.23 . . . . 0.0 110.12 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.564 ' CE1' ' O ' ' A' ' 55' ' ' CYS . 0.9 OUTLIER 70.55 61.58 0.48 Allowed Pre-proline 0 N--CA 1.493 1.717 0 O-C-N 121.123 -1.222 . . . . 0.0 109.825 179.912 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.545 ' CB ' ' CE2' ' A' ' 68' ' ' TYR . 3.4 Cg_exo -58.83 -44.9 32.27 Favored 'Trans proline' 0 C--N 1.309 -1.502 0 C-N-CA 122.544 2.162 . . . . 0.0 111.205 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.564 ' O ' ' CE1' ' A' ' 53' ' ' HIS . 0.8 OUTLIER -85.52 165.12 17.37 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.235 -0.916 . . . . 0.0 109.447 -179.114 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.508 ' O ' ' HB2' ' A' ' 81' ' ' CYS . 5.9 mt -149.66 -173.93 4.55 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 120.99 -1.069 . . . . 0.0 110.739 -179.369 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.61 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 1.1 m120 43.77 63.46 1.58 Allowed 'General case' 0 C--N 1.3 -1.561 0 CA-C-O 121.812 0.815 . . . . 0.0 109.414 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.45 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 2.1 mm-40 53.93 29.19 9.56 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.641 -0.662 . . . . 0.0 110.19 177.618 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -84.32 145.65 22.28 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.38 -1.488 . . . . 0.0 109.38 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.467 ' O ' ' SG ' ' A' ' 55' ' ' CYS . 1.7 t-160 -79.05 173.23 12.78 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.047 -1.266 . . . . 0.0 108.094 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.449 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 13.5 t -140.65 105.74 5.0 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.83 -1.169 . . . . 0.0 110.922 -179.137 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.586 ' O ' ' CG ' ' A' ' 63' ' ' BHD . 3.2 mtmm -92.77 169.96 10.07 Favored 'General case' 0 C--N 1.296 -1.73 0 N-CA-C 106.072 -1.825 . . . . 0.0 106.072 177.134 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' BHD . . . . . 0.586 ' CG ' ' O ' ' A' ' 62' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.559 ' O ' ' O ' ' A' ' 65' ' ' ILE . . . 131.24 57.7 0.09 OUTLIER Glycine 0 N--CA 1.492 2.418 0 N-CA-C 110.444 -1.062 . . . . 0.0 110.444 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.574 HG23 ' N ' ' A' ' 66' ' ' GLY . 0.0 OUTLIER 45.36 173.9 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.128 0 O-C-N 121.532 -0.981 . . . . 0.0 110.673 179.742 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.574 ' N ' HG23 ' A' ' 65' ' ' ILE . . . 58.96 -80.99 0.01 OUTLIER Glycine 0 N--CA 1.496 2.671 0 N-CA-C 108.98 -1.648 . . . . 0.0 108.98 -179.135 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.586 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 5.5 p-10 -135.29 -162.57 1.28 Allowed 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 178.378 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.688 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 4.5 p90 -150.76 -159.15 0.99 Allowed 'General case' 0 C--N 1.292 -1.915 0 O-C-N 120.904 -1.122 . . . . 0.0 109.709 -177.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -149.7 171.04 17.34 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 178.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 52.8 m -140.48 -169.1 2.7 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 120.847 -1.158 . . . . 0.0 108.726 179.19 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -160.46 124.68 3.64 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.538 -0.726 . . . . 0.0 109.318 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.52 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 66.9 m -100.93 142.05 32.95 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.038 -1.038 . . . . 0.0 109.518 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.935 ' HB3' ' CE1' ' A' ' 76' ' ' PHE . . . -73.49 -176.35 2.26 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.189 -0.945 . . . . 0.0 110.678 -179.639 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -81.23 102.44 10.35 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 123.139 1.447 . . . . 0.0 107.983 178.202 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLY . . . . . 0.466 ' HA2' ' OG1' ' A' ' 85' ' ' THR . . . 121.28 21.43 3.08 Favored Glycine 0 C--N 1.267 -3.293 0 N-CA-C 109.09 -1.604 . . . . 0.0 109.09 -179.048 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.935 ' CE1' ' HB3' ' A' ' 73' ' ' ALA . 6.0 m-85 -119.58 163.77 16.84 Favored 'General case' 0 C--N 1.294 -1.806 0 O-C-N 121.447 -1.031 . . . . 0.0 109.586 -178.369 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.493 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 1.8 mm-40 -157.21 174.41 15.51 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.956 -1.09 . . . . 0.0 110.317 -179.599 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.39 163.6 38.66 Favored Glycine 0 N--CA 1.489 2.198 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.44 -34.04 73.4 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.299 -1.118 . . . . 0.0 109.532 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.507 ' HB3' ' O ' ' A' ' 54' ' ' PRO . 0.1 OUTLIER -112.34 26.92 10.1 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 179.929 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.508 ' HB2' ' O ' ' A' ' 56' ' ' LEU . 3.0 m 63.22 12.06 5.82 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 120.804 -1.185 . . . . 0.0 108.516 -179.03 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -47.88 -43.57 28.69 Favored 'General case' 0 C--N 1.308 -1.198 0 O-C-N 121.585 -0.697 . . . . 0.0 111.462 -179.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.565 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.8 OUTLIER -81.8 83.49 7.14 Favored 'General case' 0 C--N 1.297 -1.702 0 O-C-N 121.294 -0.879 . . . . 0.0 110.585 -178.838 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.467 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 89.7 p -65.0 94.62 0.14 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.152 -0.967 . . . . 0.0 108.586 178.753 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.466 ' H ' HG23 ' A' ' 85' ' ' THR . 12.0 p -58.84 -17.01 20.02 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.337 -0.852 . . . . 0.0 110.099 -179.163 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.48 ' HG2' ' NH1' ' A' ' 86' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.291 -1.969 0 CA-C-O 117.964 -1.017 . . . . 0.0 109.525 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.555 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.7 p30 -170.81 -175.92 1.91 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.269 -0.894 . . . . 0.0 109.461 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.456 ' OG ' OE12 ' A' ' 6' ' ' CGU . 0.1 OUTLIER -105.33 153.23 21.91 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.161 -0.962 . . . . 0.0 109.479 -179.917 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.476 ' CE2' ' O ' ' A' ' 22' ' ' CYS . 21.3 p90 -49.98 -38.7 38.13 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.184 -0.948 . . . . 0.0 109.966 -179.561 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.844 HD22 ' HB3' ' A' ' 26' ' ' CGU . 0.3 OUTLIER -74.34 -138.21 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.335 0 C-N-CA 117.691 -1.604 . . . . 0.0 107.796 178.41 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 6' ' ' CGU . . . . . 0.565 ' C ' ' O ' ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' CGU . . . . . 0.601 ' CD1' ' C ' ' A' ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.787 HG23 ' O ' ' A' ' 8' ' ' VAL . 33.7 m -44.55 97.88 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.207 -1.182 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 179.705 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.518 ' O ' ' C ' ' A' ' 10' ' ' GLN . 0.0 OUTLIER -48.26 88.14 0.0 OUTLIER 'General case' 0 C--N 1.286 -2.194 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 179.648 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.623 ' N ' ' O ' ' A' ' 8' ' ' VAL . 22.9 mp0 27.53 93.75 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 121.274 0.559 . . . . 0.0 110.355 -178.585 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -102.48 -147.17 18.93 Favored Glycine 0 N--CA 1.489 2.203 0 N-CA-C 110.117 -1.193 . . . . 0.0 110.117 -179.278 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.519 ' HB3' ' HB3' ' A' ' 16' ' ' CGU . 3.2 t-20 -103.11 -169.91 1.72 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.493 -1.004 . . . . 0.0 109.615 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 1.087 HD13 ' O ' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -134.94 142.57 46.55 Favored 'General case' 0 C--N 1.306 -1.287 0 O-C-N 121.191 -0.943 . . . . 0.0 108.568 179.861 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 14' ' ' CGU . . . . . 0.998 ' N ' HD22 ' A' ' 13' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.536 ' CZ ' ' OB ' ' A' ' 63' ' ' BHD . 0.0 OUTLIER -71.54 -52.34 18.76 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.157 -0.964 . . . . 0.0 108.468 179.741 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' CGU . . . . . 0.519 ' HB3' ' HB3' ' A' ' 12' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.534 ' SG ' ' O ' ' A' ' 17' ' ' CYS . 28.7 t -104.73 17.96 23.17 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.405 -0.809 . . . . 0.0 109.51 -179.143 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.824 HD11 ' OE1' ' A' ' 51' ' ' GLU . 0.3 OUTLIER -40.79 -85.24 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.76 -1.212 . . . . 0.0 110.426 -179.907 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 19' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 20' ' ' CGU . . . . . 0.466 ' O ' ' CD2' ' A' ' 4' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.412 ' HB1' OE22 ' A' ' 16' ' ' CGU . . . -105.41 8.89 33.78 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.906 -1.121 . . . . 0.0 109.606 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.563 ' O ' ' CB ' ' A' ' 23' ' ' SER . 12.8 t -111.4 -126.46 0.28 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.207 -0.933 . . . . 0.0 109.83 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.563 ' CB ' ' O ' ' A' ' 22' ' ' CYS . 1.9 t 153.86 -23.23 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.007 -1.058 . . . . 0.0 108.164 -179.682 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.519 ' CB ' ' O ' ' A' ' 23' ' ' SER . 0.1 OUTLIER 82.72 -41.91 0.11 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.834 -0.541 . . . . 0.0 109.837 -179.801 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 25' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 26' ' ' CGU . . . . . 0.844 ' HB3' HD22 ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.702 ' HB1' ' CZ ' ' A' ' 31' ' ' PHE . . . -48.14 -61.69 1.86 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.668 -1.27 . . . . 0.0 108.998 -179.652 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.856 ' NH1' HG22 ' A' ' 37' ' ' THR . 0.8 OUTLIER -49.93 -57.9 6.53 Favored 'General case' 0 C--N 1.297 -1.681 0 O-C-N 120.575 -1.328 . . . . 0.0 110.85 -179.792 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 29' ' ' CGU . . . . . 0.431 ' C ' ' O ' ' A' ' 28' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.631 HG23 OE12 ' A' ' 26' ' ' CGU . 79.7 t -79.79 -36.17 17.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.352 -0.843 . . . . 0.0 110.072 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.903 ' CZ ' HD23 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -136.91 129.86 30.8 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.792 -1.192 . . . . 0.0 111.516 -179.459 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' CGU . . . . . 0.43 ' O ' ' C ' ' A' ' 33' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.526 ' HB3' ' HG2' ' A' ' 36' ' ' GLN . 0.1 OUTLIER -39.22 115.5 0.5 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.398 -0.814 . . . . 0.0 111.234 -177.601 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.502 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -80.54 -31.86 36.9 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 179.375 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.729 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 0.0 OUTLIER -56.93 -37.68 71.84 Favored 'General case' 0 C--O 1.198 -1.634 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 178.542 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.856 HG22 ' NH1' ' A' ' 28' ' ' ARG . 0.0 OUTLIER -38.91 -57.71 1.2 Allowed 'General case' 0 N--CA 1.502 2.129 0 O-C-N 119.656 -1.903 . . . . 0.0 107.79 178.414 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.615 ' O ' ' C ' ' A' ' 39' ' ' CGU . 1.8 t70 -82.4 -69.34 0.63 Allowed 'General case' 0 C--N 1.295 -1.784 0 O-C-N 121.154 -0.966 . . . . 0.0 109.898 176.925 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' CGU . . . . . 0.615 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.755 ' CE1' HD21 ' A' ' 13' ' ' LEU . 21.5 t80 -39.45 -59.48 1.08 Allowed 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 107.294 -1.372 . . . . 0.0 107.294 177.261 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.684 ' CD1' ' O ' ' A' ' 37' ' ' THR . 11.3 m95 -80.65 -177.03 6.09 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 177.36 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.631 ' O ' ' CB ' ' A' ' 43' ' ' LYS . 0.4 OUTLIER 35.22 81.83 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.125 0 O-C-N 121.46 -0.775 . . . . 0.0 110.055 179.213 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.631 ' CB ' ' O ' ' A' ' 42' ' ' SER . 18.2 tptt 133.86 -26.0 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 105.708 -1.96 . . . . 0.0 105.708 -178.365 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.635 ' O ' ' N ' ' A' ' 46' ' ' ASP . 0.9 OUTLIER -46.55 -71.01 0.08 Allowed 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 115.263 -0.881 . . . . 0.0 108.66 179.035 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.544 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.1 OUTLIER -1.11 64.73 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.68 0 CA-C-O 121.459 0.647 . . . . 0.0 112.054 179.663 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.635 ' N ' ' O ' ' A' ' 44' ' ' TYR . 5.3 t0 -161.38 23.48 0.13 Allowed 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 -179.613 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.602 ' O ' ' HB3' ' A' ' 48' ' ' ASP . . . 82.78 -74.56 2.5 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 107.714 -2.154 . . . . 0.0 107.714 -178.058 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.602 ' HB3' ' O ' ' A' ' 47' ' ' GLY . 0.0 OUTLIER 168.25 13.58 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.02 0 O-C-N 122.239 -0.565 . . . . 0.0 109.75 178.129 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.587 ' HB2' ' O ' ' A' ' 48' ' ' ASP . 22.8 mp0 73.31 -27.27 0.19 Allowed 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.558 -0.714 . . . . 0.0 111.845 178.723 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.491 ' HB2' ' OB ' ' A' ' 63' ' ' BHD . 10.8 t -124.35 2.97 8.46 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 120.522 -1.361 . . . . 0.0 109.691 179.102 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.824 ' OE1' HD11 ' A' ' 18' ' ' LEU . 10.7 tt0 -57.62 -47.63 81.66 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.824 -1.172 . . . . 0.0 110.878 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -67.38 -0.34 10.94 Favored Glycine 0 N--CA 1.496 2.677 0 O-C-N 120.987 -1.07 . . . . 0.0 111.658 -178.313 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.532 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 2.2 t60 57.44 61.67 6.03 Favored Pre-proline 0 N--CA 1.492 1.657 0 O-C-N 120.656 -1.496 . . . . 0.0 109.105 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.532 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 1.3 Cg_endo -64.6 -45.77 8.3 Favored 'Trans proline' 0 C--N 1.31 -1.487 0 C-N-CA 122.561 2.174 . . . . 0.0 111.911 -178.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.464 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 2.1 m -63.73 161.12 15.7 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 120.901 -1.124 . . . . 0.0 109.378 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.495 ' HA ' HD23 ' A' ' 56' ' ' LEU . 4.9 mt -144.0 -174.94 4.41 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.141 -0.975 . . . . 0.0 109.927 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.61 ' O ' ' CD2' ' A' ' 76' ' ' PHE . 5.4 m-80 41.52 63.98 1.15 Allowed 'General case' 0 C--N 1.3 -1.551 0 CA-C-O 121.886 0.85 . . . . 0.0 109.56 -179.263 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.456 ' HG3' ' C ' ' A' ' 57' ' ' ASN . 0.7 OUTLIER 47.44 35.98 4.62 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.333 -0.854 . . . . 0.0 109.075 178.13 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -79.57 142.44 24.75 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.636 -1.386 . . . . 0.0 109.636 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.494 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 2.0 m80 -79.57 137.93 37.3 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.32 -1.106 . . . . 0.0 108.562 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.464 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 27.6 t -107.96 122.11 46.15 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.152 -0.967 . . . . 0.0 110.302 -179.026 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.489 ' HB2' ' OG1' ' A' ' 69' ' ' THR . 32.2 mmtt -104.03 97.7 7.64 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 105.617 -1.994 . . . . 0.0 105.617 177.237 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' BHD . . . . . 0.536 ' OB ' ' CZ ' ' A' ' 15' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.519 ' O ' ' OE1' ' A' ' 49' ' ' GLN . . . 164.81 -166.1 37.89 Favored Glycine 0 N--CA 1.488 2.134 0 N-CA-C 106.457 -2.657 . . . . 0.0 106.457 -178.714 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.569 ' CG2' ' HG3' ' A' ' 43' ' ' LYS . 6.2 mm -98.6 -72.77 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 120.273 -1.722 . . . . 0.0 110.222 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.462 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . -42.54 -26.56 0.41 Allowed Glycine 0 N--CA 1.491 2.339 0 C-N-CA 119.553 -1.308 . . . . 0.0 110.263 -178.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.462 ' HB3' ' O ' ' A' ' 66' ' ' GLY . 2.3 p-10 179.93 -154.11 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.021 -1.282 . . . . 0.0 110.44 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.664 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 4.2 p90 -160.46 130.22 5.14 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 -178.328 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.489 ' OG1' ' HB2' ' A' ' 62' ' ' LYS . 43.5 p -98.79 117.15 32.61 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 120.71 -1.244 . . . . 0.0 109.333 -179.804 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 33.5 m -79.27 -169.24 1.79 Allowed 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.01 -1.056 . . . . 0.0 108.659 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.494 ' HB ' ' HB2' ' A' ' 60' ' ' HIS . 0.2 OUTLIER -160.48 149.82 17.34 Favored 'General case' 0 C--N 1.286 -2.159 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 179.94 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.547 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 92.8 m -114.06 118.39 33.94 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.146 -0.971 . . . . 0.0 108.945 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.864 ' HB3' ' CD1' ' A' ' 76' ' ' PHE . . . -48.26 -176.57 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.023 -1.048 . . . . 0.0 110.812 -179.223 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -80.29 101.85 9.17 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 123.278 1.513 . . . . 0.0 107.555 178.432 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLY . . . . . 0.531 ' HA2' ' HG3' ' A' ' 86' ' ' ARG . . . 118.3 20.44 4.36 Favored Glycine 0 C--N 1.268 -3.232 0 N-CA-C 108.91 -1.676 . . . . 0.0 108.91 -178.533 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.864 ' CD1' ' HB3' ' A' ' 73' ' ' ALA . 9.2 m-85 -119.55 156.04 31.06 Favored 'General case' 0 C--N 1.294 -1.827 0 O-C-N 121.621 -0.929 . . . . 0.0 109.462 -178.407 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.511 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 5.5 mm-40 -160.69 161.18 32.23 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.058 -1.026 . . . . 0.0 110.84 -179.33 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 109.97 169.7 19.96 Favored Glycine 0 N--CA 1.493 2.443 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.87 -58.87 5.2 Favored 'General case' 0 C--N 1.306 -1.324 0 O-C-N 121.094 -1.239 . . . . 0.0 109.033 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.485 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 19.2 m-20 -104.98 29.44 6.32 Favored 'General case' 0 C--N 1.289 -2.043 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 178.582 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.511 ' HA ' ' O ' ' A' ' 77' ' ' GLU . 6.4 m 68.51 16.6 9.13 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.141 -0.975 . . . . 0.0 108.716 -179.306 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.443 ' C ' ' O ' ' A' ' 81' ' ' CYS . 83.2 tt0 -34.9 -32.92 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.328 0 O-C-N 121.739 -0.601 . . . . 0.0 111.763 -179.393 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.52 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.3 OUTLIER -104.35 -161.72 0.84 Allowed 'General case' 0 C--N 1.295 -1.786 0 CA-C-O 122.719 1.247 . . . . 0.0 109.379 -179.778 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.434 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 33.1 m -157.31 95.19 1.45 Allowed 'General case' 0 C--N 1.277 -2.583 0 CA-C-N 114.471 -1.241 . . . . 0.0 108.903 179.756 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.463 ' OG1' ' HA2' ' A' ' 75' ' ' GLY . 31.1 p -50.62 -35.7 31.67 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.321 -0.862 . . . . 0.0 110.234 -179.18 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.531 ' HG3' ' HA2' ' A' ' 75' ' ' GLY . 0.0 OUTLIER . . . . . 0 C--N 1.287 -2.144 0 CA-C-O 118.007 -0.996 . . . . 0.0 109.16 179.842 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.469 ' O ' ' CB ' ' A' ' 2' ' ' ASN . . . . . . . . 0 N--CA 1.489 1.497 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.504 ' CB ' OE12 ' A' ' 6' ' ' CGU . 4.6 m120 72.74 -164.68 0.11 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.278 -0.889 . . . . 0.0 109.634 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.526 ' OG ' HD12 ' A' ' 5' ' ' LEU . 13.4 t -86.64 156.5 19.98 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.257 -0.902 . . . . 0.0 109.769 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.552 ' C ' ' CD1' ' A' ' 4' ' ' PHE . 0.5 OUTLIER -69.21 -20.64 63.98 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.29 -0.881 . . . . 0.0 109.113 179.77 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.742 HD22 OE22 ' A' ' 26' ' ' CGU . 1.2 mt -65.64 -8.21 19.21 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.117 -0.989 . . . . 0.0 109.714 -179.591 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' CGU . . . . . 0.504 OE12 ' CB ' ' A' ' 2' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' CGU . . . . . 0.432 ' O ' ' C ' ' A' ' 8' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.895 HG22 ' H ' ' A' ' 10' ' ' GLN . 1.5 p -39.29 125.92 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.199 0 CA-C-O 123.461 1.601 . . . . 0.0 109.913 -178.732 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.452 ' O ' ' O ' ' A' ' 10' ' ' GLN . 0.9 OUTLIER -80.71 25.46 0.43 Allowed 'General case' 0 C--N 1.267 -2.998 0 CA-C-N 113.119 -1.855 . . . . 0.0 110.735 -179.754 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.895 ' H ' HG22 ' A' ' 8' ' ' VAL . 2.5 tm0? 61.11 144.33 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 O-C-N 120.751 -1.218 . . . . 0.0 109.702 179.677 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.446 ' O ' ' C ' ' A' ' 12' ' ' ASN . . . 134.26 -129.12 5.13 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.6 ' OD1' HG21 ' A' ' 30' ' ' VAL . 0.8 OUTLIER 40.35 41.46 1.03 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.145 -1.209 . . . . 0.0 110.085 179.875 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.537 ' O ' ' CD2' ' A' ' 14' ' ' CGU . 0.1 OUTLIER -129.76 -7.99 4.52 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.165 -0.959 . . . . 0.0 109.446 179.549 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 14' ' ' CGU . . . . . 0.537 ' CD2' ' O ' ' A' ' 13' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.75 ' O ' ' N ' ' A' ' 17' ' ' CYS . 20.7 mtm180 -84.65 95.96 9.06 Favored 'General case' 0 C--O 1.198 -1.625 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 177.544 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' CGU . . . . . 0.71 OE11 ' HB3' ' A' ' 27' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.75 ' N ' ' O ' ' A' ' 15' ' ' ARG . 84.7 m 32.1 35.71 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.059 0 CA-C-O 121.718 0.77 . . . . 0.0 109.546 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.547 ' N ' ' O ' ' A' ' 16' ' ' CGU . 0.2 OUTLIER -47.85 -22.5 0.57 Allowed 'General case' 0 N--CA 1.495 1.796 0 CA-C-O 121.491 0.662 . . . . 0.0 111.154 -178.705 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 20' ' ' CGU . . . . . 0.409 ' O ' ' C ' ' A' ' 21' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.419 ' C ' ' SG ' ' A' ' 22' ' ' CYS . . . -44.66 -49.67 10.24 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.206 -0.934 . . . . 0.0 109.544 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.419 ' SG ' ' C ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -152.22 -170.7 3.72 Favored 'General case' 0 C--N 1.29 -2.011 0 CA-C-O 121.52 0.676 . . . . 0.0 109.683 -179.816 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.667 ' C ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -102.34 24.55 10.12 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.913 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.672 HD22 ' N ' ' A' ' 24' ' ' LEU . 2.6 mm? 76.33 -11.88 1.1 Allowed 'General case' 0 N--CA 1.498 1.932 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.657 -179.699 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 26' ' ' CGU . . . . . 0.742 OE22 HD22 ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.71 ' HB3' OE11 ' A' ' 16' ' ' CGU . . . -80.83 41.26 0.56 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.842 -1.161 . . . . 0.0 110.605 -179.26 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 8.5 mtt180 -106.61 -58.41 1.93 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.735 -1.228 . . . . 0.0 109.589 179.592 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' CGU . . . . . 0.409 OE11 OE22 ' A' ' 29' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.6 HG21 ' OD1' ' A' ' 12' ' ' ASN . 2.8 p -79.52 -29.88 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.433 -0.792 . . . . 0.0 109.583 -179.62 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.522 ' CD1' HG12 ' A' ' 30' ' ' VAL . 42.9 m-85 -79.26 101.41 8.01 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.38 -0.825 . . . . 0.0 109.491 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' CGU . . . . . 0.508 ' C ' ' O ' ' A' ' 31' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.56 ' HB2' ' HB2' ' A' ' 36' ' ' GLN . 23.0 m-20 -61.4 83.56 0.01 OUTLIER 'General case' 0 C--O 1.191 -1.974 0 O-C-N 121.71 -0.618 . . . . 0.0 110.748 -179.641 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.495 ' HA ' ' OG1' ' A' ' 37' ' ' THR . . . -39.59 -27.38 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.95 0 O-C-N 120.886 -1.134 . . . . 0.0 110.185 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' CGU . . . . . 0.517 ' N ' ' O ' ' A' ' 33' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.744 ' O ' ' HB3' ' A' ' 40' ' ' PHE . 42.6 mt-30 -49.85 -46.42 51.36 Favored 'General case' 0 C--O 1.203 -1.359 0 N-CA-C 106.313 -1.736 . . . . 0.0 106.313 177.43 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.54 ' O ' ' HB3' ' A' ' 41' ' ' TRP . 1.4 m -35.94 -59.9 0.57 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.309 -0.869 . . . . 0.0 108.814 178.395 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.614 ' O ' ' C ' ' A' ' 39' ' ' CGU . 5.7 m-20 -81.96 -73.11 0.4 Allowed 'General case' 0 C--N 1.298 -1.664 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 177.206 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' CGU . . . . . 0.614 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.744 ' HB3' ' O ' ' A' ' 36' ' ' GLN . 7.7 t80 -40.1 -50.83 2.64 Favored 'General case' 0 C--N 1.292 -1.9 0 O-C-N 121.634 -0.666 . . . . 0.0 110.259 178.809 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.556 ' CZ2' ' HD3' ' A' ' 45' ' ' LYS . 26.4 t-105 -82.32 -72.59 0.43 Allowed 'General case' 0 C--N 1.294 -1.844 0 O-C-N 121.353 -0.842 . . . . 0.0 112.499 -176.911 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.497 ' O ' ' HG3' ' A' ' 45' ' ' LYS . 35.4 p -47.96 -63.53 1.04 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.64 -1.288 . . . . 0.0 110.632 -178.313 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.554 ' HB3' ' O ' ' A' ' 39' ' ' CGU . 3.7 tttm -52.32 -21.71 3.81 Favored 'General case' 0 C--N 1.291 -1.973 0 O-C-N 121.384 -0.822 . . . . 0.0 108.925 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.717 ' HB2' ' O ' ' A' ' 40' ' ' PHE . 25.2 t80 -80.19 -96.16 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 178.854 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.556 ' HD3' ' CZ2' ' A' ' 41' ' ' TRP . 4.4 mtmt 33.37 34.56 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.13 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -179.433 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.57 ' N ' ' O ' ' A' ' 44' ' ' TYR . 1.4 t70 -131.39 -21.71 2.54 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.804 -176.692 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.523 ' HA2' ' OH ' ' A' ' 44' ' ' TYR . . . 49.06 60.12 6.36 Favored Glycine 0 N--CA 1.492 2.418 0 N-CA-C 105.845 -2.902 . . . . 0.0 105.845 -177.03 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.429 ' C ' ' OE1' ' A' ' 49' ' ' GLN . 27.1 t0 -126.41 -129.87 0.24 Allowed 'General case' 0 C--N 1.307 -1.268 0 O-C-N 121.546 -0.973 . . . . 0.0 110.658 -176.743 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.599 ' CD ' ' N ' ' A' ' 49' ' ' GLN . 8.4 mp0 57.3 -86.12 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.333 -0.854 . . . . 0.0 110.445 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.559 ' HA ' ' CG ' ' A' ' 54' ' ' PRO . 4.6 t -98.2 -1.58 41.75 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.03 -1.044 . . . . 0.0 111.188 -178.684 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.469 ' HG3' ' O ' ' A' ' 51' ' ' GLU . 0.6 OUTLIER -55.47 -26.01 39.95 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 120.961 -1.087 . . . . 0.0 111.527 -179.078 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.434 ' O ' ' C ' ' A' ' 53' ' ' HIS . . . -86.13 28.22 5.22 Favored Glycine 0 N--CA 1.494 2.506 0 O-C-N 120.545 -1.347 . . . . 0.0 110.921 -178.795 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.6 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 3.4 t-160 41.68 53.2 7.24 Favored Pre-proline 0 N--CA 1.493 1.715 0 O-C-N 121.108 -1.231 . . . . 0.0 109.775 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.6 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 4.0 Cg_exo -56.77 -37.17 98.54 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 C-N-CA 122.562 2.175 . . . . 0.0 111.299 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.535 ' SG ' ' CB ' ' A' ' 61' ' ' CYS . 0.6 OUTLIER -89.43 168.29 12.32 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.371 -0.831 . . . . 0.0 110.19 -178.218 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.521 ' HA ' HD23 ' A' ' 56' ' ' LEU . 5.8 mt -146.13 -173.66 4.23 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 122.08 0.943 . . . . 0.0 110.562 -179.397 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.615 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 51.0 m-80 40.29 64.56 0.9 Allowed 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 122.038 0.923 . . . . 0.0 110.124 -179.684 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.437 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 2.2 mm-40 51.35 33.4 9.89 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-O 121.561 0.696 . . . . 0.0 109.835 177.393 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -81.41 127.3 7.84 Favored Glycine 0 N--CA 1.487 2.057 0 N-CA-C 109.174 -1.57 . . . . 0.0 109.174 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -78.97 168.01 20.3 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.115 -1.227 . . . . 0.0 107.951 179.402 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.535 ' CB ' ' SG ' ' A' ' 55' ' ' CYS . 0.5 OUTLIER -156.53 126.99 6.62 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 118.323 -1.351 . . . . 0.0 111.175 -178.878 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.8 mmtm -94.95 108.57 20.63 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 106.944 -1.502 . . . . 0.0 106.944 177.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' BHD . . . . . 0.554 ' CG ' ' HG2' ' A' ' 15' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.538 ' O ' ' O ' ' A' ' 67' ' ' ASP . . . 147.66 123.01 1.35 Allowed Glycine 0 N--CA 1.489 2.232 0 N-CA-C 108.221 -1.952 . . . . 0.0 108.221 -179.427 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.834 ' O ' HD12 ' A' ' 65' ' ' ILE . 2.2 pp -38.0 160.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.504 2.253 0 CA-C-N 118.935 1.367 . . . . 0.0 110.13 -178.209 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.537 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . 95.46 -47.55 1.92 Allowed Glycine 0 C--N 1.294 -1.759 0 N-CA-C 106.07 -2.812 . . . . 0.0 106.07 -177.868 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.538 ' O ' ' O ' ' A' ' 64' ' ' GLY . 14.7 p-10 169.69 -145.61 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 178.267 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.619 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 4.1 p90 -160.53 -167.16 1.81 Allowed 'General case' 0 C--N 1.298 -1.646 0 O-C-N 120.691 -1.256 . . . . 0.0 108.926 -179.427 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.476 ' O ' ' HA ' ' A' ' 61' ' ' CYS . 0.1 OUTLIER -147.99 152.08 36.86 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 178.675 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 61' ' ' CYS . 85.0 m -116.98 -170.16 1.78 Allowed 'General case' 0 C--N 1.302 -1.481 0 O-C-N 120.496 -1.378 . . . . 0.0 109.197 179.749 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 1.8 m -161.27 108.21 1.44 Allowed 'General case' 0 C--N 1.294 -1.829 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.523 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 89.2 m -80.16 138.29 36.86 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.96 -1.087 . . . . 0.0 109.213 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.931 ' HB3' ' CE1' ' A' ' 76' ' ' PHE . . . -72.43 -174.4 1.34 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.074 -1.016 . . . . 0.0 111.25 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -81.57 102.36 10.57 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-O 123.035 1.398 . . . . 0.0 108.185 178.239 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 120.37 18.0 4.24 Favored Glycine 0 C--N 1.267 -3.294 0 N-CA-C 109.213 -1.555 . . . . 0.0 109.213 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.931 ' CE1' ' HB3' ' A' ' 73' ' ' ALA . 4.2 m-85 -115.82 163.99 15.05 Favored 'General case' 0 C--N 1.294 -1.838 0 O-C-N 121.476 -1.014 . . . . 0.0 109.622 -178.38 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.485 ' HB3' ' HB2' ' A' ' 83' ' ' PHE . 1.9 tt0 -157.38 167.15 31.11 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.146 -0.971 . . . . 0.0 110.051 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 96.4 162.86 32.95 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.636 -1.386 . . . . 0.0 109.636 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 7.4 tptt -60.19 -33.74 72.64 Favored 'General case' 0 C--N 1.306 -1.306 0 O-C-N 121.249 -1.147 . . . . 0.0 109.727 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.5 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.2 OUTLIER -113.97 22.12 14.21 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.877 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.532 ' O ' ' ND2' ' A' ' 57' ' ' ASN . 5.0 m 70.34 7.02 6.05 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.035 -1.041 . . . . 0.0 108.85 -179.236 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.564 ' HA ' ' ND2' ' A' ' 57' ' ' ASN . 56.3 tt0 -37.6 -47.19 0.92 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.573 -0.704 . . . . 0.0 111.305 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.579 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.6 OUTLIER -82.96 83.63 7.74 Favored 'General case' 0 C--N 1.294 -1.811 0 O-C-N 121.136 -0.977 . . . . 0.0 110.55 -178.625 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.452 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 1.6 p -70.97 91.38 0.86 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.275 -0.891 . . . . 0.0 108.802 178.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 10.2 p -60.76 -14.97 24.72 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.311 -0.868 . . . . 0.0 110.014 -179.274 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.505 ' CD ' ' O ' ' A' ' 86' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.293 -1.852 0 CA-C-O 118.055 -0.974 . . . . 0.0 109.454 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.432 ' O ' ' O ' ' A' ' 2' ' ' ASN . . . . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.432 ' O ' ' O ' ' A' ' 1' ' ' ALA . 25.7 m120 59.38 156.32 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.242 -0.911 . . . . 0.0 109.253 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.488 ' HB3' ' O ' ' A' ' 8' ' ' VAL . 0.3 OUTLIER 46.87 39.05 6.82 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.101 -1.0 . . . . 0.0 108.73 -179.632 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.523 ' C ' ' CD1' ' A' ' 4' ' ' PHE . 0.0 OUTLIER -79.87 6.82 10.1 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.528 -0.733 . . . . 0.0 110.517 -179.351 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.585 ' HB2' HG13 ' A' ' 8' ' ' VAL . 40.9 mt -63.41 91.4 0.05 Allowed 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' CGU . . . . . 0.596 ' C ' ' CD2' ' A' ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' CGU . . . . . 0.596 ' CD2' ' C ' ' A' ' 6' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.595 HG23 ' O ' ' A' ' 8' ' ' VAL . 4.6 m -55.2 97.57 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 118.061 -1.455 . . . . 0.0 107.978 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.508 ' C ' ' O ' ' A' ' 8' ' ' VAL . 2.3 tptp -39.37 -31.57 0.09 Allowed 'General case' 0 C--N 1.29 -2.016 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 179.108 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.482 ' CG ' ' C ' ' A' ' 9' ' ' LYS . 0.9 OUTLIER 165.62 84.49 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 178.664 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.47 ' O ' ' CD2' ' A' ' 13' ' ' LEU . . . -120.27 -145.05 7.31 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.689 -1.364 . . . . 0.0 109.689 -179.746 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.805 ' C ' HD22 ' A' ' 13' ' ' LEU . 21.4 m-20 56.38 77.66 0.24 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.238 -1.154 . . . . 0.0 109.387 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.805 HD22 ' C ' ' A' ' 12' ' ' ASN . 3.4 mm? -134.04 7.52 3.71 Favored 'General case' 0 C--N 1.308 -1.229 0 O-C-N 121.168 -0.957 . . . . 0.0 109.901 -179.613 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' CGU . . . . . 0.534 ' C ' ' OB ' ' A' ' 63' ' ' BHD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.664 ' O ' ' N ' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -84.22 96.2 8.91 Favored 'General case' 0 C--O 1.197 -1.68 0 N-CA-C 105.338 -2.097 . . . . 0.0 105.338 177.618 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 16' ' ' CGU . . . . . 0.657 ' CD2' ' CZ ' ' A' ' 40' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.664 ' N ' ' O ' ' A' ' 15' ' ' ARG . 7.6 p 13.16 60.0 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.278 0 CA-C-O 122.106 0.955 . . . . 0.0 111.108 -178.657 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.643 HD21 ' HH ' ' A' ' 44' ' ' TYR . 0.2 OUTLIER -80.3 0.81 31.28 Favored 'General case' 0 C--N 1.289 -2.05 0 CA-C-O 121.346 0.593 . . . . 0.0 109.552 -179.38 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 19' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 20' ' ' CGU . . . . . 0.421 ' C ' ' N ' ' A' ' 22' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.444 ' O ' HD13 ' A' ' 5' ' ' LEU . . . -53.24 -19.82 3.52 Favored 'General case' 0 C--N 1.296 -1.73 0 O-C-N 121.63 -0.669 . . . . 0.0 110.014 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.567 ' HB2' HD11 ' A' ' 5' ' ' LEU . 0.0 OUTLIER 172.11 -29.4 0.0 OUTLIER 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.402 -0.811 . . . . 0.0 109.442 179.884 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.505 ' CB ' ' O ' ' A' ' 22' ' ' CYS . 1.7 m 77.11 -76.26 0.05 Allowed 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 -178.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.484 ' O ' ' CD1' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -162.47 24.56 0.1 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.216 -0.927 . . . . 0.0 108.829 179.189 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 25' ' ' CGU . . . . . 0.417 ' O ' ' HB2' ' A' ' 28' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' CGU . . . . . 0.853 OE11 HG23 ' A' ' 30' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.48 ' C ' ' O ' ' A' ' 26' ' ' CGU . . . -39.76 -27.89 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.13 -0.981 . . . . 0.0 109.565 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.523 ' N ' ' C ' ' A' ' 26' ' ' CGU . 0.0 OUTLIER -50.25 -70.81 0.08 Allowed 'General case' 0 C--N 1.303 -1.442 0 CA-C-O 121.968 0.889 . . . . 0.0 110.831 179.812 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 29' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.853 HG23 OE11 ' A' ' 26' ' ' CGU . 0.4 OUTLIER -79.17 -20.03 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 120.908 -1.12 . . . . 0.0 109.543 -179.662 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.691 ' CZ ' ' CZ ' ' A' ' 40' ' ' PHE . 88.6 m-85 -100.74 94.42 6.07 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.227 -0.921 . . . . 0.0 110.243 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' CGU . . . . . 0.462 OE12 ' HA ' ' A' ' 32' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.578 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 0.4 OUTLIER -39.7 136.55 1.01 Allowed 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 121.334 0.588 . . . . 0.0 111.078 -179.293 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.543 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -80.74 -35.88 32.78 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 179.062 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' CGU . . . . . 0.475 ' O ' ' HB3' ' A' ' 39' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.63 ' O ' ' HB2' ' A' ' 40' ' ' PHE . 55.2 mt-30 -55.07 -37.4 66.72 Favored 'General case' 0 C--O 1.204 -1.323 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 178.395 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.704 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -42.19 -60.61 1.4 Allowed 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 117.759 -1.577 . . . . 0.0 107.172 178.499 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.678 ' O ' ' C ' ' A' ' 39' ' ' CGU . 0.3 OUTLIER -81.62 -72.05 0.45 Allowed 'General case' 0 C--N 1.296 -1.753 0 O-C-N 120.844 -1.16 . . . . 0.0 109.693 177.357 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 39' ' ' CGU . . . . . 0.678 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.691 ' CZ ' ' CZ ' ' A' ' 31' ' ' PHE . 7.3 t80 -47.55 -56.99 5.96 Favored 'General case' 0 C--N 1.295 -1.761 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 178.228 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.704 ' CD1' ' O ' ' A' ' 37' ' ' THR . 9.1 m95 -77.36 -63.73 1.31 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.309 -0.869 . . . . 0.0 112.185 -179.504 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.523 ' OG ' ' N ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -42.43 -70.06 0.12 Allowed 'General case' 0 N--CA 1.499 2.008 0 O-C-N 120.843 -1.161 . . . . 0.0 112.517 -177.556 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.541 ' CG ' ' O ' ' A' ' 39' ' ' CGU . 0.1 OUTLIER -79.15 32.36 0.22 Allowed 'General case' 0 C--N 1.288 -2.081 0 O-C-N 121.482 -0.761 . . . . 0.0 110.543 -178.55 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.643 ' HH ' HD21 ' A' ' 18' ' ' LEU . 1.0 OUTLIER -80.91 33.9 0.34 Allowed 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.126 -0.984 . . . . 0.0 110.414 179.7 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.14 37.99 1.21 Allowed 'General case' 0 C--N 1.302 -1.459 0 O-C-N 120.557 -1.339 . . . . 0.0 107.702 178.569 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -126.58 -1.1 6.81 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.724 -0.61 . . . . 0.0 109.912 -178.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.543 ' O ' ' CB ' ' A' ' 48' ' ' ASP . . . 71.64 6.71 63.36 Favored Glycine 0 N--CA 1.495 2.579 0 N-CA-C 109.179 -1.569 . . . . 0.0 109.179 -179.195 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.642 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER 85.62 5.32 0.48 Allowed 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.743 -0.857 . . . . 0.0 109.907 179.746 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.715 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 36.3 mm-40 82.37 -47.52 0.18 Allowed 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.819 -0.55 . . . . 0.0 111.723 178.798 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 11.2 t -83.04 -0.44 48.96 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.946 -1.096 . . . . 0.0 109.757 -179.537 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.493 ' OE1' ' CA ' ' A' ' 47' ' ' GLY . 47.3 tt0 -74.81 148.2 40.53 Favored 'General case' 0 N--CA 1.484 1.257 0 O-C-N 121.09 -1.007 . . . . 0.0 108.425 179.339 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 91.65 0.07 73.07 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.38 -1.488 . . . . 0.0 109.38 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.452 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 0.8 OUTLIER 54.41 63.3 7.5 Favored Pre-proline 0 C--N 1.307 -1.263 0 O-C-N 121.225 -1.162 . . . . 0.0 109.762 179.39 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.452 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 4.6 Cg_exo -56.88 -38.48 95.8 Favored 'Trans proline' 0 C--N 1.309 -1.506 0 C-N-CA 122.448 2.099 . . . . 0.0 110.325 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.474 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 0.3 OUTLIER -86.37 169.59 12.78 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.365 -0.835 . . . . 0.0 109.59 -179.714 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.507 ' O ' ' HB2' ' A' ' 81' ' ' CYS . 4.8 mt -147.13 -174.52 4.53 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.31 -0.869 . . . . 0.0 109.594 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.598 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 1.4 m-80 41.56 63.2 1.33 Allowed 'General case' 0 C--N 1.301 -1.531 0 CA-C-O 121.778 0.799 . . . . 0.0 109.824 -179.633 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.452 ' HG3' ' C ' ' A' ' 57' ' ' ASN . 1.8 mt-30 45.84 35.92 2.56 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.372 -0.83 . . . . 0.0 109.374 177.757 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -80.38 151.78 33.3 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -79.36 166.03 22.5 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.276 -1.132 . . . . 0.0 108.895 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.474 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 37.7 t -139.36 128.03 23.22 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.06 -1.025 . . . . 0.0 110.212 -179.515 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.512 ' HB2' ' OG1' ' A' ' 69' ' ' THR . 9.1 mmmt -102.61 -175.29 2.78 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 106.332 -1.729 . . . . 0.0 106.332 177.693 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' BHD . . . . . 0.534 ' OB ' ' C ' ' A' ' 14' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.512 ' O ' ' O ' ' A' ' 67' ' ' ASP . . . 152.0 137.63 2.63 Favored Glycine 0 N--CA 1.488 2.119 0 N-CA-C 107.688 -2.165 . . . . 0.0 107.688 -179.184 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.498 HG22 ' N ' ' A' ' 66' ' ' GLY . 0.5 OUTLIER -46.15 -59.43 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.555 0 O-C-N 120.578 -1.542 . . . . 0.0 109.164 -179.128 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.498 ' N ' HG22 ' A' ' 65' ' ' ILE . . . -44.64 -38.2 5.4 Favored Glycine 0 N--CA 1.493 2.448 0 N-CA-C 110.552 -1.019 . . . . 0.0 110.552 -178.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.512 ' O ' ' O ' ' A' ' 64' ' ' GLY . 9.0 p-10 177.59 -147.7 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.172 -1.193 . . . . 0.0 110.555 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.715 ' CD1' ' HB3' ' A' ' 49' ' ' GLN . 1.7 p90 -156.86 -170.89 3.45 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.924 -1.11 . . . . 0.0 109.741 -179.424 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.512 ' OG1' ' HB2' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -160.62 112.9 1.96 Allowed 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.296 -0.877 . . . . 0.0 109.815 -179.739 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 35.6 m -80.42 -171.09 2.86 Favored 'General case' 0 C--N 1.296 -1.758 0 O-C-N 120.976 -1.077 . . . . 0.0 110.107 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.444 ' O ' ' SG ' ' A' ' 81' ' ' CYS . 0.2 OUTLIER -160.67 166.97 27.91 Favored 'General case' 0 C--N 1.288 -2.086 0 CA-C-N 115.362 -0.836 . . . . 0.0 108.779 179.927 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.534 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 90.4 m -128.96 125.59 37.78 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.025 -1.047 . . . . 0.0 109.269 179.589 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.9 ' HB3' ' CD1' ' A' ' 76' ' ' PHE . . . -51.0 179.95 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.017 -1.052 . . . . 0.0 110.552 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -80.95 102.27 10.02 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 123.119 1.437 . . . . 0.0 107.735 178.278 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLY . . . . . 0.485 ' CA ' ' OG1' ' A' ' 85' ' ' THR . . . 118.68 23.04 3.49 Favored Glycine 0 C--N 1.268 -3.218 0 N-CA-C 108.756 -1.738 . . . . 0.0 108.756 -178.516 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.9 ' CD1' ' HB3' ' A' ' 73' ' ' ALA . 8.7 m-85 -119.14 159.35 24.14 Favored 'General case' 0 C--N 1.294 -1.817 0 O-C-N 121.67 -0.9 . . . . 0.0 109.451 -178.167 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.477 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 0.2 OUTLIER -156.16 165.7 35.63 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 120.879 -1.138 . . . . 0.0 110.59 -179.06 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 101.77 165.52 27.12 Favored Glycine 0 N--CA 1.493 2.47 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -58.01 -39.51 78.48 Favored 'General case' 0 C--N 1.307 -1.263 0 O-C-N 121.13 -1.218 . . . . 0.0 109.404 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.489 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 3.8 m-20 -113.56 24.42 12.2 Favored 'General case' 0 C--N 1.291 -1.946 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 179.577 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.509 ' HB2' ' HB2' ' A' ' 57' ' ' ASN . 4.6 m 71.14 6.1 5.71 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 120.985 -1.072 . . . . 0.0 109.305 -179.848 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.462 ' C ' ' O ' ' A' ' 81' ' ' CYS . 15.0 tt0 -33.15 -46.81 0.17 Allowed 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.341 0.591 . . . . 0.0 111.579 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.613 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.2 OUTLIER -88.16 89.63 8.07 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.472 -0.767 . . . . 0.0 110.576 -178.517 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.486 ' N ' ' OD1' ' A' ' 57' ' ' ASN . 3.8 p -70.58 92.64 0.86 Allowed 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 178.588 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.485 ' OG1' ' CA ' ' A' ' 75' ' ' GLY . 16.6 p -42.87 -28.87 0.28 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.246 -0.909 . . . . 0.0 110.242 -178.819 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.593 ' CZ ' ' CB ' ' A' ' 86' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.289 -2.025 0 CA-C-O 118.029 -0.986 . . . . 0.0 109.526 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.512 ' O ' ' N ' ' A' ' 4' ' ' PHE . 36.8 m-20 59.02 -168.06 0.15 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.355 -0.841 . . . . 0.0 109.646 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.2 m -47.58 92.95 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.303 -0.873 . . . . 0.0 109.683 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.512 ' N ' ' O ' ' A' ' 2' ' ' ASN . 2.0 t80 -63.66 -44.76 92.85 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.222 -0.924 . . . . 0.0 109.124 179.738 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.71 HD22 ' CB ' ' A' ' 26' ' ' CGU . 0.1 OUTLIER -62.69 -148.48 0.0 OUTLIER 'General case' 0 C--N 1.303 -1.419 0 C-N-CA 118.624 -1.23 . . . . 0.0 108.403 179.595 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 6' ' ' CGU . . . . . 0.538 ' C ' ' O ' ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' CGU . . . . . 0.46 ' HG ' ' O ' ' A' ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.706 HG13 ' N ' ' A' ' 9' ' ' LYS . 2.9 p -81.16 -150.59 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 -179.532 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.706 ' N ' HG13 ' A' ' 8' ' ' VAL . 0.1 OUTLIER -82.21 24.79 0.64 Allowed 'General case' 0 C--N 1.293 -1.879 0 O-C-N 121.114 -0.991 . . . . 0.0 110.416 179.63 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.523 ' CB ' ' O ' ' A' ' 9' ' ' LYS . 0.0 OUTLIER 80.03 -11.73 1.13 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.071 -1.018 . . . . 0.0 109.705 -179.446 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -179.15 127.9 1.19 Allowed Glycine 0 N--CA 1.49 2.298 0 N-CA-C 108.994 -1.642 . . . . 0.0 108.994 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.648 ' HB3' ' CZ ' ' A' ' 31' ' ' PHE . 0.9 OUTLIER -110.45 159.47 17.46 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.112 -1.229 . . . . 0.0 109.619 -179.598 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 1.088 HD13 ' N ' ' A' ' 14' ' ' CGU . 2.6 tm? 178.89 146.08 0.16 Allowed 'General case' 0 C--N 1.313 -1.015 0 O-C-N 120.91 -1.118 . . . . 0.0 108.788 -179.669 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' CGU . . . . . 1.088 ' N ' HD13 ' A' ' 13' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.46 ' HB3' HD23 ' A' ' 18' ' ' LEU . 7.9 mtm-85 -85.19 99.64 11.23 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 104.23 -2.508 . . . . 0.0 104.23 175.121 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' CGU . . . . . 0.672 ' HG ' ' CD2' ' A' ' 31' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.553 ' CB ' ' O ' ' A' ' 16' ' ' CGU . 5.7 m 84.83 -59.46 0.09 Allowed 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.534 -0.729 . . . . 0.0 109.822 179.633 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.645 HD12 ' CB ' ' A' ' 48' ' ' ASP . 2.5 mm? 65.29 -86.84 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.508 0 CA-C-O 121.873 0.844 . . . . 0.0 110.254 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 20' ' ' CGU . . . . . 0.486 ' C ' ' N ' ' A' ' 22' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.434 ' O ' ' CB ' ' A' ' 22' ' ' CYS . . . -49.48 -21.22 0.88 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.074 -1.017 . . . . 0.0 109.351 179.52 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.486 ' N ' ' C ' ' A' ' 20' ' ' CGU . 0.0 OUTLIER 172.63 -22.76 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.705 0 O-C-N 121.612 -0.68 . . . . 0.0 109.465 179.703 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.501 ' O ' ' HB2' ' A' ' 27' ' ' ALA . 5.9 p 53.81 -147.04 0.51 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.004 -1.06 . . . . 0.0 110.23 179.052 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.628 ' HG ' ' CZ2' ' A' ' 41' ' ' TRP . 0.3 OUTLIER -79.03 7.84 6.67 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.389 -0.82 . . . . 0.0 110.063 -179.669 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' CGU . . . . . 0.423 ' HB3' ' O ' ' A' ' 22' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' CGU . . . . . 0.71 ' CB ' HD22 ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.58 ' O ' ' CD1' ' A' ' 31' ' ' PHE . . . -66.17 -77.16 0.07 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.522 -1.361 . . . . 0.0 109.331 179.798 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -64.92 -14.71 60.7 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.672 -1.268 . . . . 0.0 111.008 -179.085 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' CGU . . . . . 0.461 ' HB3' ' HA ' ' A' ' 26' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.61 HG12 ' CD1' ' A' ' 31' ' ' PHE . 1.2 t -94.23 0.32 10.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.044 -1.035 . . . . 0.0 109.678 -179.18 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.712 ' CE2' ' HA ' ' A' ' 13' ' ' LEU . 7.4 m-85 -110.13 132.11 54.46 Favored 'General case' 0 C--N 1.295 -1.771 0 O-C-N 121.1 -1.0 . . . . 0.0 113.32 -177.239 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' CGU . . . . . 0.484 OE21 ' HA ' ' A' ' 32' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.835 ' OD1' HD21 ' A' ' 13' ' ' LEU . 69.7 m-20 -39.54 98.79 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.215 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.325 -178.682 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.513 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -77.37 -29.68 53.4 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 177.556 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' CGU . . . . . 0.435 ' O ' ' C ' ' A' ' 36' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.672 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 22.4 mm-40 -48.21 -30.51 4.76 Favored 'General case' 0 C--O 1.202 -1.427 0 C-N-CA 118.245 -1.382 . . . . 0.0 108.753 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.66 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -47.14 -60.23 2.61 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 119.506 -1.996 . . . . 0.0 107.082 177.76 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.537 ' O ' ' C ' ' A' ' 39' ' ' CGU . 0.5 OUTLIER -82.18 -64.74 1.12 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.331 -0.856 . . . . 0.0 109.655 177.336 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 39' ' ' CGU . . . . . 0.537 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.672 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 19.8 t80 -43.7 -52.71 6.32 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 107.259 -1.386 . . . . 0.0 107.259 178.663 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.66 ' CD1' ' O ' ' A' ' 37' ' ' THR . 7.9 m95 -80.73 178.61 8.26 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 177.419 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.523 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 23.2 t 63.63 105.31 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.821 -1.175 . . . . 0.0 110.757 179.092 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.65 ' HD2' HG22 ' A' ' 65' ' ' ILE . 0.0 OUTLIER 79.21 14.17 1.1 Allowed 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.667 0.746 . . . . 0.0 108.988 179.514 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.529 ' CD1' ' O ' ' A' ' 44' ' ' TYR . 1.1 t80 -81.38 34.14 0.37 Allowed 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.417 -0.802 . . . . 0.0 110.208 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 2.1 mmmt -92.72 32.81 1.19 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 120.932 -1.105 . . . . 0.0 109.217 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -116.33 3.39 13.34 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.329 -0.857 . . . . 0.0 109.539 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.575 ' O ' ' CB ' ' A' ' 48' ' ' ASP . . . 88.4 -40.04 3.09 Favored Glycine 0 N--CA 1.494 2.547 0 N-CA-C 108.937 -1.665 . . . . 0.0 108.937 -179.418 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.645 ' CB ' HD12 ' A' ' 18' ' ' LEU . 5.5 p30 152.04 15.83 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.036 0 O-C-N 122.11 -0.641 . . . . 0.0 110.027 179.184 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.571 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 68.2 mm-40 69.72 -11.39 0.53 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.229 -0.919 . . . . 0.0 111.1 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.472 ' SG ' ' HD2' ' A' ' 54' ' ' PRO . 49.3 t -135.26 10.69 3.52 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 120.749 -1.22 . . . . 0.0 109.729 179.123 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.492 ' HB2' ' OD1' ' A' ' 48' ' ' ASP . 3.2 tt0 -58.58 -53.14 61.69 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.834 -1.166 . . . . 0.0 110.199 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.478 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . -68.37 -3.81 34.09 Favored Glycine 0 N--CA 1.492 2.426 0 C-N-CA 120.257 -0.973 . . . . 0.0 110.776 -179.043 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.478 ' HB3' ' O ' ' A' ' 52' ' ' GLY . 1.5 t-80 68.32 70.18 0.43 Allowed Pre-proline 0 N--CA 1.492 1.657 0 O-C-N 120.942 -1.328 . . . . 0.0 109.363 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.495 ' CB ' ' CE2' ' A' ' 68' ' ' TYR . 5.8 Cg_exo -60.29 -38.25 76.74 Favored 'Trans proline' 0 C--N 1.308 -1.568 0 C-N-CA 122.599 2.199 . . . . 0.0 111.35 -179.701 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.482 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 1.8 m -78.07 172.52 13.39 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.217 -0.927 . . . . 0.0 109.891 -178.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.5 mt -149.47 -173.41 4.39 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.061 -1.024 . . . . 0.0 110.373 -179.434 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.597 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 2.1 m-80 41.79 63.55 1.28 Allowed 'General case' 0 C--N 1.303 -1.452 0 CA-C-O 121.855 0.836 . . . . 0.0 110.132 -179.619 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.5 mm100 47.98 33.53 3.49 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.376 -0.828 . . . . 0.0 109.856 177.498 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -78.74 143.67 26.95 Favored Glycine 0 N--CA 1.488 2.105 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.479 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 68.6 m80 -78.84 123.33 27.11 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 179.037 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.482 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 41.2 t -101.12 113.46 26.51 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.187 -0.946 . . . . 0.0 111.507 -177.635 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.507 ' HB3' ' OG1' ' A' ' 69' ' ' THR . 0.1 OUTLIER -79.55 -169.05 1.76 Allowed 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 105.955 -1.869 . . . . 0.0 105.955 176.762 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 63' ' ' BHD . . . . . 0.414 ' HA ' ' CB ' ' A' ' 68' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.528 ' O ' ' CG ' ' A' ' 49' ' ' GLN . . . 140.93 174.68 14.2 Favored Glycine 0 N--CA 1.488 2.103 0 N-CA-C 107.479 -2.249 . . . . 0.0 107.479 -178.456 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.65 HG22 ' HD2' ' A' ' 43' ' ' LYS . 19.3 mm -93.63 -61.6 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 120.609 -1.524 . . . . 0.0 109.8 -179.905 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.492 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . -47.63 -25.0 3.08 Favored Glycine 0 N--CA 1.488 2.111 0 N-CA-C 108.645 -1.782 . . . . 0.0 108.645 179.446 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.492 ' HB3' ' O ' ' A' ' 66' ' ' GLY . 3.3 p-10 176.78 -149.36 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.645 -0.915 . . . . 0.0 109.69 179.255 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.641 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 4.3 p90 -160.31 -167.09 1.82 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.37 -0.831 . . . . 0.0 109.248 -179.065 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.507 ' OG1' ' HB3' ' A' ' 62' ' ' LYS . 0.1 OUTLIER -144.96 171.63 14.18 Favored 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 178.651 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 20.6 m -136.27 -174.5 3.7 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 120.843 -1.161 . . . . 0.0 108.313 179.253 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.479 ' HB ' ' HB2' ' A' ' 60' ' ' HIS . 0.2 OUTLIER -160.54 150.85 18.1 Favored 'General case' 0 C--N 1.292 -1.909 0 O-C-N 121.518 -0.739 . . . . 0.0 109.249 179.478 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.53 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 88.3 m -120.95 124.86 45.94 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.114 -0.991 . . . . 0.0 109.133 179.712 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.868 ' HB3' ' CE1' ' A' ' 76' ' ' PHE . . . -57.13 -179.81 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.019 -1.051 . . . . 0.0 111.103 -179.27 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.26 100.97 6.04 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 123.425 1.583 . . . . 0.0 108.702 178.633 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLY . . . . . 0.487 ' HA2' ' OG1' ' A' ' 85' ' ' THR . . . 119.5 20.42 3.91 Favored Glycine 0 C--N 1.266 -3.309 0 CA-C-N 113.21 -1.814 . . . . 0.0 108.834 -178.672 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.868 ' CE1' ' HB3' ' A' ' 73' ' ' ALA . 6.5 m-85 -117.51 158.03 25.26 Favored 'General case' 0 C--N 1.296 -1.749 0 O-C-N 121.61 -0.935 . . . . 0.0 109.89 -178.036 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.607 ' HG2' HG23 ' A' ' 85' ' ' THR . 0.9 OUTLIER -160.08 163.33 33.97 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.18 -0.95 . . . . 0.0 110.487 -179.505 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 108.23 166.33 21.24 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.14 -39.42 72.24 Favored 'General case' 0 C--N 1.308 -1.216 0 O-C-N 121.167 -1.196 . . . . 0.0 109.17 179.716 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.514 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 70.8 m-20 -119.03 29.5 7.66 Favored 'General case' 0 C--N 1.292 -1.933 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 179.315 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.521 ' HB2' ' HB2' ' A' ' 57' ' ' ASN . 6.8 m 68.41 10.73 8.03 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.035 -1.041 . . . . 0.0 108.575 -179.13 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.461 ' C ' ' O ' ' A' ' 81' ' ' CYS . 22.1 tt0 -29.47 -45.45 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 121.186 0.517 . . . . 0.0 112.232 -179.543 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.468 ' HB2' ' HG3' ' A' ' 77' ' ' GLU . 0.4 OUTLIER -101.41 -161.06 0.83 Allowed 'General case' 0 C--N 1.294 -1.832 0 CA-C-O 122.84 1.305 . . . . 0.0 109.834 -178.895 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.416 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 1.5 p -147.94 115.04 6.16 Favored 'General case' 0 C--N 1.278 -2.518 0 CA-C-N 114.23 -1.35 . . . . 0.0 108.877 179.713 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.607 HG23 ' HG2' ' A' ' 77' ' ' GLU . 18.2 p -63.44 -18.24 63.54 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.128 -0.983 . . . . 0.0 109.729 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.1 ptt180 . . . . . 0 C--N 1.293 -1.87 0 CA-C-O 118.01 -0.995 . . . . 0.0 109.504 -179.987 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.457 ' O ' ' HB2' ' A' ' 2' ' ' ASN . . . . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.457 ' HB2' ' O ' ' A' ' 1' ' ' ALA . 0.5 OUTLIER 71.04 22.21 4.61 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.264 -0.897 . . . . 0.0 109.42 -179.891 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 88.1 p -146.49 74.17 1.35 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.243 -0.91 . . . . 0.0 109.467 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.506 ' C ' ' CD1' ' A' ' 4' ' ' PHE . 0.1 OUTLIER -80.6 24.49 0.47 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.261 -0.9 . . . . 0.0 110.749 -179.701 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.498 ' O ' HG13 ' A' ' 8' ' ' VAL . 0.1 OUTLIER -64.66 -36.31 83.86 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.72 -1.237 . . . . 0.0 109.362 -179.91 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 6' ' ' CGU . . . . . 0.469 OE12 ' HB3' ' A' ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' CGU . . . . . 0.469 ' HB3' OE12 ' A' ' 6' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.771 HG23 ' O ' ' A' ' 8' ' ' VAL . 4.2 m -39.72 99.95 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 CA-C-O 122.644 1.212 . . . . 0.0 109.424 -179.405 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.465 ' O ' ' HB3' ' A' ' 10' ' ' GLN . 3.5 tmtt? -39.89 -27.44 0.04 OUTLIER 'General case' 0 C--N 1.287 -2.147 0 CA-C-N 115.177 -0.92 . . . . 0.0 109.768 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.472 ' N ' ' O ' ' A' ' 8' ' ' VAL . 27.1 tt0 61.73 119.25 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.088 -1.007 . . . . 0.0 109.219 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 178.41 -75.29 0.07 OUTLIER Glycine 0 N--CA 1.492 2.39 0 N-CA-C 110.003 -1.239 . . . . 0.0 110.003 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.458 ' OD1' ' HD2' ' A' ' 15' ' ' ARG . 1.0 OUTLIER -102.93 163.85 11.96 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.201 -1.176 . . . . 0.0 109.401 -179.781 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.792 HD23 ' CD1' ' A' ' 31' ' ' PHE . 4.3 mp -80.33 -125.85 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.23 0 O-C-N 121.099 -1.0 . . . . 0.0 109.747 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' CGU . . . . . 0.753 OE21 HD23 ' A' ' 18' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.55 ' NE ' ' HB3' ' A' ' 62' ' ' LYS . 82.5 mtt180 -46.32 -33.64 3.94 Favored 'General case' 0 N--CA 1.487 1.408 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.561 ' HA ' ' HB3' ' A' ' 22' ' ' CYS . 1.7 m -93.73 33.28 1.31 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.088 -1.008 . . . . 0.0 110.194 -179.662 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 1.043 HD13 ' O ' ' A' ' 18' ' ' LEU . 2.8 tm? -80.51 -16.29 54.63 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-O 121.943 0.878 . . . . 0.0 108.709 178.916 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 20' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -79.41 -0.69 33.93 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.161 -0.962 . . . . 0.0 109.918 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.561 ' HB3' ' HA ' ' A' ' 17' ' ' CYS . 7.0 t 179.33 158.87 0.64 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.116 -0.99 . . . . 0.0 109.259 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.538 ' O ' ' CB ' ' A' ' 17' ' ' CYS . 3.1 m -99.62 -161.5 0.88 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.964 -1.085 . . . . 0.0 110.721 -178.461 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.915 HD12 ' CZ3' ' A' ' 41' ' ' TRP . 3.9 mm? -94.27 -41.77 9.28 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.541 -0.724 . . . . 0.0 109.5 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 26' ' ' CGU . . . . . 0.523 ' CD2' ' C ' ' A' ' 26' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.652 ' O ' ' CE1' ' A' ' 31' ' ' PHE . . . -57.03 -43.21 81.66 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.005 -1.059 . . . . 0.0 109.408 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.449 ' CG ' HH11 ' A' ' 28' ' ' ARG . 0.0 OUTLIER -65.77 -22.5 66.59 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.658 -1.277 . . . . 0.0 109.752 -179.908 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 29' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 53.3 t -80.77 -41.2 19.62 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 O-C-N 121.542 -0.724 . . . . 0.0 109.964 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.792 ' CD1' HD23 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -114.35 118.94 35.3 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.848 -1.158 . . . . 0.0 110.38 179.947 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' CGU . . . . . 0.46 ' O ' ' C ' ' A' ' 33' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.566 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 0.8 OUTLIER -39.46 126.02 1.77 Allowed 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.636 -0.665 . . . . 0.0 110.442 -178.609 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.522 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -80.32 -34.77 36.45 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 179.858 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.683 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 3.4 mm100 -53.18 -38.25 62.65 Favored 'General case' 0 C--O 1.203 -1.37 0 C-N-CA 118.369 -1.332 . . . . 0.0 107.834 178.36 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.688 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -40.28 -59.82 1.21 Allowed 'General case' 0 N--CA 1.502 2.133 0 O-C-N 120.203 -1.561 . . . . 0.0 107.787 178.812 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.634 ' O ' ' C ' ' A' ' 39' ' ' CGU . 0.5 OUTLIER -80.82 -67.71 0.75 Allowed 'General case' 0 C--N 1.297 -1.714 0 O-C-N 120.969 -1.082 . . . . 0.0 109.46 177.847 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 39' ' ' CGU . . . . . 0.634 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.683 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 14.9 t80 -39.9 -51.28 2.47 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 178.278 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.915 ' CZ3' HD12 ' A' ' 24' ' ' LEU . 10.2 m95 -81.22 -68.78 0.66 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.933 -1.104 . . . . 0.0 112.427 -179.156 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.527 ' O ' ' CG ' ' A' ' 45' ' ' LYS . 0.3 OUTLIER -49.16 -53.25 21.94 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.65 -1.281 . . . . 0.0 111.476 -177.377 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.545 ' HG2' ' HB ' ' A' ' 65' ' ' ILE . 0.4 OUTLIER -62.74 -27.35 69.21 Favored 'General case' 0 C--N 1.283 -2.3 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 179.793 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.612 ' CA ' HG21 ' A' ' 65' ' ' ILE . 25.4 t80 -81.35 -95.63 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.381 0 O-C-N 121.425 -0.797 . . . . 0.0 108.857 179.368 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.556 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.0 OUTLIER 29.32 38.2 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.365 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 -178.782 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.601 ' N ' ' O ' ' A' ' 44' ' ' TYR . 19.7 t0 -127.91 -18.89 4.13 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.672 -176.44 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.472 ' HA2' ' OH ' ' A' ' 44' ' ' TYR . . . 49.73 49.36 34.52 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 105.897 -2.881 . . . . 0.0 105.897 -177.338 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.502 ' O ' ' C ' ' A' ' 49' ' ' GLN . 15.1 t0 -117.31 -138.18 0.36 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 122.089 -0.653 . . . . 0.0 110.625 -177.245 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.64 ' O ' ' CB ' ' A' ' 50' ' ' CYS . 7.3 mt-30 24.0 80.15 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.893 0 CA-C-O 121.617 0.722 . . . . 0.0 111.487 -179.654 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.64 ' CB ' ' O ' ' A' ' 49' ' ' GLN . 50.5 t 112.8 -30.59 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 115.279 -0.873 . . . . 0.0 108.863 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.457 ' CB ' ' O ' ' A' ' 47' ' ' GLY . 1.4 tm-20 -61.47 -53.17 59.95 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.359 -0.838 . . . . 0.0 109.985 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.56 ' O ' ' CB ' ' A' ' 53' ' ' HIS . . . -61.28 -9.61 17.25 Favored Glycine 0 N--CA 1.493 2.474 0 N-CA-C 110.035 -1.226 . . . . 0.0 110.035 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.703 ' CE1' HD23 ' A' ' 56' ' ' LEU . 1.0 OUTLIER 80.74 53.73 0.1 Allowed Pre-proline 0 N--CA 1.486 1.355 0 O-C-N 121.372 -1.076 . . . . 0.0 110.193 179.563 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.548 ' CD ' ' N ' ' A' ' 53' ' ' HIS . 3.4 Cg_exo -57.91 -38.16 93.41 Favored 'Trans proline' 0 C--N 1.312 -1.377 0 C-N-CA 122.457 2.105 . . . . 0.0 109.731 178.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.45 ' O ' ' ND1' ' A' ' 53' ' ' HIS . 1.6 m -96.1 174.29 6.99 Favored 'General case' 0 C--N 1.298 -1.657 0 CA-C-O 121.157 0.503 . . . . 0.0 109.844 -178.669 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.703 HD23 ' CE1' ' A' ' 53' ' ' HIS . 5.1 mt -149.6 -174.78 4.78 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.114 -0.991 . . . . 0.0 110.309 -179.568 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.624 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 4.2 m-20 45.54 62.18 2.29 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-O 121.769 0.795 . . . . 0.0 109.929 -179.578 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.45 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 1.8 mm100 49.94 28.04 2.68 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.55 -0.719 . . . . 0.0 110.653 177.193 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -65.57 132.77 35.2 Favored Glycine 0 N--CA 1.489 2.201 0 N-CA-C 109.012 -1.635 . . . . 0.0 109.012 179.555 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 57.7 t60 -79.07 136.28 37.12 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.106 -1.232 . . . . 0.0 108.288 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 70' ' ' CYS . 1.1 p -120.52 150.85 40.19 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 120.969 -1.082 . . . . 0.0 111.344 -178.373 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.55 ' HB3' ' NE ' ' A' ' 15' ' ' ARG . 8.3 mttp -124.11 97.16 5.22 Favored 'General case' 0 C--N 1.299 -1.614 0 N-CA-C 105.364 -2.087 . . . . 0.0 105.364 177.037 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' BHD . . . . . 0.525 ' N ' ' HG2' ' A' ' 15' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.521 ' O ' ' O ' ' A' ' 65' ' ' ILE . . . 162.14 114.54 0.33 Allowed Glycine 0 N--CA 1.483 1.797 0 N-CA-C 107.031 -2.428 . . . . 0.0 107.031 -179.583 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.824 ' O ' HD12 ' A' ' 65' ' ' ILE . 2.4 pp -35.63 154.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 CA-C-N 118.322 1.061 . . . . 0.0 110.016 -177.819 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.499 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . 103.47 -44.42 1.49 Allowed Glycine 0 N--CA 1.483 1.812 0 N-CA-C 104.432 -3.467 . . . . 0.0 104.432 -176.104 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.499 ' HB3' ' O ' ' A' ' 66' ' ' GLY . 5.2 p-10 171.81 -152.35 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 176.508 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.61 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 6.4 p90 -158.43 115.05 2.79 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 -179.359 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.502 ' OG1' ' HB2' ' A' ' 62' ' ' LYS . 76.8 p -79.67 115.11 19.1 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 120.659 -1.275 . . . . 0.0 109.438 -178.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 61' ' ' CYS . 0.0 OUTLIER -103.12 -172.54 2.13 Favored 'General case' 0 C--N 1.304 -1.384 0 O-C-N 121.195 -0.94 . . . . 0.0 109.303 179.814 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 7.8 m -162.03 131.4 4.49 Favored 'General case' 0 C--N 1.291 -1.976 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 179.339 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.537 ' HB3' ' CB ' ' A' ' 76' ' ' PHE . 94.1 m -82.05 116.49 21.67 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.832 -1.167 . . . . 0.0 108.569 179.152 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.887 ' HB3' ' CD1' ' A' ' 76' ' ' PHE . . . -43.67 172.56 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.014 -1.054 . . . . 0.0 111.319 -179.075 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.02 100.41 3.57 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-O 123.583 1.659 . . . . 0.0 108.586 178.625 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLY . . . . . 0.552 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 118.96 28.96 1.92 Allowed Glycine 0 C--N 1.264 -3.47 0 N-CA-C 108.066 -2.013 . . . . 0.0 108.066 -178.284 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.887 ' CD1' ' HB3' ' A' ' 73' ' ' ALA . 17.7 m-85 -128.0 148.78 50.54 Favored 'General case' 0 C--N 1.296 -1.759 0 O-C-N 121.833 -0.804 . . . . 0.0 110.367 -178.218 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.757 ' HB2' HG23 ' A' ' 85' ' ' THR . 0.7 OUTLIER -152.58 166.55 31.69 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.252 -0.905 . . . . 0.0 110.514 -179.73 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 109.24 163.97 20.15 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.476 -1.45 . . . . 0.0 109.476 179.599 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.6 tptt -57.84 -33.61 68.83 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.113 -1.228 . . . . 0.0 109.106 179.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.506 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.4 OUTLIER -121.9 27.76 7.93 Favored 'General case' 0 C--N 1.291 -1.963 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 179.644 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.515 ' O ' ' HB2' ' A' ' 57' ' ' ASN . 4.7 m 62.53 14.24 6.87 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 -178.453 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.448 ' C ' ' O ' ' A' ' 81' ' ' CYS . 45.9 tt0 -33.54 -36.94 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.323 0 O-C-N 121.666 -0.646 . . . . 0.0 111.923 -179.101 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.623 ' O ' ' ND2' ' A' ' 57' ' ' ASN . 1.3 m-85 -106.19 -166.49 1.2 Allowed 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 122.809 1.29 . . . . 0.0 109.492 -179.309 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.498 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 0.7 OUTLIER -138.82 107.27 5.83 Favored 'General case' 0 C--N 1.275 -2.659 0 CA-C-N 114.415 -1.266 . . . . 0.0 109.113 -179.871 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.757 HG23 ' HB2' ' A' ' 77' ' ' GLU . 2.4 p -62.36 96.49 0.08 Allowed 'General case' 0 C--N 1.302 -1.464 0 O-C-N 120.913 -1.117 . . . . 0.0 110.032 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.527 ' HG2' ' NH1' ' A' ' 86' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.294 -1.829 0 CA-C-O 118.052 -0.975 . . . . 0.0 110.099 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.424 ' O ' ' C ' ' A' ' 2' ' ' ASN . . . . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.424 ' C ' ' O ' ' A' ' 1' ' ' ALA . 0.9 OUTLIER 44.07 54.13 6.1 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.242 -0.911 . . . . 0.0 109.461 -179.996 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.481 ' O ' ' CD2' ' A' ' 6' ' ' CGU . 0.6 OUTLIER -86.42 125.23 33.54 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.308 -0.87 . . . . 0.0 109.699 -179.896 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.537 ' CZ ' OE21 ' A' ' 26' ' ' CGU . 0.0 OUTLIER -72.63 -20.13 61.33 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.304 -0.873 . . . . 0.0 108.901 179.693 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.859 ' O ' HG13 ' A' ' 8' ' ' VAL . 0.1 OUTLIER -75.5 -10.77 59.74 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.238 -0.914 . . . . 0.0 109.442 179.924 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 6' ' ' CGU . . . . . 0.519 ' CD1' ' C ' ' A' ' 6' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' CGU . . . . . 0.484 ' O ' ' N ' ' A' ' 9' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.859 HG13 ' O ' ' A' ' 5' ' ' LEU . 5.5 m -42.79 98.83 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.306 -1.299 0 CA-C-O 122.528 1.156 . . . . 0.0 109.488 -179.679 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.492 ' O ' ' HB3' ' A' ' 10' ' ' GLN . 0.8 OUTLIER -41.53 -27.29 0.09 Allowed 'General case' 0 C--N 1.286 -2.192 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.251 179.935 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.492 ' HB3' ' O ' ' A' ' 9' ' ' LYS . 15.9 tt0 67.54 77.41 0.26 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.515 -0.741 . . . . 0.0 110.006 179.531 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.427 ' O ' ' CG ' ' A' ' 12' ' ' ASN . . . 128.71 94.34 0.78 Allowed Glycine 0 N--CA 1.49 2.286 0 N-CA-C 110.003 -1.239 . . . . 0.0 110.003 179.602 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.72 ' O ' HG21 ' A' ' 30' ' ' VAL . 1.0 OUTLIER 174.84 142.17 0.05 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.253 -1.145 . . . . 0.0 109.169 179.47 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.51 HD12 ' N ' ' A' ' 13' ' ' LEU . 4.8 mp -109.07 -146.69 0.41 Allowed 'General case' 0 N--CA 1.478 0.93 0 O-C-N 120.576 -1.327 . . . . 0.0 110.725 -179.134 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' CGU . . . . . 0.502 OE12 ' O ' ' A' ' 48' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.3 mtp180 -66.79 -43.23 84.46 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' CGU . . . . . 0.583 ' CB ' ' HB3' ' A' ' 12' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.831 ' O ' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -53.02 -50.95 63.19 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.535 -0.728 . . . . 0.0 109.29 -179.559 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.619 ' C ' HD12 ' A' ' 18' ' ' LEU . 0.3 OUTLIER 57.68 -88.79 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.394 -0.816 . . . . 0.0 109.998 179.864 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 19' ' ' CGU . . . . . 0.504 ' O ' ' SG ' ' A' ' 22' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.831 ' HB3' ' O ' ' A' ' 17' ' ' CYS . . . -63.8 -16.13 60.48 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.36 -0.837 . . . . 0.0 109.172 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.517 ' HB3' ' HB2' ' A' ' 17' ' ' CYS . 1.0 OUTLIER -113.37 173.98 6.14 Favored 'General case' 0 N--CA 1.496 1.827 0 C-N-CA 119.656 -0.818 . . . . 0.0 109.412 179.281 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.614 ' O ' ' HB2' ' A' ' 24' ' ' LEU . 29.7 t -121.84 14.33 10.8 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.227 -0.92 . . . . 0.0 109.461 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.702 HD22 ' N ' ' A' ' 24' ' ' LEU . 3.5 mm? 78.43 -37.97 0.23 Allowed 'General case' 0 N--CA 1.503 2.195 0 O-C-N 122.162 -0.336 . . . . 0.0 110.61 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 26' ' ' CGU . . . . . 0.537 OE21 ' CZ ' ' A' ' 4' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.664 ' O ' HG12 ' A' ' 30' ' ' VAL . . . -62.75 -43.28 99.21 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.189 -0.944 . . . . 0.0 109.626 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.44 ' CG ' HH11 ' A' ' 28' ' ' ARG . 0.0 OUTLIER -57.19 -53.0 63.02 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-O 122.309 1.052 . . . . 0.0 110.105 -179.568 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 29' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.72 HG21 ' O ' ' A' ' 12' ' ' ASN . 0.3 OUTLIER -87.72 -41.0 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 120.935 -1.103 . . . . 0.0 110.763 -178.896 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.648 ' CE2' ' CE2' ' A' ' 40' ' ' PHE . 0.1 OUTLIER -135.8 124.16 23.34 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.474 -1.391 . . . . 0.0 111.626 -179.784 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 32' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.574 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 6.8 m-20 -39.35 127.49 1.81 Allowed 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.662 -0.649 . . . . 0.0 111.417 -177.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.507 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -80.71 -30.02 36.37 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 178.582 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' CGU . . . . . 0.401 ' O ' ' C ' ' A' ' 36' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.662 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 11.1 mm100 -50.01 -41.37 47.03 Favored 'General case' 0 C--O 1.203 -1.37 0 C-N-CA 118.802 -1.159 . . . . 0.0 108.01 178.347 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.64 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.1 OUTLIER -40.88 -59.1 1.51 Allowed 'General case' 0 N--CA 1.498 1.943 0 C-N-CA 118.23 -1.388 . . . . 0.0 108.631 179.31 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.595 ' O ' ' C ' ' A' ' 39' ' ' CGU . 0.8 OUTLIER -80.95 -65.91 0.95 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.043 -1.036 . . . . 0.0 110.196 178.796 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 39' ' ' CGU . . . . . 0.595 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.662 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 10.0 t80 -39.9 -50.01 2.45 Favored 'General case' 0 C--N 1.296 -1.758 0 O-C-N 121.956 -0.465 . . . . 0.0 109.928 178.363 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.64 ' CD1' ' O ' ' A' ' 37' ' ' THR . 9.4 m95 -81.3 -69.32 0.62 Allowed 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.522 -0.736 . . . . 0.0 112.802 -178.759 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.489 ' OG ' ' N ' ' A' ' 43' ' ' LYS . 0.1 OUTLIER -42.89 -73.74 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.026 0 O-C-N 120.831 -1.168 . . . . 0.0 112.646 -176.906 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.55 ' HD2' ' CG2' ' A' ' 65' ' ' ILE . 1.4 ptpt -78.2 31.88 0.18 Allowed 'General case' 0 C--N 1.287 -2.113 0 O-C-N 121.649 -0.657 . . . . 0.0 110.57 -178.509 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.59 ' HB2' ' O ' ' A' ' 40' ' ' PHE . 0.8 OUTLIER -80.26 23.37 0.49 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.014 -1.054 . . . . 0.0 110.693 179.747 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -90.21 31.92 0.97 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 120.776 -1.202 . . . . 0.0 108.619 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.52 ' OD2' ' NE2' ' A' ' 49' ' ' GLN . 1.6 t0 -111.12 4.12 19.09 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.464 -0.773 . . . . 0.0 109.827 -179.235 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.546 ' O ' ' CB ' ' A' ' 48' ' ' ASP . . . 69.42 16.13 71.17 Favored Glycine 0 N--CA 1.492 2.395 0 N-CA-C 108.577 -1.809 . . . . 0.0 108.577 -179.086 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.584 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER 83.58 7.96 0.64 Allowed 'General case' 0 N--CA 1.501 2.106 0 O-C-N 121.779 -0.836 . . . . 0.0 109.527 -179.815 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.631 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 33.7 mm-40 72.33 -21.91 0.22 Allowed 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.462 -0.774 . . . . 0.0 111.838 179.273 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.497 ' O ' ' HD3' ' A' ' 54' ' ' PRO . 25.1 t -105.97 -20.05 13.55 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.426 -1.421 . . . . 0.0 109.436 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.486 ' HB2' ' O ' ' A' ' 47' ' ' GLY . 72.5 tt0 -49.83 136.45 17.97 Favored 'General case' 0 N--CA 1.485 1.281 0 O-C-N 121.088 -1.007 . . . . 0.0 109.073 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 100.0 -11.9 60.59 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 110.094 -1.203 . . . . 0.0 110.094 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.425 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 1.9 t-80 60.82 65.74 1.96 Allowed Pre-proline 0 N--CA 1.491 1.582 0 O-C-N 121.088 -1.242 . . . . 0.0 109.436 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.497 ' HD3' ' O ' ' A' ' 50' ' ' CYS . 5.7 Cg_exo -58.86 -38.57 87.78 Favored 'Trans proline' 0 C--N 1.308 -1.558 0 C-N-CA 122.415 2.077 . . . . 0.0 110.751 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.466 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 1.8 m -72.4 172.45 10.39 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.353 -0.842 . . . . 0.0 109.233 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.487 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 4.7 mt -144.88 -174.99 4.5 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.238 -0.914 . . . . 0.0 109.934 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.614 ' O ' ' CD2' ' A' ' 76' ' ' PHE . 4.0 m-20 44.76 61.9 2.29 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-O 121.666 0.746 . . . . 0.0 109.538 -179.857 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.455 ' HG3' ' C ' ' A' ' 57' ' ' ASN . 1.4 mt-30 45.18 33.84 1.24 Allowed 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.232 -0.917 . . . . 0.0 109.387 177.868 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -80.27 152.28 34.12 Favored Glycine 0 N--CA 1.489 2.182 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.467 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 0.0 OUTLIER -79.85 169.31 18.1 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.337 -1.096 . . . . 0.0 108.631 179.502 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.466 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 19.2 t -140.72 125.87 18.51 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.024 -1.047 . . . . 0.0 110.125 -179.389 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.529 ' O ' ' HB2' ' A' ' 68' ' ' TYR . 0.1 OUTLIER -109.12 -175.95 2.9 Favored 'General case' 0 N--CA 1.486 1.375 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 178.148 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 63' ' ' BHD . . . . . 0.453 ' OD1' OE12 ' A' ' 14' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.557 ' O ' ' N ' ' A' ' 66' ' ' GLY . . . 144.5 41.97 0.05 OUTLIER Glycine 0 N--CA 1.49 2.262 0 N-CA-C 110.026 -1.23 . . . . 0.0 110.026 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.698 HG22 ' N ' ' A' ' 66' ' ' GLY . 2.2 mm 47.67 -86.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 121.432 -1.04 . . . . 0.0 110.081 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.698 ' N ' HG22 ' A' ' 65' ' ' ILE . . . -31.26 -38.24 0.03 OUTLIER Glycine 0 N--CA 1.5 2.938 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.517 ' N ' ' O ' ' A' ' 65' ' ' ILE . 5.0 p-10 -175.29 -150.42 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.393 -1.063 . . . . 0.0 109.549 178.722 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.644 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 1.8 p90 -160.38 139.16 10.43 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.198 -0.939 . . . . 0.0 109.606 -178.755 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.494 ' O ' ' HD3' ' A' ' 62' ' ' LYS . 50.1 p -104.64 120.14 40.63 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.11 -0.994 . . . . 0.0 109.341 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 6.9 m -79.33 -166.64 0.99 Allowed 'General case' 0 C--N 1.303 -1.419 0 O-C-N 120.663 -1.273 . . . . 0.0 108.82 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.467 ' HB ' ' HB2' ' A' ' 60' ' ' HIS . 4.7 m -160.37 159.3 30.97 Favored 'General case' 0 C--N 1.288 -2.084 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.55 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 87.2 m -125.65 123.04 38.1 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.026 -1.046 . . . . 0.0 109.484 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.835 ' HB3' ' CD1' ' A' ' 76' ' ' PHE . . . -50.34 -176.15 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.073 -1.017 . . . . 0.0 110.757 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -81.03 102.11 9.98 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-O 123.067 1.413 . . . . 0.0 107.869 178.344 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLY . . . . . 0.495 ' HA2' ' OG1' ' A' ' 85' ' ' THR . . . 117.37 21.21 4.47 Favored Glycine 0 C--N 1.267 -3.283 0 N-CA-C 108.583 -1.807 . . . . 0.0 108.583 -178.653 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.835 ' CD1' ' HB3' ' A' ' 73' ' ' ALA . 8.3 m-85 -119.8 157.32 28.88 Favored 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.632 -0.922 . . . . 0.0 110.156 -177.793 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.553 ' HG2' ' N ' ' A' ' 85' ' ' THR . 0.6 OUTLIER -160.17 163.03 33.98 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.048 -1.032 . . . . 0.0 110.955 -179.25 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 109.84 166.03 19.83 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.352 -1.499 . . . . 0.0 109.352 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.64 -34.82 69.74 Favored 'General case' 0 C--N 1.306 -1.313 0 O-C-N 121.155 -1.203 . . . . 0.0 109.12 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.487 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.7 OUTLIER -121.84 27.07 8.32 Favored 'General case' 0 C--N 1.291 -1.962 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 179.363 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.513 ' HA ' ' O ' ' A' ' 77' ' ' GLU . 7.1 m 65.99 10.63 7.13 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.23 -0.919 . . . . 0.0 109.198 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.542 ' HB3' ' CE1' ' A' ' 83' ' ' PHE . 28.5 tt0 -32.78 -43.03 0.09 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.868 -0.52 . . . . 0.0 111.821 -179.499 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.562 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -99.6 -160.3 0.79 Allowed 'General case' 0 C--N 1.296 -1.742 0 CA-C-O 122.864 1.316 . . . . 0.0 109.738 -179.043 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.522 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 1.0 OUTLIER -148.43 123.02 9.8 Favored 'General case' 0 C--N 1.278 -2.53 0 CA-C-N 114.314 -1.312 . . . . 0.0 109.051 179.603 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.553 ' N ' ' HG2' ' A' ' 77' ' ' GLU . 14.2 p -69.38 -16.23 63.47 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.205 -0.934 . . . . 0.0 109.656 -179.56 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.406 ' OXT' ' O ' ' A' ' 85' ' ' THR . 1.5 mtt180 . . . . . 0 C--N 1.295 -1.798 0 CA-C-O 118.03 -0.986 . . . . 0.0 109.588 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.546 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.402 ' O ' ' CB ' ' A' ' 3' ' ' SER . 4.5 p30 -148.2 124.76 11.05 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.25 -0.906 . . . . 0.0 109.677 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.402 ' CB ' ' O ' ' A' ' 2' ' ' ASN . 0.4 OUTLIER 171.15 45.12 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.284 -0.885 . . . . 0.0 109.304 179.96 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.569 ' CE1' ' O ' ' A' ' 21' ' ' ALA . 1.5 p90 -80.2 7.89 8.43 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.249 -0.907 . . . . 0.0 109.577 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.741 HD11 ' CB ' ' A' ' 23' ' ' SER . 1.0 OUTLIER -71.33 -24.01 62.03 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.999 -1.063 . . . . 0.0 108.963 -179.826 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 6' ' ' CGU . . . . . 0.487 ' C ' ' O ' ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' CGU . . . . . 0.428 ' O ' ' C ' ' A' ' 8' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.756 HG23 ' O ' ' A' ' 8' ' ' VAL . 2.7 m -39.68 102.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 CA-C-O 122.706 1.241 . . . . 0.0 109.489 -178.455 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.551 ' O ' ' CG ' ' A' ' 10' ' ' GLN . 27.5 mttp -45.1 -20.28 0.04 OUTLIER 'General case' 0 C--N 1.284 -2.245 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.531 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.551 ' CG ' ' O ' ' A' ' 9' ' ' LYS . 19.3 pt20 42.3 53.09 4.55 Favored 'General case' 0 N--CA 1.483 1.223 0 O-C-N 121.079 -1.013 . . . . 0.0 109.825 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -131.5 144.91 16.57 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.927 -1.269 . . . . 0.0 109.927 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.623 ' O ' HG11 ' A' ' 30' ' ' VAL . 17.5 m-80 60.92 152.89 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.521 -0.988 . . . . 0.0 110.111 179.734 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.78 HD23 ' HB3' ' A' ' 31' ' ' PHE . 3.2 mp -75.42 -97.19 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.164 0 O-C-N 121.084 -1.01 . . . . 0.0 110.582 -179.447 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' CGU . . . . . 0.514 OE11 ' N ' ' A' ' 15' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.514 ' N ' OE11 ' A' ' 14' ' ' CGU . 4.0 mtt180 -62.92 -22.46 66.77 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 120.512 -1.368 . . . . 0.0 109.927 -179.39 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' CGU . . . . . 0.903 ' O ' ' HB3' ' A' ' 21' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.548 ' HA ' ' HB3' ' A' ' 22' ' ' CYS . 1.6 t -100.9 1.07 39.55 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.998 -1.064 . . . . 0.0 109.52 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.74 HD21 ' HB2' ' A' ' 48' ' ' ASP . 0.4 OUTLIER -64.43 -15.57 60.85 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.526 -1.359 . . . . 0.0 110.197 179.56 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' CGU . . . . . 0.417 ' C ' ' H ' ' A' ' 21' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.903 ' HB3' ' O ' ' A' ' 16' ' ' CGU . . . -76.2 6.53 5.3 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.387 -0.821 . . . . 0.0 110.804 -179.171 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.548 ' HB3' ' HA ' ' A' ' 17' ' ' CYS . 11.9 p -139.68 -150.62 0.33 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.704 -1.247 . . . . 0.0 110.803 -179.64 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.913 ' O ' HD22 ' A' ' 24' ' ' LEU . 47.1 t -166.52 -70.5 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.646 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.913 HD22 ' O ' ' A' ' 23' ' ' SER . 0.2 OUTLIER -152.48 -82.06 0.09 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.276 -0.89 . . . . 0.0 109.726 179.824 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' CGU . . . . . 0.654 ' HG ' ' HN2' ' A' ' 26' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' CGU . . . . . 0.654 ' HN2' ' HG ' ' A' ' 25' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.595 ' O ' ' CE1' ' A' ' 31' ' ' PHE . . . -76.92 -46.31 24.73 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.874 -1.142 . . . . 0.0 110.242 -179.589 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.683 HH22 HD12 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -73.57 3.68 5.92 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 120.59 -1.318 . . . . 0.0 110.396 179.569 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 29' ' ' CGU . . . . . 0.433 OE12 OE11 ' A' ' 25' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.623 HG11 ' O ' ' A' ' 12' ' ' ASN . 58.8 t -106.15 -50.01 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 120.714 -1.241 . . . . 0.0 110.833 -179.719 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.78 ' HB3' HD23 ' A' ' 13' ' ' LEU . 0.0 OUTLIER -107.89 146.91 31.68 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 120.713 -1.242 . . . . 0.0 112.233 -178.993 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 32' ' ' CGU . . . . . 0.418 ' O ' ' C ' ' A' ' 33' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.828 ' O ' HG23 ' A' ' 37' ' ' THR . 51.3 p-10 -38.73 101.25 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.544 0 CA-C-O 121.759 0.79 . . . . 0.0 111.795 -177.293 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.563 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -80.28 -25.4 39.45 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 178.143 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.647 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 81.1 mt-30 -51.61 -38.59 55.29 Favored 'General case' 0 C--O 1.203 -1.393 0 O-C-N 120.947 -1.095 . . . . 0.0 108.299 178.481 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.828 HG23 ' O ' ' A' ' 33' ' ' ASP . 1.0 OUTLIER -42.26 -57.46 2.54 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.292 -1.505 . . . . 0.0 107.774 179.061 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.63 ' O ' ' C ' ' A' ' 39' ' ' CGU . 1.9 t70 -80.85 -69.19 0.62 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 120.875 -1.141 . . . . 0.0 108.666 176.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' CGU . . . . . 0.63 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.647 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 14.2 t80 -39.56 -52.44 2.18 Favored 'General case' 0 C--N 1.295 -1.765 0 O-C-N 121.923 -0.485 . . . . 0.0 110.008 178.474 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.676 ' CD1' ' O ' ' A' ' 37' ' ' THR . 7.7 m95 -77.64 -66.0 0.89 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.563 -0.71 . . . . 0.0 112.648 -178.58 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.496 ' OG ' ' N ' ' A' ' 43' ' ' LYS . 0.1 OUTLIER -42.55 -73.4 0.05 OUTLIER 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.738 -1.226 . . . . 0.0 112.223 -177.344 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.602 ' HD2' HG23 ' A' ' 65' ' ' ILE . 0.0 OUTLIER -81.32 35.9 0.4 Allowed 'General case' 0 C--N 1.286 -2.162 0 O-C-N 121.544 -0.723 . . . . 0.0 109.814 -178.874 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.578 ' CE1' ' OD1' ' A' ' 48' ' ' ASP . 0.6 OUTLIER -80.03 12.9 2.5 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.135 -0.978 . . . . 0.0 110.695 -179.709 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 4.6 mttm -86.77 55.01 3.37 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 120.964 -1.085 . . . . 0.0 108.377 179.107 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -131.64 4.5 4.25 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.501 -0.749 . . . . 0.0 110.128 -178.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.558 ' O ' ' CB ' ' A' ' 51' ' ' GLU . . . 72.49 29.23 66.21 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 108.606 -1.798 . . . . 0.0 108.606 -179.308 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.74 ' HB2' HD21 ' A' ' 18' ' ' LEU . 0.0 OUTLIER 46.58 21.57 0.14 Allowed 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.482 -1.01 . . . . 0.0 110.329 -179.868 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.639 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 33.2 mm-40 59.06 -92.29 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.453 0 O-C-N 120.973 -1.079 . . . . 0.0 111.157 178.036 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.511 ' CB ' ' OB ' ' A' ' 63' ' ' BHD . 36.5 t -45.87 -25.64 0.56 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.183 -0.948 . . . . 0.0 110.862 -178.768 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.558 ' CB ' ' O ' ' A' ' 47' ' ' GLY . 20.1 tt0 -49.43 148.55 2.67 Favored 'General case' 0 N--CA 1.485 1.312 0 O-C-N 120.577 -1.327 . . . . 0.0 108.708 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.465 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . 90.8 -15.92 59.47 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 110.078 -1.209 . . . . 0.0 110.078 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.472 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 30.7 t60 65.03 64.26 1.06 Allowed Pre-proline 0 N--CA 1.493 1.72 0 O-C-N 121.144 -1.209 . . . . 0.0 109.599 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.499 ' HD3' ' O ' ' A' ' 50' ' ' CYS . 4.9 Cg_exo -61.19 -39.5 58.08 Favored 'Trans proline' 0 C--N 1.31 -1.5 0 C-N-CA 122.604 2.203 . . . . 0.0 110.604 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.464 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 1.8 m -71.51 173.05 8.48 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.381 -0.824 . . . . 0.0 109.304 -179.576 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.565 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.6 mt -146.6 -176.84 5.34 Favored 'General case' 0 N--CA 1.492 1.635 0 CA-C-O 122.231 1.015 . . . . 0.0 109.906 179.466 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.615 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 1.6 m120 45.84 61.33 2.7 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.513 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.447 ' NE2' ' HZ ' ' A' ' 76' ' ' PHE . 4.2 mt-30 46.54 33.36 1.96 Allowed 'General case' 0 C--N 1.299 -1.591 0 C-N-CA 119.468 -0.893 . . . . 0.0 109.384 177.828 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -73.93 145.71 35.53 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.669 -1.373 . . . . 0.0 109.669 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.468 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 1.3 t60 -79.91 115.8 19.7 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.208 -1.172 . . . . 0.0 109.021 179.701 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.464 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 44.5 t -91.92 134.37 34.85 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.102 -0.999 . . . . 0.0 110.092 -179.438 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.508 ' HB2' ' O ' ' A' ' 69' ' ' THR . 2.1 tttp -117.74 115.08 24.31 Favored 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 106.919 -1.511 . . . . 0.0 106.919 178.237 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' BHD . . . . . 0.74 ' OD1' HD13 ' A' ' 18' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.513 ' O ' ' O ' ' A' ' 67' ' ' ASP . . . 147.69 138.32 3.06 Favored Glycine 0 N--CA 1.488 2.161 0 N-CA-C 107.71 -2.156 . . . . 0.0 107.71 -179.243 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.602 HG23 ' HD2' ' A' ' 43' ' ' LYS . 0.4 OUTLIER -53.31 -61.98 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 O-C-N 120.461 -1.611 . . . . 0.0 109.216 -179.088 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.58 ' N ' HG22 ' A' ' 65' ' ' ILE . . . -43.68 -38.46 4.26 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 110.029 -1.228 . . . . 0.0 110.029 -179.469 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.523 ' OD1' ' N ' ' A' ' 68' ' ' TYR . 1.6 p30 179.29 -157.16 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.255 -1.144 . . . . 0.0 110.094 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.647 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 3.1 p90 -150.66 124.84 9.39 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.121 -0.987 . . . . 0.0 108.919 -178.82 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.508 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 70.3 p -95.34 119.33 33.67 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 120.898 -1.126 . . . . 0.0 109.201 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 9.5 m -79.11 -171.46 2.67 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.664 -1.273 . . . . 0.0 108.382 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.468 ' HB ' ' HB3' ' A' ' 60' ' ' HIS . 5.1 m -161.19 145.1 13.21 Favored 'General case' 0 C--N 1.285 -2.198 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 179.801 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.5 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 73.8 m -109.06 118.34 36.53 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.176 -0.953 . . . . 0.0 108.974 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.908 ' HB3' ' CD1' ' A' ' 76' ' ' PHE . . . -47.89 -178.02 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.066 -1.021 . . . . 0.0 110.42 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -80.51 100.67 8.67 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-O 123.2 1.476 . . . . 0.0 108.065 178.63 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLY . . . . . 0.46 ' O ' ' OG1' ' A' ' 85' ' ' THR . . . 119.17 18.5 4.58 Favored Glycine 0 C--N 1.269 -3.148 0 CA-C-N 113.575 -1.648 . . . . 0.0 108.994 -179.208 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.908 ' CD1' ' HB3' ' A' ' 73' ' ' ALA . 4.8 m-85 -115.58 160.07 20.46 Favored 'General case' 0 C--N 1.294 -1.813 0 O-C-N 121.372 -1.076 . . . . 0.0 109.726 -178.373 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.647 ' OE2' HG22 ' A' ' 85' ' ' THR . 19.3 pt-20 -160.72 167.26 27.26 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.158 -0.964 . . . . 0.0 110.304 -179.332 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 108.28 166.68 21.22 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 110.105 -1.198 . . . . 0.0 110.105 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.39 -47.49 72.66 Favored 'General case' 0 C--N 1.307 -1.251 0 O-C-N 121.371 -1.076 . . . . 0.0 109.638 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.565 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 2.9 m-20 -111.79 32.57 5.36 Favored 'General case' 0 C--N 1.287 -2.129 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 179.272 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.492 ' O ' ' HB2' ' A' ' 57' ' ' ASN . 3.3 m 52.27 67.82 0.92 Allowed 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 105.67 -1.974 . . . . 0.0 105.67 -177.215 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.433 ' C ' ' OD1' ' A' ' 57' ' ' ASN . 37.9 tt0 -103.52 -25.2 13.31 Favored 'General case' 0 C--N 1.306 -1.29 0 O-C-N 121.589 -0.694 . . . . 0.0 111.067 -176.558 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.632 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -99.53 74.84 1.91 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.898 -1.126 . . . . 0.0 109.212 -179.827 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.444 ' C ' ' O ' ' A' ' 83' ' ' PHE . 0.3 OUTLIER -43.66 94.97 0.01 OUTLIER 'General case' 0 C--N 1.293 -1.862 0 C-N-CA 119.697 -0.801 . . . . 0.0 109.521 -179.82 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.647 HG22 ' OE2' ' A' ' 77' ' ' GLU . 5.8 p -68.38 -11.69 59.98 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.339 -0.851 . . . . 0.0 109.822 -179.639 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.439 ' OXT' ' O ' ' A' ' 85' ' ' THR . 3.5 mtp180 . . . . . 0 C--N 1.299 -1.605 0 CA-C-O 118.034 -0.984 . . . . 0.0 109.936 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.497 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -143.85 86.54 1.87 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.242 -0.911 . . . . 0.0 109.648 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.6 t -80.9 155.33 26.57 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.275 -0.891 . . . . 0.0 109.145 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.558 ' CE2' ' HA ' ' A' ' 22' ' ' CYS . 6.3 p90 -77.06 -2.75 35.68 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.167 -0.958 . . . . 0.0 109.408 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.511 ' O ' ' C ' ' A' ' 6' ' ' CGU . 0.4 OUTLIER -66.04 -36.35 83.0 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.236 -0.915 . . . . 0.0 109.532 -179.907 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 6' ' ' CGU . . . . . 0.587 ' HN2' ' CD2' ' A' ' 6' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' CGU . . . . . 0.485 ' O ' ' N ' ' A' ' 9' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.784 HG23 ' O ' ' A' ' 8' ' ' VAL . 11.4 m -39.54 97.71 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.307 -1.256 0 CA-C-O 122.402 1.096 . . . . 0.0 110.037 -178.872 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.51 ' O ' ' N ' ' A' ' 11' ' ' GLY . 8.1 tptt -47.5 92.68 0.01 OUTLIER 'General case' 0 C--N 1.285 -2.239 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 179.505 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.531 ' N ' ' O ' ' A' ' 8' ' ' VAL . 0.9 OUTLIER -39.04 94.56 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.54 -0.725 . . . . 0.0 110.005 -179.037 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.51 ' N ' ' O ' ' A' ' 9' ' ' LYS . . . 81.73 131.83 1.38 Allowed Glycine 0 N--CA 1.493 2.445 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.634 ' C ' HD22 ' A' ' 13' ' ' LEU . 0.5 OUTLIER -169.9 158.62 7.38 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.228 -1.16 . . . . 0.0 109.668 -179.936 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.708 HD22 ' N ' ' A' ' 13' ' ' LEU . 3.4 mm? -110.91 -173.73 2.31 Favored 'General case' 0 N--CA 1.48 1.054 0 O-C-N 121.069 -1.02 . . . . 0.0 109.05 179.696 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' CGU . . . . . 0.637 ' CD2' ' C ' ' A' ' 14' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.602 ' CB ' ' CZ ' ' A' ' 15' ' ' ARG . 0.4 OUTLIER -76.79 -48.78 17.56 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.273 -0.892 . . . . 0.0 109.243 179.443 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 16' ' ' CGU . . . . . 0.558 ' HB2' ' CB ' ' A' ' 12' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.515 ' O ' ' HB2' ' A' ' 22' ' ' CYS . 0.6 OUTLIER -167.34 43.76 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.091 -1.078 . . . . 0.0 108.091 -179.235 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.546 ' CA ' ' O ' ' A' ' 14' ' ' CGU . 0.3 OUTLIER -56.66 -117.41 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.873 -0.517 . . . . 0.0 110.011 -179.713 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 19' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 20' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.414 ' O ' ' HA ' ' A' ' 17' ' ' CYS . . . -93.28 12.76 23.49 Favored 'General case' 0 C--N 1.297 -1.681 0 O-C-N 121.454 -0.779 . . . . 0.0 109.062 179.597 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.826 ' SG ' ' HB2' ' A' ' 27' ' ' ALA . 1.7 t -130.67 173.24 11.1 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.397 -0.814 . . . . 0.0 109.379 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.525 ' O ' ' CB ' ' A' ' 24' ' ' LEU . 30.4 t -135.91 -0.74 2.52 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.217 -0.927 . . . . 0.0 109.934 179.581 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.525 ' CB ' ' O ' ' A' ' 23' ' ' SER . 0.1 OUTLIER 80.93 -35.04 0.12 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.212 -0.93 . . . . 0.0 110.465 179.966 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 25' ' ' CGU . . . . . 0.415 ' O ' OE12 ' A' ' 29' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' CGU . . . . . 0.658 OE11 HG23 ' A' ' 30' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.826 ' HB2' ' SG ' ' A' ' 22' ' ' CYS . . . -60.17 -13.91 14.63 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.975 -1.078 . . . . 0.0 109.555 -179.86 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -80.27 -54.6 5.58 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 122.19 0.995 . . . . 0.0 110.394 -179.651 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' CGU . . . . . 0.415 OE12 ' O ' ' A' ' 25' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.658 HG23 OE11 ' A' ' 26' ' ' CGU . 5.3 t -88.57 -28.71 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.173 -0.954 . . . . 0.0 109.801 -179.711 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.584 ' CE2' ' CE2' ' A' ' 40' ' ' PHE . 1.9 m-85 -103.54 92.37 4.43 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 120.885 -1.134 . . . . 0.0 109.831 -179.694 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' CGU . . . . . 0.439 ' O ' ' C ' ' A' ' 33' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.596 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 22.6 m-20 -39.95 125.72 1.96 Allowed 'General case' 0 C--N 1.303 -1.45 0 CA-C-O 121.255 0.55 . . . . 0.0 110.69 -179.416 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.52 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -79.85 -31.43 40.48 Favored 'General case' 0 N--CA 1.487 1.375 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 178.611 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' CGU . . . . . 0.456 ' O ' ' HB3' ' A' ' 39' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.661 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 5.8 mm100 -52.98 -37.15 61.0 Favored 'General case' 0 C--O 1.203 -1.376 0 O-C-N 120.55 -1.344 . . . . 0.0 108.216 178.535 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.614 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -41.55 -60.09 1.42 Allowed 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.164 -1.585 . . . . 0.0 107.926 179.056 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.601 ' O ' ' C ' ' A' ' 39' ' ' CGU . 1.8 t70 -81.44 -65.87 0.96 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.337 -0.852 . . . . 0.0 109.263 177.581 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' CGU . . . . . 0.601 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.661 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 20.6 t80 -39.49 -49.34 2.09 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 178.655 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.614 ' CD1' ' O ' ' A' ' 37' ' ' THR . 9.5 m95 -80.94 -71.85 0.45 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.778 -0.576 . . . . 0.0 112.101 -179.176 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.52 ' OG ' ' N ' ' A' ' 43' ' ' LYS . 1.1 p -53.77 -60.34 3.45 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.435 -1.416 . . . . 0.0 110.711 -178.113 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.531 ' CD ' OE11 ' A' ' 39' ' ' CGU . 0.3 OUTLIER -62.38 -13.71 32.21 Favored 'General case' 0 C--N 1.284 -2.246 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 -179.738 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.707 ' O ' ' N ' ' A' ' 46' ' ' ASP . 0.9 OUTLIER -43.23 -65.72 0.46 Allowed 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.31 -0.869 . . . . 0.0 109.0 -179.769 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.543 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.2 OUTLIER -15.58 73.34 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.719 0 CA-C-O 121.203 0.525 . . . . 0.0 111.272 -179.938 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.707 ' N ' ' O ' ' A' ' 44' ' ' TYR . 2.6 t0 -161.71 -30.26 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.215 -0.928 . . . . 0.0 110.414 -178.602 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.491 ' O ' ' OD2' ' A' ' 48' ' ' ASP . . . 105.34 16.15 17.19 Favored Glycine 0 N--CA 1.486 1.999 0 N-CA-C 108.15 -1.98 . . . . 0.0 108.15 -178.199 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.658 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER 72.21 9.23 5.93 Favored 'General case' 0 N--CA 1.504 2.244 0 O-C-N 121.777 -0.837 . . . . 0.0 109.988 -179.704 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.658 ' HB2' ' O ' ' A' ' 48' ' ' ASP . 32.5 mm-40 79.42 -25.13 0.19 Allowed 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.77 -0.581 . . . . 0.0 111.807 178.609 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 19.2 t -111.8 -14.49 13.55 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.676 -1.265 . . . . 0.0 110.349 -179.529 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.487 ' CB ' ' O ' ' A' ' 47' ' ' GLY . 13.9 tt0 -54.98 -20.39 9.0 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 120.943 -1.098 . . . . 0.0 111.514 -179.34 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.415 ' O ' ' C ' ' A' ' 53' ' ' HIS . . . -95.94 21.74 43.31 Favored Glycine 0 N--CA 1.497 2.708 0 O-C-N 120.701 -1.25 . . . . 0.0 111.244 -178.518 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.582 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 13.2 t60 42.94 54.66 10.27 Favored Pre-proline 0 N--CA 1.493 1.717 0 O-C-N 120.956 -1.32 . . . . 0.0 109.721 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.582 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 6.3 Cg_exo -57.89 -39.43 86.71 Favored 'Trans proline' 0 C--N 1.309 -1.542 0 C-N-CA 122.537 2.158 . . . . 0.0 111.846 -179.633 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.464 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 1.0 OUTLIER -83.84 158.84 21.52 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.083 -1.011 . . . . 0.0 110.348 -178.405 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.531 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.4 mt -144.69 -172.84 3.9 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.434 -0.791 . . . . 0.0 109.516 -179.83 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.646 ' HB3' ' CD2' ' A' ' 76' ' ' PHE . 8.1 m-80 46.78 58.81 4.38 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-O 121.827 0.822 . . . . 0.0 110.363 178.662 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.566 ' OE1' ' CZ ' ' A' ' 76' ' ' PHE . 8.4 mt-30 52.64 30.16 8.31 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-O 121.489 0.662 . . . . 0.0 109.54 177.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.438 ' HA2' ' O ' ' A' ' 71' ' ' THR . . . -82.31 141.32 21.29 Favored Glycine 0 N--CA 1.489 2.217 0 N-CA-C 109.728 -1.349 . . . . 0.0 109.728 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -79.39 149.71 31.57 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.193 -1.18 . . . . 0.0 108.036 179.137 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.464 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 41.0 t -119.55 113.79 21.26 Favored 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 119.027 -1.069 . . . . 0.0 111.254 -178.529 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.429 ' HB3' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER -97.29 -178.14 4.07 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 105.454 -2.054 . . . . 0.0 105.454 176.595 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 63' ' ' BHD . . . . . 0.553 ' OD2' ' CD1' ' A' ' 14' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.503 ' O ' ' O ' ' A' ' 67' ' ' ASP . . . 135.19 132.93 3.21 Favored Glycine 0 N--CA 1.488 2.142 0 N-CA-C 107.438 -2.265 . . . . 0.0 107.438 -178.584 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.595 HG22 ' N ' ' A' ' 66' ' ' GLY . 0.0 OUTLIER -45.53 -56.21 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 120.662 -1.493 . . . . 0.0 109.132 -178.826 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.595 ' N ' HG22 ' A' ' 65' ' ' ILE . . . -44.04 -43.58 7.09 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.503 ' O ' ' O ' ' A' ' 64' ' ' GLY . 2.1 p-10 178.44 -154.87 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.408 -1.054 . . . . 0.0 109.686 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.648 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 1.9 p90 -144.82 157.73 44.06 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 120.859 -1.151 . . . . 0.0 109.962 -179.211 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.429 ' OG1' ' HB3' ' A' ' 62' ' ' LYS . 73.7 p -122.52 115.15 21.69 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.429 -0.795 . . . . 0.0 109.181 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 65.8 m -84.63 -167.61 1.87 Allowed 'General case' 0 C--N 1.298 -1.643 0 O-C-N 120.889 -1.132 . . . . 0.0 108.937 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.438 ' O ' ' HA2' ' A' ' 59' ' ' GLY . 1.3 m -160.85 120.93 2.74 Favored 'General case' 0 C--N 1.29 -2.011 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.442 ' O ' ' O ' ' A' ' 73' ' ' ALA . 91.4 m -89.56 115.88 27.29 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.126 -0.983 . . . . 0.0 109.437 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.442 ' O ' ' O ' ' A' ' 72' ' ' CYS . . . -49.51 -179.42 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.481 0 O-C-N 120.915 -1.116 . . . . 0.0 110.162 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -81.03 101.3 9.47 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-O 122.97 1.367 . . . . 0.0 107.799 178.407 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLY . . . . . 0.583 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 130.99 5.11 3.97 Favored Glycine 0 C--N 1.269 -3.149 0 CA-C-N 114.003 -1.453 . . . . 0.0 110.003 -179.315 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.646 ' CD2' ' HB3' ' A' ' 57' ' ' ASN . 45.4 m-85 -133.45 154.16 51.02 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.111 -1.229 . . . . 0.0 110.606 -177.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.467 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 0.0 OUTLIER -155.92 168.22 27.91 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.247 -0.908 . . . . 0.0 110.206 -179.233 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 116.79 171.99 16.11 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 109.452 -1.459 . . . . 0.0 109.452 179.882 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.469 ' C ' ' HD3' ' A' ' 79' ' ' LYS . 0.4 OUTLIER -50.98 -56.26 13.32 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.152 -1.205 . . . . 0.0 108.65 179.687 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.531 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 1.3 m-20 -108.39 26.87 9.95 Favored 'General case' 0 C--N 1.287 -2.122 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.538 ' O ' ' ND2' ' A' ' 57' ' ' ASN . 4.1 m 63.87 14.63 8.49 Favored 'General case' 0 C--N 1.305 -1.342 0 O-C-N 121.083 -1.01 . . . . 0.0 108.372 -178.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 36.8 tt0 -38.24 -25.5 0.01 OUTLIER 'General case' 0 C--N 1.309 -1.179 0 O-C-N 121.861 -0.525 . . . . 0.0 111.71 -179.53 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.551 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.4 OUTLIER -97.43 -161.44 0.87 Allowed 'General case' 0 C--N 1.299 -1.599 0 CA-C-O 122.836 1.303 . . . . 0.0 109.597 -179.743 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.469 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 54.7 m -161.44 93.1 0.92 Allowed 'General case' 0 C--N 1.277 -2.555 0 CA-C-N 114.302 -1.317 . . . . 0.0 109.098 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.439 ' C ' ' HG3' ' A' ' 86' ' ' ARG . 82.7 p -51.92 -58.81 5.4 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.191 -0.943 . . . . 0.0 109.885 -179.519 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.444 ' O ' ' HA3' ' A' ' 75' ' ' GLY . 2.5 ppt_? . . . . . 0 C--N 1.285 -2.225 0 CA-C-O 117.997 -1.002 . . . . 0.0 109.445 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 49.08 74.5 0.18 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.288 -0.883 . . . . 0.0 109.671 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.455 ' HB2' ' HB3' ' A' ' 6' ' ' CGU . 62.5 p -66.02 90.21 0.13 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.326 -0.859 . . . . 0.0 109.257 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.579 ' CZ ' ' O ' ' A' ' 21' ' ' ALA . 17.6 t80 -73.93 -30.49 62.59 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.3 -0.875 . . . . 0.0 109.709 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.636 ' C ' ' H ' ' A' ' 7' ' ' CGU . 0.4 OUTLIER -77.33 -29.24 53.43 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.099 -1.001 . . . . 0.0 110.013 -179.432 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 6' ' ' CGU . . . . . 0.455 ' HB3' ' HB2' ' A' ' 3' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' CGU . . . . . 0.636 ' H ' ' C ' ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.747 HG23 ' O ' ' A' ' 8' ' ' VAL . 5.0 m -40.09 101.86 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.309 -1.175 0 CA-C-O 122.335 1.064 . . . . 0.0 109.255 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.459 ' C ' ' O ' ' A' ' 8' ' ' VAL . 0.0 OUTLIER -39.25 -29.26 0.04 OUTLIER 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 115.536 -0.756 . . . . 0.0 108.979 -179.796 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.486 ' N ' ' O ' ' A' ' 8' ' ' VAL . 0.7 OUTLIER -168.14 178.46 5.02 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.449 -0.782 . . . . 0.0 109.273 179.01 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -88.4 34.24 3.88 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.697 -1.361 . . . . 0.0 109.697 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.967 ' C ' HD13 ' A' ' 13' ' ' LEU . 1.4 t-20 -110.04 154.12 23.67 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.159 -1.2 . . . . 0.0 109.486 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 1.023 HD11 HG11 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -153.49 -32.16 0.12 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.075 -1.016 . . . . 0.0 109.836 178.665 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 14' ' ' CGU . . . . . 0.612 ' N ' HD22 ' A' ' 13' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.533 ' NH1' ' O ' ' A' ' 61' ' ' CYS . 26.5 mtm180 -75.91 -34.13 59.91 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.706 -0.621 . . . . 0.0 110.221 179.092 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' CGU . . . . . 0.504 ' HB2' ' HA ' ' A' ' 13' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.71 ' HA ' ' HB3' ' A' ' 22' ' ' CYS . 44.6 t -110.28 25.42 11.8 Favored 'General case' 0 N--CA 1.49 1.567 0 CA-C-O 122.227 1.013 . . . . 0.0 109.287 179.786 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.854 HD11 ' O ' ' A' ' 48' ' ' ASP . 0.1 OUTLIER -79.48 -14.32 58.97 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.146 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 19' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 20' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.579 ' O ' ' CZ ' ' A' ' 4' ' ' PHE . . . -83.22 17.92 1.9 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.108 -0.995 . . . . 0.0 110.801 -178.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.71 ' HB3' ' HA ' ' A' ' 17' ' ' CYS . 18.1 p -134.5 -163.59 1.39 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.842 -1.161 . . . . 0.0 110.491 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.531 ' O ' ' N ' ' A' ' 25' ' ' CGU . 84.4 p -170.62 137.8 1.38 Allowed 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 179.317 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 1.137 HD13 ' N ' ' A' ' 25' ' ' CGU . 0.0 OUTLIER -41.24 -21.03 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.227 -0.92 . . . . 0.0 111.042 -179.278 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 25' ' ' CGU . . . . . 1.137 ' N ' HD13 ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' CGU . . . . . 0.55 ' CA ' HD11 ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.702 ' HB3' ' CZ2' ' A' ' 41' ' ' TRP . . . -81.36 66.3 6.85 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 179.759 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.548 ' HG3' ' O ' ' A' ' 24' ' ' LEU . 4.1 mtp180 -121.35 -85.3 0.66 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.252 -0.905 . . . . 0.0 110.801 -179.345 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 1.023 HG11 HD11 ' A' ' 13' ' ' LEU . 1.9 t -79.26 -34.22 16.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 120.813 -1.179 . . . . 0.0 109.569 -179.614 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.653 ' HZ ' ' HB1' ' A' ' 27' ' ' ALA . 0.0 OUTLIER -122.55 123.52 41.42 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 119.138 -1.025 . . . . 0.0 110.014 178.265 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 32' ' ' CGU . . . . . 0.416 ' O ' ' C ' ' A' ' 33' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.595 ' HB2' ' CG ' ' A' ' 36' ' ' GLN . 4.8 m-20 -39.25 108.87 0.09 Allowed 'General case' 0 C--N 1.304 -1.402 0 CA-C-O 121.561 0.696 . . . . 0.0 111.44 -179.21 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.526 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -78.09 -25.94 47.83 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 106.12 -1.808 . . . . 0.0 106.12 177.078 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' CGU . . . . . 0.421 ' O ' ' N ' ' A' ' 39' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.691 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 0.0 OUTLIER -51.24 -35.87 39.09 Favored 'General case' 0 C--O 1.202 -1.417 0 C-N-CA 117.796 -1.562 . . . . 0.0 107.432 179.344 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.604 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -41.89 -61.89 1.03 Allowed 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 117.548 -1.661 . . . . 0.0 106.969 178.698 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.637 ' O ' ' C ' ' A' ' 39' ' ' CGU . 0.4 OUTLIER -83.69 -68.49 0.71 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.358 -0.839 . . . . 0.0 109.544 176.397 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 39' ' ' CGU . . . . . 0.637 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.763 ' O ' ' HB2' ' A' ' 44' ' ' TYR . 21.0 t80 -47.13 -52.95 14.09 Favored 'General case' 0 C--O 1.189 -2.103 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 178.081 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.702 ' CZ2' ' HB3' ' A' ' 27' ' ' ALA . 16.2 m95 -80.94 -66.06 0.93 Allowed 'General case' 0 C--N 1.294 -1.817 0 O-C-N 120.656 -1.278 . . . . 0.0 112.019 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.55 ' O ' ' CB ' ' A' ' 43' ' ' LYS . 0.6 OUTLIER -71.85 79.62 0.88 Allowed 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 122.334 1.064 . . . . 0.0 109.565 -178.81 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.55 ' CB ' ' O ' ' A' ' 42' ' ' SER . 0.0 OUTLIER 153.68 -26.69 0.0 OUTLIER 'General case' 0 C--N 1.283 -2.324 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 -179.46 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.976 ' HA ' HD11 ' A' ' 65' ' ' ILE . 22.1 t80 -80.38 -97.55 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 179.034 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.551 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.1 OUTLIER 35.84 33.41 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 -179.057 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.563 ' HB2' ' O ' ' A' ' 44' ' ' TYR . 7.4 t0 -134.21 -17.59 2.08 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.712 -176.308 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.524 ' HA2' ' CE1' ' A' ' 44' ' ' TYR . . . 45.06 60.88 3.75 Favored Glycine 0 N--CA 1.496 2.685 0 N-CA-C 106.328 -2.709 . . . . 0.0 106.328 -177.31 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.854 ' O ' HD11 ' A' ' 18' ' ' LEU . 13.0 t70 -129.18 -129.22 0.21 Allowed 'General case' 0 C--N 1.308 -1.228 0 O-C-N 121.445 -1.032 . . . . 0.0 111.434 -176.166 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.542 ' HG3' ' N ' ' A' ' 67' ' ' ASP . 0.1 OUTLIER 52.04 -86.0 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.425 -0.797 . . . . 0.0 111.343 -179.385 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.502 ' HA ' ' CG ' ' A' ' 54' ' ' PRO . 46.1 t -101.33 12.63 37.1 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.948 -1.095 . . . . 0.0 111.221 -178.542 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -70.19 146.05 51.02 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 120.714 -1.241 . . . . 0.0 109.008 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 90.94 -1.85 78.62 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 110.107 -1.197 . . . . 0.0 110.107 179.594 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.43 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 10.2 t60 62.59 66.52 1.3 Allowed Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.114 -1.227 . . . . 0.0 109.411 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.502 ' CG ' ' HA ' ' A' ' 50' ' ' CYS . 3.0 Cg_exo -61.97 -52.93 2.4 Favored 'Trans proline' 0 C--N 1.309 -1.502 0 C-N-CA 122.42 2.08 . . . . 0.0 111.259 -179.666 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.491 ' SG ' ' CB ' ' A' ' 61' ' ' CYS . 1.8 m -65.76 160.72 22.35 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.093 -1.005 . . . . 0.0 109.178 -179.349 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.502 ' HA ' HD23 ' A' ' 56' ' ' LEU . 5.3 mt -145.21 -173.83 4.21 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.195 -0.941 . . . . 0.0 110.026 -179.573 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.658 ' HB3' ' CD2' ' A' ' 76' ' ' PHE . 2.4 m120 45.68 59.7 3.51 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-O 121.995 0.902 . . . . 0.0 110.281 178.819 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.443 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 2.2 mm-40 53.66 30.18 10.58 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-O 121.521 0.677 . . . . 0.0 109.709 177.678 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.498 ' HA2' ' O ' ' A' ' 71' ' ' THR . . . -81.58 131.13 10.17 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.435 -1.466 . . . . 0.0 109.435 179.752 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -79.63 123.48 27.67 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.116 -1.226 . . . . 0.0 109.019 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.533 ' O ' ' NH1' ' A' ' 15' ' ' ARG . 39.0 t -91.96 148.98 21.79 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.383 -0.823 . . . . 0.0 110.397 -179.046 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 69' ' ' THR . 0.9 OUTLIER -136.56 102.36 4.91 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 178.446 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 63' ' ' BHD . . . . . 0.528 ' OB ' ' CG ' ' A' ' 15' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.556 ' O ' ' O ' ' A' ' 65' ' ' ILE . . . 153.27 33.25 0.03 OUTLIER Glycine 0 N--CA 1.488 2.106 0 C-N-CA 119.527 -1.321 . . . . 0.0 110.95 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.976 HD11 ' HA ' ' A' ' 44' ' ' TYR . 0.1 OUTLIER 54.97 143.34 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.258 -1.142 . . . . 0.0 109.975 179.776 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 85.07 -43.47 3.26 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 108.223 -1.951 . . . . 0.0 108.223 -178.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.542 ' N ' ' HG3' ' A' ' 49' ' ' GLN . 1.8 p-10 -176.15 -157.46 0.05 Allowed 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.488 -1.007 . . . . 0.0 109.162 178.51 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.704 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 4.0 p90 -160.71 125.46 3.69 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.303 -0.873 . . . . 0.0 108.759 -177.724 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.473 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 73.3 p -85.48 128.21 34.66 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 120.492 -1.38 . . . . 0.0 109.66 179.691 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 31.0 m -92.89 -170.91 2.56 Favored 'General case' 0 C--N 1.306 -1.287 0 O-C-N 120.972 -1.08 . . . . 0.0 108.422 179.37 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.498 ' O ' ' HA2' ' A' ' 59' ' ' GLY . 9.0 m -161.34 112.65 1.76 Allowed 'General case' 0 C--N 1.289 -2.06 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.571 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 99.6 m -79.74 121.19 25.03 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 120.96 -1.088 . . . . 0.0 108.766 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -52.05 175.34 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.403 0 O-C-N 120.937 -1.102 . . . . 0.0 109.732 -179.653 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -80.75 101.33 9.25 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-O 123.022 1.391 . . . . 0.0 107.788 178.731 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLY . . . . . 0.553 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 131.45 5.99 3.53 Favored Glycine 0 C--N 1.27 -3.126 0 CA-C-N 113.905 -1.498 . . . . 0.0 110.184 -179.374 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.658 ' CD2' ' HB3' ' A' ' 57' ' ' ASN . 27.1 m-85 -130.64 160.78 33.22 Favored 'General case' 0 C--N 1.299 -1.626 0 O-C-N 121.041 -1.27 . . . . 0.0 110.6 -178.238 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.482 ' C ' ' HA ' ' A' ' 81' ' ' CYS . 0.8 OUTLIER -159.44 169.23 24.37 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.119 -0.988 . . . . 0.0 110.494 -179.387 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 115.83 173.49 17.35 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 109.322 -1.511 . . . . 0.0 109.322 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.55 -57.47 7.02 Favored 'General case' 0 C--N 1.306 -1.301 0 O-C-N 121.088 -1.242 . . . . 0.0 109.018 179.76 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.488 ' O ' ' CB ' ' A' ' 81' ' ' CYS . 2.7 m-20 -108.51 23.94 13.78 Favored 'General case' 0 C--N 1.29 -2.013 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 178.762 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.589 ' HB2' ' HB2' ' A' ' 57' ' ' ASN . 3.3 m 72.05 15.47 5.55 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.078 -1.014 . . . . 0.0 108.566 -179.451 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 34.8 tt0 -39.42 -25.13 0.02 OUTLIER 'General case' 0 C--N 1.308 -1.239 0 O-C-N 121.772 -0.58 . . . . 0.0 112.348 -179.266 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.52 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.4 OUTLIER -101.96 -161.84 0.88 Allowed 'General case' 0 C--N 1.299 -1.608 0 CA-C-O 122.91 1.338 . . . . 0.0 110.092 -179.079 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.505 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 8.0 m -156.36 99.07 1.89 Allowed 'General case' 0 C--N 1.278 -2.515 0 CA-C-N 114.13 -1.396 . . . . 0.0 109.069 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 77.9 p -58.29 -55.48 34.46 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.085 -1.009 . . . . 0.0 109.764 -179.623 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.517 ' HG2' ' HA2' ' A' ' 75' ' ' GLY . 0.0 OUTLIER . . . . . 0 C--N 1.285 -2.208 0 CA-C-O 117.984 -1.008 . . . . 0.0 109.411 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.529 ' ND2' ' HB3' ' A' ' 5' ' ' LEU . 17.7 t-20 -79.27 -98.19 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.301 -0.874 . . . . 0.0 109.346 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.513 ' N ' ' OD1' ' A' ' 2' ' ' ASN . 16.2 t 54.38 -89.95 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.0 -1.062 . . . . 0.0 109.923 179.645 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.57 ' CE1' HD12 ' A' ' 5' ' ' LEU . 38.3 p90 -62.3 -11.91 17.86 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.201 -0.937 . . . . 0.0 109.818 -179.467 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.57 HD12 ' CE1' ' A' ' 4' ' ' PHE . 0.2 OUTLIER -63.77 -32.37 73.85 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.084 -1.01 . . . . 0.0 109.435 179.979 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 6' ' ' CGU . . . . . 0.478 ' C ' ' O ' ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' CGU . . . . . 0.463 ' O ' ' N ' ' A' ' 9' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.788 HG23 ' O ' ' A' ' 8' ' ' VAL . 4.7 m -40.15 99.29 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.308 -1.203 0 CA-C-O 122.391 1.091 . . . . 0.0 109.761 -179.364 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.463 ' N ' ' O ' ' A' ' 7' ' ' CGU . 8.2 mtmt -51.43 89.08 0.0 OUTLIER 'General case' 0 C--N 1.283 -2.31 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.54 ' N ' ' O ' ' A' ' 8' ' ' VAL . 0.4 OUTLIER -47.24 127.58 10.83 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.101 -1.0 . . . . 0.0 109.284 -179.257 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -121.93 -52.26 0.23 Allowed Glycine 0 N--CA 1.49 2.283 0 C-N-CA 119.723 -1.227 . . . . 0.0 110.293 -179.452 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.731 ' C ' HD22 ' A' ' 13' ' ' LEU . 5.1 t-20 -170.12 -167.09 0.6 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.121 -1.223 . . . . 0.0 109.553 -179.493 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.731 HD22 ' C ' ' A' ' 12' ' ' ASN . 3.4 mm? -110.37 124.77 52.31 Favored 'General case' 0 C--N 1.309 -1.185 0 O-C-N 120.775 -1.203 . . . . 0.0 108.999 -179.72 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' CGU . . . . . 0.604 ' HA ' ' CE2' ' A' ' 40' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.583 ' CB ' ' CZ ' ' A' ' 15' ' ' ARG . 2.3 mtm-85 -83.31 18.73 1.68 Allowed 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.281 -0.887 . . . . 0.0 109.333 178.936 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' CGU . . . . . 0.537 ' C ' ' SG ' ' A' ' 17' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.775 ' HB3' ' C ' ' A' ' 21' ' ' ALA . 3.6 m -164.12 61.28 0.15 Allowed 'General case' 0 C--N 1.307 -1.247 0 CA-C-O 123.024 1.392 . . . . 0.0 107.891 178.668 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.902 HD21 ' CG ' ' A' ' 48' ' ' ASP . 0.4 OUTLIER -105.35 -35.06 7.65 Favored 'General case' 0 C--N 1.286 -2.176 0 CA-C-N 114.43 -1.259 . . . . 0.0 107.62 177.488 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 19' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 20' ' ' CGU . . . . . 0.477 ' C ' ' N ' ' A' ' 22' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.775 ' C ' ' HB3' ' A' ' 17' ' ' CYS . . . 43.34 33.11 0.56 Allowed 'General case' 0 C--N 1.306 -1.299 0 CA-C-O 122.746 1.26 . . . . 0.0 108.698 -179.476 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.506 ' SG ' ' HB2' ' A' ' 26' ' ' CGU . 17.0 p 20.14 -142.2 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 CA-C-N 113.342 -1.754 . . . . 0.0 112.397 177.599 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.536 ' HB3' HD11 ' A' ' 5' ' ' LEU . 32.2 t -127.21 58.47 1.45 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.849 -1.157 . . . . 0.0 111.168 -178.4 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.596 ' HA ' ' CH2' ' A' ' 41' ' ' TRP . 0.2 OUTLIER 50.55 -90.12 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.234 -0.916 . . . . 0.0 111.229 178.372 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 25' ' ' CGU . . . . . 0.48 ' C ' ' O ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' CGU . . . . . 0.528 ' HG ' ' CG1' ' A' ' 8' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.61 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . . . -70.56 -22.8 62.55 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.932 -1.105 . . . . 0.0 110.427 -179.349 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 25' ' ' CGU . 1.3 ptm180 -65.64 -15.13 62.47 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.929 -1.107 . . . . 0.0 110.077 -179.305 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.668 HG13 HD13 ' A' ' 13' ' ' LEU . 1.7 p -87.2 -42.69 15.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 120.912 -1.117 . . . . 0.0 109.954 -179.914 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.595 ' CE1' ' O ' ' A' ' 27' ' ' ALA . 0.1 OUTLIER -116.67 136.63 52.81 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.922 -1.111 . . . . 0.0 111.025 -179.854 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 32' ' ' CGU . . . . . 0.445 OE11 ' O ' ' A' ' 32' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.592 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 0.8 OUTLIER -39.97 115.87 0.58 Allowed 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.648 -0.657 . . . . 0.0 111.583 -178.386 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.468 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -77.41 -27.57 52.4 Favored 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 106.477 -1.675 . . . . 0.0 106.477 177.432 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' CGU . . . . . 0.612 ' CD2' ' N ' ' A' ' 35' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.632 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 23.1 mt-30 -49.06 -35.71 16.51 Favored 'General case' 0 C--O 1.205 -1.289 0 C-N-CA 118.424 -1.311 . . . . 0.0 108.445 179.131 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.67 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -43.11 -59.35 2.08 Favored 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 117.709 -1.596 . . . . 0.0 107.317 178.502 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.584 ' O ' ' C ' ' A' ' 39' ' ' CGU . 1.0 OUTLIER -81.92 -68.45 0.7 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.277 -0.89 . . . . 0.0 109.405 177.195 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 39' ' ' CGU . . . . . 0.584 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.632 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 10.9 t80 -43.2 -56.29 3.52 Favored 'General case' 0 N--CA 1.486 1.364 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 178.468 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.67 ' CD1' ' O ' ' A' ' 37' ' ' THR . 9.9 m95 -77.07 177.35 7.88 Favored 'General case' 0 C--N 1.306 -1.304 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 176.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' SER . . . . . 0.567 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 0.1 OUTLIER 62.65 110.97 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.345 0 O-C-N 120.506 -1.371 . . . . 0.0 108.625 -179.992 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.567 ' CG ' ' O ' ' A' ' 42' ' ' SER . 0.0 OUTLIER 84.59 -25.48 0.13 Allowed 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 -178.617 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.714 ' O ' ' N ' ' A' ' 46' ' ' ASP . 1.0 OUTLIER -40.6 -63.72 0.61 Allowed 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.545 -179.948 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.513 ' C ' ' O ' ' A' ' 44' ' ' TYR . 5.6 ptmt -20.84 74.35 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.557 0 CA-C-O 121.238 0.542 . . . . 0.0 111.185 -179.469 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.714 ' N ' ' O ' ' A' ' 44' ' ' TYR . 3.8 t70 -161.82 18.46 0.1 Allowed 'General case' 0 N--CA 1.486 1.341 0 O-C-N 121.238 -0.914 . . . . 0.0 109.709 -178.382 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.552 ' O ' HD11 ' A' ' 18' ' ' LEU . . . 67.35 11.44 59.31 Favored Glycine 0 N--CA 1.492 2.403 0 N-CA-C 107.906 -2.078 . . . . 0.0 107.906 -177.685 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.902 ' CG ' HD21 ' A' ' 18' ' ' LEU . 0.3 OUTLIER 71.61 5.89 5.53 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.612 -0.934 . . . . 0.0 109.785 -179.644 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.595 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 2.9 mm100 78.09 -18.38 0.51 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.312 -0.867 . . . . 0.0 111.255 178.254 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.484 ' O ' ' HD3' ' A' ' 54' ' ' PRO . 0.1 OUTLIER -108.38 -18.27 13.79 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 120.756 -1.215 . . . . 0.0 110.157 -179.683 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.44 ' HG3' ' O ' ' A' ' 51' ' ' GLU . 1.9 tt0 -50.62 -20.07 1.1 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.173 -0.954 . . . . 0.0 111.238 -179.247 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.416 ' O ' ' C ' ' A' ' 53' ' ' HIS . . . -85.63 19.94 21.58 Favored Glycine 0 N--CA 1.495 2.585 0 O-C-N 120.813 -1.179 . . . . 0.0 110.867 -178.848 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.56 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 20.3 t-160 45.03 59.55 14.02 Favored Pre-proline 0 N--CA 1.492 1.647 0 O-C-N 120.892 -1.358 . . . . 0.0 109.086 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.56 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 5.5 Cg_exo -57.74 -53.11 4.88 Favored 'Trans proline' 0 C--N 1.309 -1.541 0 C-N-CA 122.658 2.239 . . . . 0.0 111.869 -179.568 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.559 ' SG ' ' CB ' ' A' ' 61' ' ' CYS . 3.6 m -60.32 175.41 0.43 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 120.836 -1.165 . . . . 0.0 110.046 -178.958 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.509 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 4.9 mt -148.87 -174.98 4.77 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-O 121.647 0.737 . . . . 0.0 109.121 179.198 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.634 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 22.5 m120 39.14 64.01 0.87 Allowed 'General case' 0 C--N 1.299 -1.591 0 CA-C-O 121.886 0.851 . . . . 0.0 109.662 -179.664 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.449 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 1.9 mm-40 51.75 35.74 16.02 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 121.667 0.746 . . . . 0.0 109.328 178.148 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -86.99 131.12 10.38 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.775 -1.33 . . . . 0.0 109.775 -179.76 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.484 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 88.9 m-70 -79.43 142.26 36.07 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.309 -1.112 . . . . 0.0 108.561 179.499 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.576 ' HA ' ' HA ' ' A' ' 70' ' ' CYS . 0.1 OUTLIER -116.13 127.23 54.66 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.075 -1.016 . . . . 0.0 110.137 -179.039 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.548 ' HB3' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER -79.05 -154.22 0.08 Allowed 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 106.595 -1.632 . . . . 0.0 106.595 177.569 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 63' ' ' BHD . . . . . 0.545 ' CG ' ' N ' ' A' ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.545 ' N ' ' CG ' ' A' ' 63' ' ' BHD . . . 179.26 175.67 46.37 Favored Glycine 0 N--CA 1.494 2.523 0 N-CA-C 108.389 -1.884 . . . . 0.0 108.389 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.692 HG23 ' HA ' ' A' ' 44' ' ' TYR . 35.9 mm -86.68 -66.59 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 120.744 -1.444 . . . . 0.0 110.341 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.425 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . -61.19 -12.57 31.55 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 -179.544 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.496 ' HA ' HE21 ' A' ' 49' ' ' GLN . 1.5 p-10 -178.1 -157.3 0.04 OUTLIER 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.201 -1.176 . . . . 0.0 110.357 179.378 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.697 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 2.0 p90 -156.15 -160.37 1.0 Allowed 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -178.632 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.548 ' OG1' ' HB3' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -151.04 177.67 9.94 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 177.955 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 70' ' ' CYS . . . . . 0.576 ' HA ' ' HA ' ' A' ' 61' ' ' CYS . 1.3 m -137.09 -174.47 3.75 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 120.674 -1.266 . . . . 0.0 109.4 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.484 ' HB ' ' HB2' ' A' ' 60' ' ' HIS . 0.7 OUTLIER -161.09 123.63 3.14 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 179.362 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.513 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 84.7 m -97.84 140.34 32.36 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.93 -1.106 . . . . 0.0 109.571 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.851 ' HB3' ' CE1' ' A' ' 76' ' ' PHE . . . -73.76 -176.39 2.39 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.073 -1.017 . . . . 0.0 110.659 -179.621 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -81.45 102.31 10.45 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-O 123.119 1.438 . . . . 0.0 108.265 178.362 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLY . . . . . 0.464 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 123.31 17.57 3.24 Favored Glycine 0 C--N 1.268 -3.238 0 CA-C-N 113.765 -1.561 . . . . 0.0 109.459 -179.332 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.851 ' CE1' ' HB3' ' A' ' 73' ' ' ALA . 4.8 m-85 -119.92 167.79 11.79 Favored 'General case' 0 C--N 1.294 -1.805 0 O-C-N 121.44 -1.035 . . . . 0.0 109.578 -178.316 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.51 ' CB ' ' HB2' ' A' ' 83' ' ' PHE . 3.7 mt-10 -160.41 171.01 19.83 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.038 -1.039 . . . . 0.0 110.355 -179.658 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.33 169.01 40.41 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 179.573 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.441 ' C ' ' HD3' ' A' ' 79' ' ' LYS . 1.0 OUTLIER -57.89 -55.81 30.1 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.303 -1.116 . . . . 0.0 109.318 179.897 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.509 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.2 OUTLIER -95.56 25.46 4.5 Favored 'General case' 0 C--N 1.287 -2.119 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.585 179.999 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 77' ' ' GLU . 6.6 m 69.7 11.6 7.9 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.84 -1.163 . . . . 0.0 109.021 -179.619 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 26.7 tt0 -42.06 -47.4 4.49 Favored 'General case' 0 N--CA 1.489 1.517 0 CA-C-O 121.446 0.641 . . . . 0.0 111.39 -179.71 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.619 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.6 OUTLIER -79.77 84.63 5.54 Favored 'General case' 0 C--N 1.295 -1.794 0 O-C-N 121.223 -0.923 . . . . 0.0 110.66 -178.328 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.598 ' HB3' ' ND2' ' A' ' 57' ' ' ASN . 3.9 p -67.42 94.5 0.4 Allowed 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.583 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.457 ' H ' HG23 ' A' ' 85' ' ' THR . 18.5 p -54.92 -21.38 11.44 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.172 -0.955 . . . . 0.0 109.924 -179.041 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.417 ' HD2' ' HA3' ' A' ' 75' ' ' GLY . 14.4 ptm180 . . . . . 0 C--N 1.289 -2.044 0 CA-C-O 118.033 -0.985 . . . . 0.0 109.556 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ALA . . . . . 0.42 ' O ' ' HB2' ' A' ' 2' ' ' ASN . . . . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 121.256 0.55 . . . . 0.0 109.536 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.441 ' O ' ' CB ' ' A' ' 3' ' ' SER . 6.8 m-20 61.18 76.88 0.35 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.238 -0.914 . . . . 0.0 109.395 -179.903 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.441 ' CB ' ' O ' ' A' ' 2' ' ' ASN . 0.2 OUTLIER 168.85 -169.75 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.251 -0.906 . . . . 0.0 109.402 179.955 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -63.29 -22.85 67.13 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.106 -0.996 . . . . 0.0 109.261 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.627 ' C ' ' H ' ' A' ' 7' ' ' CGU . 4.1 mp -68.81 -25.55 64.73 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.174 -0.953 . . . . 0.0 109.462 -179.854 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' CGU . . . . . 0.423 OE21 ' HA ' ' A' ' 6' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' CGU . . . . . 0.627 ' H ' ' C ' ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.715 HG23 ' O ' ' A' ' 8' ' ' VAL . 1.3 m -39.77 103.82 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.308 -1.217 0 CA-C-O 122.343 1.068 . . . . 0.0 109.86 -178.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.478 ' O ' ' O ' ' A' ' 10' ' ' GLN . 3.1 mtmt -63.57 84.93 0.03 OUTLIER 'General case' 0 C--N 1.283 -2.287 0 N-CA-C 106.868 -1.53 . . . . 0.0 106.868 178.359 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.478 ' O ' ' O ' ' A' ' 9' ' ' LYS . 3.5 tt0 56.01 158.67 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.335 0 O-C-N 121.536 -0.727 . . . . 0.0 109.442 -178.207 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.435 ' O ' ' HB2' ' A' ' 12' ' ' ASN . . . -104.1 -171.16 25.15 Favored Glycine 0 N--CA 1.491 2.301 0 C-N-CA 119.841 -1.171 . . . . 0.0 110.428 -179.005 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.563 ' HB3' ' CB ' ' A' ' 16' ' ' CGU . 0.6 OUTLIER 170.26 -179.93 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 -179.416 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.829 HD22 ' HB3' ' A' ' 31' ' ' PHE . 0.5 OUTLIER -84.75 -173.58 4.8 Favored 'General case' 0 C--N 1.312 -1.023 0 O-C-N 120.171 -1.58 . . . . 0.0 109.104 -179.772 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 14' ' ' CGU . . . . . 0.693 ' CD2' ' C ' ' A' ' 14' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.516 ' N ' OE12 ' A' ' 14' ' ' CGU . 4.2 mtp180 -76.37 -40.71 50.35 Favored 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 119.294 -0.962 . . . . 0.0 110.172 -178.84 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' CGU . . . . . 0.899 OE11 ' HB2' ' A' ' 21' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.81 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 28.2 m -61.79 -28.45 69.47 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.924 -1.11 . . . . 0.0 111.199 -178.124 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.423 ' C ' ' O ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -48.37 -24.56 1.27 Allowed 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 118.641 -1.224 . . . . 0.0 108.061 179.252 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 19' ' ' CGU . . . . . 0.444 ' N ' ' C ' ' A' ' 17' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.899 ' HB2' OE11 ' A' ' 16' ' ' CGU . . . -74.43 -41.78 60.26 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 120.526 -1.358 . . . . 0.0 110.07 -179.56 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.504 ' HB2' ' HB3' ' A' ' 17' ' ' CYS . 1.4 m -149.57 168.59 23.11 Favored 'General case' 0 C--N 1.292 -1.909 0 O-C-N 121.549 -0.719 . . . . 0.0 109.178 178.892 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.548 ' O ' ' CB ' ' A' ' 24' ' ' LEU . 0.7 OUTLIER -85.29 31.62 0.57 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.158 -0.964 . . . . 0.0 110.502 -178.986 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.548 ' CB ' ' O ' ' A' ' 23' ' ' SER . 0.1 OUTLIER 81.26 -40.24 0.14 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.409 -0.807 . . . . 0.0 110.31 179.665 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 25' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 26' ' ' CGU . . . . . 0.491 ' CD2' HG21 ' A' ' 30' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.68 62.18 5.4 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.105 -0.997 . . . . 0.0 110.213 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.517 ' O ' ' CB ' ' A' ' 29' ' ' CGU . 26.3 ptt180 -159.4 110.75 2.05 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 178.416 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' CGU . . . . . 0.517 ' CB ' ' O ' ' A' ' 28' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.491 HG21 ' CD2' ' A' ' 26' ' ' CGU . 2.1 t -80.25 -14.79 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 O-C-N 120.87 -1.144 . . . . 0.0 108.38 179.306 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.829 ' HB3' HD22 ' A' ' 13' ' ' LEU . 0.0 OUTLIER -127.09 139.21 53.15 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 121.381 -0.825 . . . . 0.0 109.772 -179.695 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 32' ' ' CGU . . . . . 0.55 ' O ' ' N ' ' A' ' 34' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.64 ' HB2' ' CD2' ' A' ' 31' ' ' PHE . 0.9 OUTLIER -38.63 90.88 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 121.379 0.609 . . . . 0.0 110.57 -179.787 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.55 ' N ' ' O ' ' A' ' 32' ' ' CGU . . . -80.38 -28.03 38.05 Favored 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.68 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 65.8 mt-30 -52.86 -34.81 56.06 Favored 'General case' 0 C--O 1.202 -1.41 0 C-N-CA 117.99 -1.484 . . . . 0.0 108.261 179.256 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.647 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -42.54 -59.3 1.94 Allowed 'General case' 0 N--CA 1.499 2.014 0 O-C-N 119.797 -1.814 . . . . 0.0 107.571 178.4 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.611 ' O ' ' C ' ' A' ' 39' ' ' CGU . 2.0 t70 -82.13 -68.09 0.73 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.43 -0.794 . . . . 0.0 109.305 177.354 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' CGU . . . . . 0.611 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.68 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 18.5 t80 -40.23 -55.72 2.1 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 178.128 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.647 ' CD1' ' O ' ' A' ' 37' ' ' THR . 9.1 m95 -80.99 172.02 14.26 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.878 -0.514 . . . . 0.0 109.857 178.505 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 76.47 -59.8 0.49 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.532 -0.73 . . . . 0.0 112.254 177.632 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.565 ' HD2' ' CD1' ' A' ' 39' ' ' CGU . 0.0 OUTLIER -101.74 11.05 39.43 Favored 'General case' 0 C--N 1.28 -2.432 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 178.489 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.607 ' O ' ' N ' ' A' ' 46' ' ' ASP . 0.8 OUTLIER -56.9 -76.22 0.04 OUTLIER 'General case' 0 C--N 1.307 -1.248 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 179.589 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.549 ' C ' ' O ' ' A' ' 44' ' ' TYR . 7.1 mttt 9.85 55.55 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.419 0 CA-C-O 121.172 0.511 . . . . 0.0 112.144 179.095 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.607 ' N ' ' O ' ' A' ' 44' ' ' TYR . 0.9 OUTLIER -156.35 8.55 0.22 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.131 -0.981 . . . . 0.0 110.056 -179.667 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.571 ' O ' ' CB ' ' A' ' 48' ' ' ASP . . . 86.03 -48.46 3.95 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 108.636 -1.785 . . . . 0.0 108.636 -179.147 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.571 ' CB ' ' O ' ' A' ' 47' ' ' GLY . 16.1 p-10 140.42 -10.04 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.247 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 179.561 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.594 ' NE2' ' O ' ' A' ' 65' ' ' ILE . 0.0 OUTLIER 77.78 -15.99 0.7 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.754 -0.591 . . . . 0.0 110.858 -179.547 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 50' ' ' CYS . . . . . 0.518 ' HB2' ' OD1' ' A' ' 63' ' ' BHD . 20.2 t -99.23 -21.09 16.26 Favored 'General case' 0 N--CA 1.487 1.403 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 176.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.489 ' HB2' ' OD1' ' A' ' 48' ' ' ASP . 21.9 tt0 -58.93 148.89 28.74 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 121.319 -0.863 . . . . 0.0 108.899 179.248 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.462 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . 102.2 -22.25 38.57 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 109.357 -1.497 . . . . 0.0 109.357 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.546 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 0.6 OUTLIER 68.8 58.24 0.64 Allowed Pre-proline 0 N--CA 1.49 1.56 0 O-C-N 121.456 -1.026 . . . . 0.0 109.847 -179.954 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.546 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 3.2 Cg_exo -57.05 -35.09 98.8 Favored 'Trans proline' 0 C--N 1.31 -1.494 0 C-N-CA 122.36 2.04 . . . . 0.0 110.317 179.327 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.538 ' O ' ' CE1' ' A' ' 53' ' ' HIS . 0.2 OUTLIER -75.28 164.2 26.69 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.576 -0.703 . . . . 0.0 109.197 -179.617 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.505 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.8 mt -145.0 -175.34 4.65 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.241 -0.912 . . . . 0.0 110.037 179.724 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.602 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 0.9 OUTLIER 42.59 63.63 1.38 Allowed 'General case' 0 C--N 1.299 -1.605 0 CA-C-O 121.931 0.872 . . . . 0.0 109.143 -179.965 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.433 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 2.2 mm100 51.61 32.66 9.45 Favored 'General case' 0 C--N 1.301 -1.532 0 C-N-CA 119.934 -0.706 . . . . 0.0 109.771 177.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -82.2 139.35 19.66 Favored Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.367 -1.493 . . . . 0.0 109.367 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -79.76 149.69 31.03 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.264 -1.139 . . . . 0.0 109.095 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.446 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 44.3 t -116.12 124.78 51.21 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.106 -0.996 . . . . 0.0 110.144 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.546 ' HB2' ' OG1' ' A' ' 69' ' ' THR . 80.5 mttt -102.3 -169.12 1.63 Allowed 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 177.882 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' BHD . . . . . 0.559 ' HA ' ' HA ' ' A' ' 68' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.651 ' O ' ' N ' ' A' ' 66' ' ' GLY . . . 119.75 63.2 0.27 Allowed Glycine 0 N--CA 1.492 2.385 0 N-CA-C 109.121 -1.592 . . . . 0.0 109.121 -178.985 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.892 HD12 ' H ' ' A' ' 66' ' ' GLY . 0.6 OUTLIER 19.74 -71.01 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.511 2.611 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -178.726 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.892 ' H ' HD12 ' A' ' 65' ' ' ILE . . . -32.7 -36.33 0.04 OUTLIER Glycine 0 N--CA 1.502 3.05 0 N-CA-C 109.222 -1.551 . . . . 0.0 109.222 -179.295 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.556 ' HA ' ' OE1' ' A' ' 49' ' ' GLN . 3.1 p-10 175.84 -162.87 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 177.584 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.644 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 1.0 OUTLIER -131.18 -176.48 4.03 Favored 'General case' 0 C--N 1.291 -1.971 0 O-C-N 121.01 -1.056 . . . . 0.0 108.341 179.934 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.546 ' OG1' ' HB2' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -148.5 109.83 4.39 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 120.821 -1.174 . . . . 0.0 109.537 179.342 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 66.8 m -84.47 -174.15 5.12 Favored 'General case' 0 C--N 1.292 -1.904 0 CA-C-O 122.149 0.976 . . . . 0.0 109.608 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 10.3 m -161.35 144.21 12.41 Favored 'General case' 0 C--N 1.286 -2.195 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.31 179.785 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' CYS . . . . . 0.542 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 99.1 m -106.81 134.31 50.15 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.144 -0.973 . . . . 0.0 108.991 179.522 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.916 ' HB3' ' CE1' ' A' ' 76' ' ' PHE . . . -64.92 -175.12 0.17 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.943 -1.098 . . . . 0.0 111.076 -179.092 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -81.5 101.56 10.0 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-O 123.114 1.435 . . . . 0.0 108.307 178.452 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLY . . . . . 0.437 ' O ' ' OG1' ' A' ' 85' ' ' THR . . . 120.3 16.54 4.71 Favored Glycine 0 C--N 1.269 -3.192 0 N-CA-C 109.146 -1.581 . . . . 0.0 109.146 -179.23 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.916 ' CE1' ' HB3' ' A' ' 73' ' ' ALA . 4.2 m-85 -113.31 164.38 13.64 Favored 'General case' 0 C--N 1.293 -1.856 0 O-C-N 121.443 -1.034 . . . . 0.0 109.23 -178.434 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.487 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 0.0 OUTLIER -160.52 170.11 21.59 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.004 -1.06 . . . . 0.0 110.335 -179.372 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 97.2 173.36 34.19 Favored Glycine 0 N--CA 1.488 2.14 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 179.749 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.3 tmtt? -60.2 -57.8 11.24 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.343 -1.092 . . . . 0.0 109.234 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.505 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 1.0 OUTLIER -98.59 27.47 4.81 Favored 'General case' 0 C--N 1.287 -2.113 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 179.428 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 57' ' ' ASN . 4.6 m 71.71 7.83 6.0 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.99 -1.069 . . . . 0.0 109.422 -179.898 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.424 ' C ' ' O ' ' A' ' 81' ' ' CYS . 41.1 tt0 -36.34 -44.62 0.43 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.542 -0.724 . . . . 0.0 111.489 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.607 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.9 OUTLIER -80.47 86.82 5.73 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.269 -0.894 . . . . 0.0 110.424 -178.607 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.544 ' CB ' ' OD1' ' A' ' 57' ' ' ASN . 0.2 OUTLIER -74.66 92.2 2.42 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.416 -0.802 . . . . 0.0 109.164 179.345 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.437 ' OG1' ' O ' ' A' ' 75' ' ' GLY . 10.5 p -72.61 -14.4 61.6 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.22 -0.925 . . . . 0.0 109.694 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.466 ' HD3' ' CZ ' ' A' ' 76' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.78 0 CA-C-O 117.995 -1.002 . . . . 0.0 109.633 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 1.1 m120 54.96 86.67 0.05 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.229 -0.92 . . . . 0.0 109.326 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 5.5 t -131.12 -171.1 2.5 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.268 -0.895 . . . . 0.0 109.714 -179.821 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.573 ' CZ ' ' O ' ' A' ' 21' ' ' ALA . 2.3 p90 -80.7 14.58 2.06 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.323 -0.861 . . . . 0.0 110.194 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.72 HD11 ' HB3' ' A' ' 23' ' ' SER . 0.2 OUTLIER -63.95 -30.78 71.83 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 120.926 -1.109 . . . . 0.0 109.831 -179.632 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 6' ' ' CGU . . . . . 0.453 OE12 ' HB3' ' A' ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' CGU . . . . . 0.473 ' O ' ' N ' ' A' ' 9' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.781 HG23 ' O ' ' A' ' 8' ' ' VAL . 3.6 m -39.66 98.46 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.307 -1.25 0 CA-C-O 122.83 1.3 . . . . 0.0 110.18 -178.617 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.549 ' O ' ' CB ' ' A' ' 10' ' ' GLN . 2.6 mmpt? -55.82 -17.31 5.93 Favored 'General case' 0 C--N 1.283 -2.301 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 178.918 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.714 ' HA ' HG21 ' A' ' 30' ' ' VAL . 1.2 tt0 85.44 109.72 0.05 Allowed 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 121.217 0.532 . . . . 0.0 109.735 179.586 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.478 ' O ' ' O ' ' A' ' 10' ' ' GLN . . . -61.02 -135.19 0.01 OUTLIER Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.043 -1.623 . . . . 0.0 109.043 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.535 ' HB2' ' CB ' ' A' ' 16' ' ' CGU . 0.3 OUTLIER -169.58 -46.61 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.398 0 O-C-N 120.763 -1.433 . . . . 0.0 110.798 179.787 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.551 ' O ' ' CG ' ' A' ' 14' ' ' CGU . 0.0 OUTLIER -167.12 -22.4 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.227 0 O-C-N 120.398 -1.439 . . . . 0.0 111.223 -179.959 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 14' ' ' CGU . . . . . 0.551 ' CG ' ' O ' ' A' ' 13' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.512 ' NH1' ' HG3' ' A' ' 15' ' ' ARG . 9.1 mtm-85 -80.08 -21.39 43.4 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.543 -0.723 . . . . 0.0 111.322 -179.08 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' CGU . . . . . 0.535 ' CB ' ' HB2' ' A' ' 12' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.751 ' SG ' ' HB2' ' A' ' 27' ' ' ALA . 0.1 OUTLIER -166.52 42.27 0.06 Allowed 'General case' 0 N--CA 1.491 1.576 0 CA-C-O 124.013 1.863 . . . . 0.0 107.991 -178.918 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.789 HD11 ' HB3' ' A' ' 48' ' ' ASP . 0.2 OUTLIER -115.32 -2.05 12.74 Favored 'General case' 0 C--N 1.29 -1.987 0 O-C-N 120.857 -1.152 . . . . 0.0 109.319 178.868 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 19' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 20' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.573 ' O ' ' CZ ' ' A' ' 4' ' ' PHE . . . -89.28 32.43 0.84 Allowed 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.282 -0.886 . . . . 0.0 109.766 -179.718 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' CYS . . . . . 0.598 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 11.5 t -150.82 -47.67 0.12 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.334 -0.854 . . . . 0.0 110.341 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.72 ' HB3' HD11 ' A' ' 5' ' ' LEU . 7.8 t 84.26 -2.46 1.03 Allowed 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 -178.827 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.558 ' CB ' ' O ' ' A' ' 23' ' ' SER . 0.4 OUTLIER 83.66 -54.69 0.15 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.614 -0.679 . . . . 0.0 110.436 179.667 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 25' ' ' CGU . . . . . 0.463 ' O ' OE11 ' A' ' 29' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' CGU . . . . . 0.456 OE11 ' HA ' ' A' ' 26' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.751 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . . . -68.81 -26.37 65.15 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.099 -1.001 . . . . 0.0 109.814 -179.684 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.455 ' HG2' ' O ' ' A' ' 25' ' ' CGU . 8.1 ptm180 -91.82 -17.87 24.68 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.934 -1.104 . . . . 0.0 110.654 -179.27 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' CGU . . . . . 0.463 OE11 ' O ' ' A' ' 25' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.714 HG21 ' HA ' ' A' ' 10' ' ' GLN . 0.9 OUTLIER -93.08 -6.34 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 120.901 -1.124 . . . . 0.0 110.125 -179.104 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.59 ' CD1' ' O ' ' A' ' 27' ' ' ALA . 25.7 m-85 -100.0 96.1 7.31 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 120.893 -1.129 . . . . 0.0 111.055 -178.866 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' CGU . . . . . 0.432 ' O ' ' C ' ' A' ' 33' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.562 ' O ' HG23 ' A' ' 37' ' ' THR . 3.9 m-20 -39.88 111.74 0.22 Allowed 'General case' 0 C--N 1.305 -1.333 0 O-C-N 121.894 -0.504 . . . . 0.0 110.325 -179.323 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.521 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -78.37 -31.03 48.28 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 178.865 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.639 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 2.3 mm100 -53.95 -34.65 60.27 Favored 'General case' 0 C--O 1.205 -1.278 0 C-N-CA 118.846 -1.142 . . . . 0.0 108.676 179.013 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.671 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.2 OUTLIER -46.12 -59.0 3.14 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.259 -1.526 . . . . 0.0 107.797 178.952 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ASP . . . . . 0.6 ' O ' ' C ' ' A' ' 39' ' ' CGU . 3.0 t70 -80.68 -66.5 0.88 Allowed 'General case' 0 C--N 1.298 -1.665 0 O-C-N 121.17 -0.956 . . . . 0.0 109.91 178.733 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' CGU . . . . . 0.6 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.639 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 6.4 t80 -46.96 -46.94 21.86 Favored 'General case' 0 C--N 1.299 -1.618 0 O-C-N 121.62 -0.675 . . . . 0.0 110.36 179.467 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.671 ' CD1' ' O ' ' A' ' 37' ' ' THR . 6.8 m95 -80.35 -67.5 0.76 Allowed 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.452 -0.78 . . . . 0.0 112.304 -178.611 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -57.34 -50.08 74.08 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.516 -1.365 . . . . 0.0 110.356 -177.883 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.789 ' HD3' HG23 ' A' ' 65' ' ' ILE . 0.7 OUTLIER -81.87 2.14 31.75 Favored 'General case' 0 C--N 1.287 -2.136 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 179.624 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.687 ' O ' ' N ' ' A' ' 46' ' ' ASP . 1.0 OUTLIER -46.43 -70.39 0.1 Allowed 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.379 -0.826 . . . . 0.0 109.182 -179.913 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.542 ' C ' ' O ' ' A' ' 44' ' ' TYR . 3.1 ptmt -9.75 69.05 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.647 0 CA-C-O 121.366 0.603 . . . . 0.0 111.797 -179.481 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.687 ' N ' ' O ' ' A' ' 44' ' ' TYR . 2.4 t0 -162.13 -30.44 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.4 -0.813 . . . . 0.0 110.077 -179.109 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.48 ' O ' ' OD2' ' A' ' 48' ' ' ASP . . . 98.61 13.97 39.23 Favored Glycine 0 N--CA 1.486 2.003 0 N-CA-C 107.83 -2.108 . . . . 0.0 107.83 -177.754 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.789 ' HB3' HD11 ' A' ' 18' ' ' LEU . 0.0 OUTLIER 74.6 11.35 3.94 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.784 -0.833 . . . . 0.0 109.358 -179.628 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.66 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 34.5 mm-40 73.85 -10.79 1.04 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.807 -0.558 . . . . 0.0 111.125 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 15.0 t -114.83 -11.45 12.24 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.665 -1.272 . . . . 0.0 110.088 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.471 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 53.5 tt0 -74.12 152.73 39.81 Favored 'General case' 0 N--CA 1.483 1.223 0 O-C-N 120.888 -1.132 . . . . 0.0 109.135 179.884 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.463 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . 94.27 -14.07 66.05 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' HIS . . . . . 0.463 ' HB3' ' O ' ' A' ' 52' ' ' GLY . 1.2 t60 68.42 69.6 0.44 Allowed Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.336 -1.096 . . . . 0.0 109.343 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' PRO . . . . . 0.45 ' HG2' ' SG ' ' A' ' 61' ' ' CYS . 5.7 Cg_exo -59.67 -39.83 70.35 Favored 'Trans proline' 0 C--N 1.31 -1.479 0 C-N-CA 122.45 2.1 . . . . 0.0 110.61 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.494 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 0.6 OUTLIER -84.77 177.89 7.85 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.338 -0.851 . . . . 0.0 109.302 -179.863 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.518 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.5 mt -140.08 -175.37 4.22 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 179.199 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ASN . . . . . 0.586 ' HB3' ' CD2' ' A' ' 76' ' ' PHE . 4.9 m-80 48.49 56.43 7.53 Favored 'General case' 0 C--N 1.296 -1.729 0 CA-C-O 121.718 0.771 . . . . 0.0 110.943 178.013 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 1.3 mm-40 47.06 30.15 1.25 Allowed 'General case' 0 C--N 1.301 -1.507 0 CA-C-O 121.439 0.638 . . . . 0.0 109.873 177.455 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -79.08 150.92 34.49 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.198 -1.561 . . . . 0.0 109.198 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.518 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 3.1 t60 -79.64 156.47 27.6 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.98 -1.306 . . . . 0.0 108.772 179.585 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' CYS . . . . . 0.494 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 0.6 OUTLIER -124.56 116.98 23.32 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.18 -0.95 . . . . 0.0 109.948 -179.082 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.503 ' HB3' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER -79.12 -173.05 3.41 Favored 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 106.91 -1.515 . . . . 0.0 106.91 177.755 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 63' ' ' BHD . . . . . 0.503 ' CG ' ' N ' ' A' ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLY . . . . . 0.574 ' O ' ' O ' ' A' ' 67' ' ' ASP . . . 137.03 134.46 3.28 Favored Glycine 0 N--CA 1.493 2.479 0 N-CA-C 108.079 -2.008 . . . . 0.0 108.079 -179.26 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ILE . . . . . 0.789 HG23 ' HD3' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -51.76 -61.94 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 119.881 -1.952 . . . . 0.0 109.316 -179.136 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.69 ' N ' HG22 ' A' ' 65' ' ' ILE . . . -43.19 -50.1 6.47 Favored Glycine 0 N--CA 1.493 2.482 0 N-CA-C 109.964 -1.254 . . . . 0.0 109.964 -179.34 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.574 ' O ' ' O ' ' A' ' 64' ' ' GLY . 6.4 p-10 -164.89 -147.8 0.1 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.41 -1.053 . . . . 0.0 109.278 179.71 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.66 ' CD1' ' HB3' ' A' ' 49' ' ' GLN . 2.5 p90 -159.8 -165.15 1.45 Allowed 'General case' 0 C--N 1.296 -1.751 0 O-C-N 120.501 -1.374 . . . . 0.0 109.352 -179.45 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.503 ' OG1' ' HB3' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -149.43 -177.48 5.88 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 107.324 -1.362 . . . . 0.0 107.324 178.989 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.7 m -139.61 -173.29 3.58 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 120.601 -1.312 . . . . 0.0 108.563 179.158 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.518 ' HB ' ' HB3' ' A' ' 60' ' ' HIS . 1.5 m -161.08 139.92 10.08 Favored 'General case' 0 C--N 1.292 -1.931 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 179.334 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 95.0 m -104.15 141.99 35.28 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.952 -1.093 . . . . 0.0 109.365 179.697 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.557 ' HB3' ' CD1' ' A' ' 76' ' ' PHE . . . -77.16 177.66 7.67 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.222 -0.924 . . . . 0.0 109.8 -179.756 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -80.56 102.34 9.71 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-O 123.399 1.571 . . . . 0.0 107.839 178.526 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLY . . . . . 0.632 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 127.27 25.58 1.17 Allowed Glycine 0 C--N 1.267 -3.302 0 CA-C-N 113.299 -1.773 . . . . 0.0 109.896 -179.556 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.632 ' CD1' ' C ' ' A' ' 75' ' ' GLY . 58.2 m-85 -141.37 159.88 41.28 Favored 'General case' 0 C--N 1.287 -2.115 0 O-C-N 121.174 -1.192 . . . . 0.0 110.05 -177.815 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLU . . . . . 0.503 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 2.5 mt-10 -150.36 175.21 12.04 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.172 -0.955 . . . . 0.0 110.239 -178.929 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 95.47 168.02 35.48 Favored Glycine 0 N--CA 1.491 2.327 0 N-CA-C 110.191 -1.164 . . . . 0.0 110.191 179.348 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.469 ' C ' ' HD3' ' A' ' 79' ' ' LYS . 4.6 tmtt? -55.86 -57.77 10.65 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.466 -1.02 . . . . 0.0 109.158 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ASN . . . . . 0.518 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 1.1 m-20 -94.43 25.86 3.69 Favored 'General case' 0 C--N 1.287 -2.113 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 179.418 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.579 ' HB2' ' HB2' ' A' ' 57' ' ' ASN . 4.1 m 66.36 14.85 9.89 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 120.818 -1.176 . . . . 0.0 108.41 -179.211 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -46.53 -42.44 15.77 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.769 -0.582 . . . . 0.0 112.122 -179.284 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.607 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.8 OUTLIER -79.32 85.09 5.18 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.169 -0.957 . . . . 0.0 111.135 -178.035 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 84' ' ' SER . . . . . 0.546 ' CB ' ' OD1' ' A' ' 57' ' ' ASN . 0.4 OUTLIER -68.64 109.27 3.7 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 178.232 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.46 ' O ' ' C ' ' A' ' 86' ' ' ARG . 33.3 p -92.02 -32.91 15.03 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.997 -1.064 . . . . 0.0 109.807 -179.334 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ARG . . . . . 0.46 ' C ' ' O ' ' A' ' 85' ' ' THR . 0.1 OUTLIER . . . . . 0 C--N 1.289 -2.05 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.202 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.864 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 84.9 m . . . . . 0 N--CA 1.494 1.755 0 CA-C-O 121.382 0.61 . . . . 0.0 109.758 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.801 HD11 ' CG ' ' A' ' 48' ' ' ASP . 0.2 OUTLIER . . . . . 0 C--N 1.299 -1.622 0 CA-C-O 121.795 0.807 . . . . 0.0 110.018 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.864 ' HB3' ' HA ' ' A' ' 17' ' ' CYS . . . . . . . . 0 N--CA 1.489 1.505 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.419 ' SG ' ' C ' ' A' ' 21' ' ' ALA . 0.5 OUTLIER -151.98 -170.35 3.62 Favored 'General case' 0 C--N 1.289 -2.024 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.936 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 35.5 p -175.96 -35.27 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.771 ' O ' HD13 ' A' ' 24' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--N 1.303 -1.448 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 179.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.706 0 CA-C-O 121.426 0.631 . . . . 0.0 110.602 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.581 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 24.6 ptt180 . . . . . 0 C--N 1.3 -1.559 0 N-CA-C 106.634 -1.617 . . . . 0.0 106.634 177.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.4 t . . . . . 0 N--CA 1.485 1.278 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.7 ' CD1' ' N ' ' A' ' 31' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.306 -1.295 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.667 ' O ' HG23 ' A' ' 37' ' ' THR . 50.7 p-10 . . . . . 0 N--CA 1.479 0.98 0 CA-C-O 121.211 0.529 . . . . 0.0 111.559 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.407 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 N--CA 1.49 1.537 0 O-C-N 121.272 -0.892 . . . . 0.0 109.056 178.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.744 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 2.0 mt-30 . . . . . 0 C--O 1.2 -1.522 0 N-CA-C 105.907 -1.886 . . . . 0.0 105.907 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.753 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 40.7 p -41.37 -59.46 1.55 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 120.045 -1.659 . . . . 0.0 106.763 177.037 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.485 ' O ' ' O ' ' A' ' 41' ' ' TRP . 0.4 OUTLIER . . . . . 0 C--N 1.287 -2.109 0 O-C-N 121.166 -0.959 . . . . 0.0 109.745 177.152 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.744 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 12.5 t80 . . . . . 0 N--CA 1.489 1.476 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.753 ' CD1' ' O ' ' A' ' 37' ' ' THR . 7.6 m95 -80.63 -171.0 2.88 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 177.239 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.599 ' O ' ' CB ' ' A' ' 43' ' ' LYS . 54.8 p 42.13 87.74 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.874 0 O-C-N 120.577 -1.327 . . . . 0.0 109.904 179.098 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.933 ' HD2' HD13 ' A' ' 65' ' ' ILE . 4.9 ptpt 115.19 5.55 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 -179.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.633 ' HA ' HG22 ' A' ' 65' ' ' ILE . 0.7 OUTLIER -80.7 -95.34 0.04 OUTLIER 'General case' 0 C--O 1.206 -1.212 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 179.489 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.599 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.0 OUTLIER 12.61 55.3 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.597 0 CA-C-O 121.326 0.584 . . . . 0.0 111.17 179.346 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.599 ' N ' ' O ' ' A' ' 44' ' ' TYR . 11.6 t0 -143.98 16.76 1.76 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.325 -0.859 . . . . 0.0 108.979 -178.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.646 ' O ' HD21 ' A' ' 18' ' ' LEU . . . 75.29 2.86 68.53 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 107.86 -2.096 . . . . 0.0 107.86 -177.477 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.801 ' CG ' HD11 ' A' ' 18' ' ' LEU . 0.0 OUTLIER 88.55 7.16 0.16 Allowed 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -179.358 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.719 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 1.6 mt-30 72.47 -23.44 0.2 Allowed 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 120.403 -0.519 . . . . 0.0 112.275 178.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . 0.486 ' O ' ' HD3' ' A' ' 54' ' ' PRO . 17.1 t -93.55 -21.24 19.56 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 120.632 -1.292 . . . . 0.0 107.727 178.311 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -55.99 139.65 45.86 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 179.105 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 101.65 -13.04 58.1 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.427 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 31.7 t60 65.85 63.33 0.99 Allowed Pre-proline 0 N--CA 1.489 1.486 0 O-C-N 121.333 -1.098 . . . . 0.0 109.968 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.486 ' HD3' ' O ' ' A' ' 50' ' ' CYS . 3.5 Cg_exo -60.77 -39.35 63.6 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 C-N-CA 122.25 1.966 . . . . 0.0 110.167 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.469 ' SG ' ' O ' ' A' ' 60' ' ' HIS . 1.9 m -78.42 162.24 26.55 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.56 -0.712 . . . . 0.0 109.372 -179.466 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.528 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 6.0 mt -145.57 -173.85 4.24 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.994 -1.066 . . . . 0.0 110.658 -179.299 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.603 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 0.9 OUTLIER 43.83 64.51 1.25 Allowed 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 121.831 0.824 . . . . 0.0 108.99 -179.486 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.447 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 5.2 mm-40 51.14 31.02 6.13 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.226 177.715 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.433 ' HA2' ' O ' ' A' ' 71' ' ' THR . . . -83.05 141.61 20.9 Favored Glycine 0 N--CA 1.488 2.135 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.475 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 97.8 m-70 -79.23 -164.04 0.57 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.219 -1.165 . . . . 0.0 108.059 179.16 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.457 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 12.5 t -160.77 120.03 2.64 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.553 -1.342 . . . . 0.0 110.922 -179.393 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.494 1.762 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 178.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.608 ' O ' HD12 ' A' ' 65' ' ' ILE . . . . . . . . 0 N--CA 1.495 2.599 0 N-CA-C 111.459 -0.656 . . . . 0.0 111.459 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.933 HD13 ' HD2' ' A' ' 43' ' ' LYS . 2.4 pp 34.59 -165.22 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.511 2.585 0 CA-C-N 118.299 1.049 . . . . 0.0 109.964 -179.184 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.498 ' O ' ' CG ' ' A' ' 67' ' ' ASP . . . 47.51 30.67 6.38 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 106.326 -2.71 . . . . 0.0 106.326 -178.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.602 ' OD1' ' N ' ' A' ' 68' ' ' TYR . 0.4 OUTLIER 85.58 -171.75 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.507 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 -176.287 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.719 ' CD1' ' HB3' ' A' ' 49' ' ' GLN . 1.0 OUTLIER -137.67 -162.14 1.26 Allowed 'General case' 0 C--N 1.285 -2.229 0 O-C-N 120.345 -1.472 . . . . 0.0 108.376 -178.218 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -148.76 165.22 32.07 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 178.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 61' ' ' CYS . 22.6 m -132.05 -165.57 1.61 Allowed 'General case' 0 C--N 1.293 -1.856 0 O-C-N 120.637 -1.29 . . . . 0.0 108.019 179.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.475 ' HB ' ' HB2' ' A' ' 60' ' ' HIS . 0.7 OUTLIER -160.15 118.41 2.65 Favored 'General case' 0 C--N 1.297 -1.705 0 O-C-N 121.1 -1.0 . . . . 0.0 109.618 179.516 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.556 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 59.3 m -96.76 139.56 32.64 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.137 -0.977 . . . . 0.0 109.33 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.996 ' HB3' ' CE1' ' A' ' 76' ' ' PHE . . . -71.64 -176.05 1.5 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.114 -0.991 . . . . 0.0 110.467 -179.6 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -81.42 102.02 10.23 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-O 123.149 1.452 . . . . 0.0 108.152 178.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . 0.485 ' HA3' ' HD3' ' A' ' 86' ' ' ARG . . . 121.21 21.7 3.04 Favored Glycine 0 C--N 1.268 -3.236 0 CA-C-N 113.663 -1.608 . . . . 0.0 109.195 -179.122 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.996 ' CE1' ' HB3' ' A' ' 73' ' ' ALA . 4.7 m-85 -116.43 166.22 12.33 Favored 'General case' 0 C--N 1.295 -1.801 0 O-C-N 121.581 -0.952 . . . . 0.0 109.423 -178.225 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.476 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 3.6 mt-10 -159.95 170.76 20.69 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 120.775 -1.203 . . . . 0.0 110.458 -179.331 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.83 166.0 39.6 Favored Glycine 0 N--CA 1.489 2.2 0 N-CA-C 109.678 -1.369 . . . . 0.0 109.678 179.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.467 ' C ' ' HD3' ' A' ' 79' ' ' LYS . 2.3 tmtt? -55.77 -56.19 23.39 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.255 -1.144 . . . . 0.0 109.139 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.528 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.9 OUTLIER -94.06 30.19 1.95 Allowed 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 179.856 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . 0.486 ' O ' ' HB2' ' A' ' 57' ' ' ASN . 3.1 m 61.2 14.43 5.54 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.867 -1.146 . . . . 0.0 108.622 -179.527 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -44.5 -46.54 9.8 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.601 -0.687 . . . . 0.0 111.456 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.601 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.5 OUTLIER -81.16 84.45 6.55 Favored 'General case' 0 C--N 1.297 -1.687 0 O-C-N 121.401 -0.812 . . . . 0.0 110.751 -178.406 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.518 ' N ' ' OD1' ' A' ' 57' ' ' ASN . 0.1 OUTLIER -66.73 94.42 0.3 Allowed 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 178.473 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.459 ' OG1' ' HG3' ' A' ' 86' ' ' ARG . 20.0 p -49.05 -29.62 5.28 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.185 -0.947 . . . . 0.0 110.239 -178.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.485 ' HD3' ' HA3' ' A' ' 75' ' ' GLY . 9.4 mtp180 . . . . . 0 C--N 1.289 -2.055 0 CA-C-O 117.995 -1.003 . . . . 0.0 109.642 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.692 ' O ' ' HB2' ' A' ' 18' ' ' LEU . 9.9 p . . . . . 0 N--CA 1.501 2.112 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.692 ' HB2' ' O ' ' A' ' 17' ' ' CYS . 1.9 mm? . . . . . 0 N--CA 1.503 2.182 0 C-N-CA 124.059 0.943 . . . . 0.0 109.891 178.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.768 0 CA-C-O 121.912 0.863 . . . . 0.0 109.745 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 30.1 p -119.66 167.87 11.6 Favored 'General case' 0 C--N 1.292 -1.932 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.437 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.513 ' O ' ' CB ' ' A' ' 24' ' ' LEU . 42.3 t -87.76 1.33 54.14 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.214 -0.929 . . . . 0.0 109.082 179.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.513 ' CB ' ' O ' ' A' ' 23' ' ' SER . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.631 0 O-C-N 121.429 -0.794 . . . . 0.0 109.832 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.862 0 CA-C-O 120.774 0.321 . . . . 0.0 110.637 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.507 ' HG2' ' NH1' ' A' ' 28' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.423 0 O-C-N 120.766 -1.209 . . . . 0.0 111.571 -179.276 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.0 p . . . . . 0 N--CA 1.494 1.765 0 CA-C-O 121.36 0.6 . . . . 0.0 109.736 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 . . . . . 0 N--CA 1.492 1.632 0 O-C-N 121.351 -0.843 . . . . 0.0 109.944 -179.656 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.602 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 1.5 m-20 . . . . . 0 N--CA 1.485 1.325 0 CA-C-O 121.274 0.559 . . . . 0.0 110.752 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.515 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 N--CA 1.485 1.287 0 N-CA-C 107.494 -1.298 . . . . 0.0 107.494 178.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.635 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 13.2 mm100 . . . . . 0 C--O 1.206 -1.218 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.72 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -40.97 -58.43 1.72 Allowed 'General case' 0 N--CA 1.499 1.991 0 C-N-CA 117.743 -1.583 . . . . 0.0 107.33 178.569 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.465 ' O ' ' N ' ' A' ' 41' ' ' TRP . 0.6 OUTLIER . . . . . 0 C--N 1.298 -1.631 0 O-C-N 121.115 -0.99 . . . . 0.0 109.493 177.291 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.663 ' O ' ' HB2' ' A' ' 44' ' ' TYR . 9.6 t80 . . . . . 0 C--O 1.205 -1.265 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.72 ' CD1' ' O ' ' A' ' 37' ' ' THR . 7.1 m95 -79.46 -179.79 7.01 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 120.83 -1.169 . . . . 0.0 108.593 177.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.665 ' O ' ' CB ' ' A' ' 43' ' ' LYS . 1.5 t 36.84 92.86 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.659 -0.651 . . . . 0.0 110.2 179.259 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.665 ' CB ' ' O ' ' A' ' 42' ' ' SER . 0.0 OUTLIER 123.14 -33.33 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 106.235 -1.765 . . . . 0.0 106.235 -178.789 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.663 ' HB2' ' O ' ' A' ' 40' ' ' PHE . 0.1 OUTLIER -55.05 -73.66 0.05 Allowed 'General case' 0 C--N 1.299 -1.614 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.58 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.593 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -0.69 68.96 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.662 0 CA-C-O 121.457 0.646 . . . . 0.0 111.137 179.435 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.602 ' N ' ' O ' ' A' ' 44' ' ' TYR . 8.2 t70 -160.45 28.0 0.16 Allowed 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.381 -0.825 . . . . 0.0 109.204 -178.476 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.547 ' O ' HD11 ' A' ' 18' ' ' LEU . . . 67.31 12.1 60.33 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 108.272 -1.931 . . . . 0.0 108.272 -178.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.577 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 33.7 t70 71.72 21.4 4.32 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.817 -0.813 . . . . 0.0 109.611 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.61 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 52.9 mm-40 70.53 -10.63 0.68 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.843 -0.536 . . . . 0.0 112.142 178.473 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . 0.461 ' O ' ' HD3' ' A' ' 54' ' ' PRO . 52.9 t -114.6 -10.11 12.55 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.446 -1.409 . . . . 0.0 109.986 179.555 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.533 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 12.1 tm-20 -62.1 152.26 33.3 Favored 'General case' 0 N--CA 1.482 1.169 0 O-C-N 120.819 -1.176 . . . . 0.0 108.851 179.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.445 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . 93.52 -12.77 68.95 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 110.173 -1.171 . . . . 0.0 110.173 179.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.452 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 6.1 t60 68.84 66.08 0.52 Allowed Pre-proline 0 N--CA 1.492 1.651 0 O-C-N 120.982 -1.305 . . . . 0.0 109.234 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.461 ' HD3' ' O ' ' A' ' 50' ' ' CYS . 5.4 Cg_exo -60.86 -40.09 56.49 Favored 'Trans proline' 0 C--N 1.31 -1.494 0 C-N-CA 122.651 2.234 . . . . 0.0 111.302 -179.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.486 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 1.0 OUTLIER -83.61 174.05 10.87 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.118 -0.989 . . . . 0.0 109.947 -179.044 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.598 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.2 mt -147.07 -171.77 3.85 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.487 -0.758 . . . . 0.0 108.967 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.737 ' HB3' ' CD2' ' A' ' 76' ' ' PHE . 0.9 OUTLIER 48.71 57.14 6.66 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.419 -0.801 . . . . 0.0 110.055 179.727 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.45 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 0.7 OUTLIER 44.69 33.84 1.03 Allowed 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 178.17 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -83.3 153.7 30.76 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 -179.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.465 ' O ' ' SG ' ' A' ' 55' ' ' CYS . 0.1 OUTLIER -79.53 164.96 23.47 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.4 -1.059 . . . . 0.0 108.319 179.035 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.486 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 20.4 t -134.31 111.69 10.41 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.018 -1.051 . . . . 0.0 110.519 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.507 ' HB3' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.298 -1.656 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 177.46 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.427 ' O ' ' CG ' ' A' ' 49' ' ' GLN . . . . . . . . 0 N--CA 1.489 2.172 0 N-CA-C 107.618 -2.193 . . . . 0.0 107.618 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.63 HD12 ' HA ' ' A' ' 44' ' ' TYR . 10.2 mm -94.37 -67.42 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 120.619 -1.518 . . . . 0.0 110.014 179.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.5 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . -43.47 -26.94 0.72 Allowed Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.189 -1.565 . . . . 0.0 109.189 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.5 ' HB3' ' O ' ' A' ' 66' ' ' GLY . 6.6 p-10 175.54 -149.47 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.635 -0.921 . . . . 0.0 109.592 179.275 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.626 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 2.8 p90 -160.43 -165.1 1.36 Allowed 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 -179.399 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.507 ' OG1' ' HB3' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -147.82 179.26 7.85 Favored 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.535 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 3.8 m -141.23 -170.83 3.15 Favored 'General case' 0 C--N 1.297 -1.702 0 O-C-N 120.898 -1.126 . . . . 0.0 108.253 179.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.429 ' HB ' ' HB2' ' A' ' 60' ' ' HIS . 4.0 m -160.78 140.92 11.18 Favored 'General case' 0 C--N 1.292 -1.901 0 O-C-N 121.461 -0.775 . . . . 0.0 109.315 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 55.9 m -105.77 139.17 40.75 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.147 -0.971 . . . . 0.0 109.37 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.37 175.64 5.27 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.076 -1.015 . . . . 0.0 109.66 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -80.66 102.13 9.67 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 123.065 1.412 . . . . 0.0 107.668 178.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . 0.592 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 130.46 8.15 3.29 Favored Glycine 0 C--N 1.269 -3.17 0 CA-C-N 113.902 -1.499 . . . . 0.0 110.186 -179.352 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.737 ' CD2' ' HB3' ' A' ' 57' ' ' ASN . 13.8 m-85 -130.64 169.19 15.95 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 120.779 -1.424 . . . . 0.0 110.155 -178.547 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.473 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 2.3 mt-10 -160.56 174.52 13.92 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.104 -0.998 . . . . 0.0 110.046 -178.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 112.24 169.37 18.06 Favored Glycine 0 N--CA 1.493 2.47 0 N-CA-C 110.12 -1.192 . . . . 0.0 110.12 179.167 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.46 ' HD3' ' O ' ' A' ' 79' ' ' LYS . 3.1 tmtt? -56.98 -55.71 31.18 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.268 -1.137 . . . . 0.0 108.428 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.598 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.7 OUTLIER -99.75 26.97 5.73 Favored 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 178.183 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . 0.521 ' HB2' ' HB2' ' A' ' 57' ' ' ASN . 1.8 m 55.84 71.7 0.54 Allowed 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 105.389 -2.078 . . . . 0.0 105.389 -177.088 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.436 ' O ' ' HG3' ' A' ' 82' ' ' GLU . 0.5 OUTLIER -108.24 -30.9 8.12 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.373 -0.829 . . . . 0.0 110.266 -176.894 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.66 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -87.12 81.52 7.99 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.043 -1.035 . . . . 0.0 109.996 -179.792 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.22 108.88 0.46 Allowed 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 179.124 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.421 ' O ' ' OXT' ' A' ' 86' ' ' ARG . 5.0 p -85.89 -11.78 52.34 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.083 -1.011 . . . . 0.0 109.974 -179.29 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.554 ' NH1' ' HG3' ' A' ' 86' ' ' ARG . 0.3 OUTLIER . . . . . 0 C--N 1.297 -1.699 0 CA-C-O 118.104 -0.951 . . . . 0.0 109.467 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 1.027 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 42.1 m . . . . . 0 N--CA 1.49 1.536 0 CA-C-O 120.877 0.37 . . . . 0.0 110.435 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.5 HD22 ' HA ' ' A' ' 18' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.479 0 O-C-N 120.802 -1.186 . . . . 0.0 108.569 179.018 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 1.027 ' HB3' ' HA ' ' A' ' 17' ' ' CYS . . . . . . . . 0 N--CA 1.493 1.684 0 CA-C-O 121.678 0.752 . . . . 0.0 109.928 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.419 ' C ' ' OG ' ' A' ' 23' ' ' SER . 2.4 m -143.33 -44.35 0.29 Allowed 'General case' 0 C--N 1.289 -2.031 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 179.268 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.511 ' O ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER 61.28 -85.3 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.57 -0.706 . . . . 0.0 110.515 179.328 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.716 HD13 ' CZ2' ' A' ' 41' ' ' TRP . 0.9 OUTLIER . . . . . 0 N--CA 1.493 1.711 0 O-C-N 120.964 -1.085 . . . . 0.0 110.139 -179.059 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.694 0 CA-C-O 121.061 0.458 . . . . 0.0 110.175 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 28.7 mtt180 . . . . . 0 N--CA 1.489 1.496 0 O-C-N 121.114 -0.992 . . . . 0.0 110.523 -179.766 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.524 HG12 ' CD1' ' A' ' 31' ' ' PHE . 1.0 OUTLIER . . . . . 0 N--CA 1.492 1.645 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.57 ' CD2' ' NE2' ' A' ' 36' ' ' GLN . 69.1 m-85 . . . . . 0 N--CA 1.489 1.495 0 O-C-N 121.131 -0.981 . . . . 0.0 111.413 -179.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.559 ' CB ' ' HG2' ' A' ' 36' ' ' GLN . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 121.085 0.469 . . . . 0.0 110.974 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.469 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 C--N 1.303 -1.424 0 N-CA-C 106.368 -1.716 . . . . 0.0 106.368 177.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.628 ' O ' ' HB2' ' A' ' 40' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.483 1.178 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.693 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -42.22 -59.6 1.74 Allowed 'General case' 0 N--CA 1.496 1.839 0 C-N-CA 117.63 -1.628 . . . . 0.0 106.694 178.46 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.575 ' O ' ' O ' ' A' ' 41' ' ' TRP . 0.7 OUTLIER . . . . . 0 C--N 1.297 -1.689 0 O-C-N 121.131 -0.981 . . . . 0.0 109.023 176.305 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.628 ' HB2' ' O ' ' A' ' 36' ' ' GLN . 9.2 t80 . . . . . 0 N--CA 1.484 1.248 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.716 ' CZ2' HD13 ' A' ' 24' ' ' LEU . 8.7 m95 -81.34 -177.56 6.54 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 176.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.475 ' OG ' ' N ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER 73.05 -71.62 0.13 Allowed 'General case' 0 N--CA 1.496 1.848 0 CA-C-O 121.934 0.873 . . . . 0.0 111.646 177.168 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.475 ' N ' ' OG ' ' A' ' 42' ' ' SER . 0.1 OUTLIER -87.48 18.75 3.67 Favored 'General case' 0 C--N 1.278 -2.543 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 -179.903 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.519 ' OH ' ' HB3' ' A' ' 48' ' ' ASP . 0.3 OUTLIER -81.03 31.78 0.32 Allowed 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 119.764 -0.775 . . . . 0.0 110.6 -179.977 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 8.0 pttm -91.0 19.57 5.56 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 120.993 -1.067 . . . . 0.0 108.474 179.113 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -103.7 3.82 34.67 Favored 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.51 ' O ' ' CB ' ' A' ' 48' ' ' ASP . . . 91.72 -71.98 1.72 Allowed Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.252 -1.539 . . . . 0.0 109.252 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.548 ' O ' ' N ' ' A' ' 50' ' ' CYS . 1.5 p-10 159.59 37.24 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.554 -0.968 . . . . 0.0 109.136 179.66 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.618 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 21.9 mp0 51.96 -86.87 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.449 -0.782 . . . . 0.0 110.043 178.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . 0.548 ' N ' ' O ' ' A' ' 48' ' ' ASP . 2.7 t -39.6 -26.24 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.342 -0.849 . . . . 0.0 109.867 179.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.507 ' N ' ' O ' ' A' ' 49' ' ' GLN . 1.1 tt0 -53.64 134.77 41.45 Favored 'General case' 0 N--CA 1.484 1.254 0 O-C-N 120.562 -1.336 . . . . 0.0 108.466 179.522 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.471 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . 103.28 -14.07 54.94 Favored Glycine 0 N--CA 1.495 2.614 0 O-C-N 120.732 -1.23 . . . . 0.0 110.12 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.564 ' CE1' ' O ' ' A' ' 55' ' ' CYS . 0.9 OUTLIER 70.55 61.58 0.48 Allowed Pre-proline 0 N--CA 1.493 1.717 0 O-C-N 121.123 -1.222 . . . . 0.0 109.825 179.912 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.545 ' CB ' ' CE2' ' A' ' 68' ' ' TYR . 3.4 Cg_exo -58.83 -44.9 32.27 Favored 'Trans proline' 0 C--N 1.309 -1.502 0 C-N-CA 122.544 2.162 . . . . 0.0 111.205 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.564 ' O ' ' CE1' ' A' ' 53' ' ' HIS . 0.8 OUTLIER -85.52 165.12 17.37 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.235 -0.916 . . . . 0.0 109.447 -179.114 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.508 ' O ' ' HB2' ' A' ' 81' ' ' CYS . 5.9 mt -149.66 -173.93 4.55 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 120.99 -1.069 . . . . 0.0 110.739 -179.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.61 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 1.1 m120 43.77 63.46 1.58 Allowed 'General case' 0 C--N 1.3 -1.561 0 CA-C-O 121.812 0.815 . . . . 0.0 109.414 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.45 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 0.2 OUTLIER 53.93 29.19 9.56 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.641 -0.662 . . . . 0.0 110.19 177.618 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -84.32 145.65 22.28 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.38 -1.488 . . . . 0.0 109.38 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.467 ' O ' ' SG ' ' A' ' 55' ' ' CYS . 1.7 t-160 -79.05 173.23 12.78 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.047 -1.266 . . . . 0.0 108.094 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.449 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 13.5 t -140.65 105.74 5.0 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.83 -1.169 . . . . 0.0 110.922 -179.137 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.526 ' O ' ' HB2' ' A' ' 68' ' ' TYR . 3.2 mtmm . . . . . 0 C--N 1.296 -1.73 0 N-CA-C 106.072 -1.825 . . . . 0.0 106.072 177.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.559 ' O ' ' O ' ' A' ' 65' ' ' ILE . . . . . . . . 0 N--CA 1.492 2.418 0 N-CA-C 110.444 -1.062 . . . . 0.0 110.444 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.574 HG23 ' N ' ' A' ' 66' ' ' GLY . 0.0 OUTLIER 45.36 173.9 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.128 0 O-C-N 121.532 -0.981 . . . . 0.0 110.673 179.742 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.574 ' N ' HG23 ' A' ' 65' ' ' ILE . . . 58.96 -80.99 0.01 OUTLIER Glycine 0 N--CA 1.496 2.671 0 N-CA-C 108.98 -1.648 . . . . 0.0 108.98 -179.135 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.586 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 5.5 p-10 -135.29 -162.57 1.28 Allowed 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 178.378 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.688 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 4.5 p90 -150.76 -159.15 0.99 Allowed 'General case' 0 C--N 1.292 -1.915 0 O-C-N 120.904 -1.122 . . . . 0.0 109.709 -177.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -149.7 171.04 17.34 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 178.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 52.8 m -140.48 -169.1 2.7 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 120.847 -1.158 . . . . 0.0 108.726 179.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -160.46 124.68 3.64 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.538 -0.726 . . . . 0.0 109.318 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.52 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 66.9 m -100.93 142.05 32.95 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.038 -1.038 . . . . 0.0 109.518 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.935 ' HB3' ' CE1' ' A' ' 76' ' ' PHE . . . -73.49 -176.35 2.26 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.189 -0.945 . . . . 0.0 110.678 -179.639 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -81.23 102.44 10.35 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 123.139 1.447 . . . . 0.0 107.983 178.202 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . 0.466 ' HA2' ' OG1' ' A' ' 85' ' ' THR . . . 121.28 21.43 3.08 Favored Glycine 0 C--N 1.267 -3.293 0 N-CA-C 109.09 -1.604 . . . . 0.0 109.09 -179.048 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.935 ' CE1' ' HB3' ' A' ' 73' ' ' ALA . 6.0 m-85 -119.58 163.77 16.84 Favored 'General case' 0 C--N 1.294 -1.806 0 O-C-N 121.447 -1.031 . . . . 0.0 109.586 -178.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.493 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 1.8 mm-40 -157.21 174.41 15.51 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.956 -1.09 . . . . 0.0 110.317 -179.599 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.39 163.6 38.66 Favored Glycine 0 N--CA 1.489 2.198 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.44 -34.04 73.4 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.299 -1.118 . . . . 0.0 109.532 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.507 ' HB3' ' O ' ' A' ' 54' ' ' PRO . 0.1 OUTLIER -112.34 26.92 10.1 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 179.929 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . 0.508 ' HB2' ' O ' ' A' ' 56' ' ' LEU . 3.0 m 63.22 12.06 5.82 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 120.804 -1.185 . . . . 0.0 108.516 -179.03 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -47.88 -43.57 28.69 Favored 'General case' 0 C--N 1.308 -1.198 0 O-C-N 121.585 -0.697 . . . . 0.0 111.462 -179.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.565 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.8 OUTLIER -81.8 83.49 7.14 Favored 'General case' 0 C--N 1.297 -1.702 0 O-C-N 121.294 -0.879 . . . . 0.0 110.585 -178.838 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.467 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 89.7 p -65.0 94.62 0.14 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.152 -0.967 . . . . 0.0 108.586 178.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.466 ' H ' HG23 ' A' ' 85' ' ' THR . 12.0 p -58.84 -17.01 20.02 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.337 -0.852 . . . . 0.0 110.099 -179.163 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.48 ' HG2' ' NH1' ' A' ' 86' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.291 -1.969 0 CA-C-O 117.964 -1.017 . . . . 0.0 109.525 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.534 ' SG ' ' O ' ' A' ' 17' ' ' CYS . 28.7 t . . . . . 0 N--CA 1.494 1.773 0 CA-C-O 121.573 0.701 . . . . 0.0 109.51 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.824 HD11 ' OE1' ' A' ' 51' ' ' GLU . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.663 0 O-C-N 120.76 -1.212 . . . . 0.0 110.426 -179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 121.249 0.547 . . . . 0.0 109.606 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.563 ' O ' ' CB ' ' A' ' 23' ' ' SER . 12.8 t -111.4 -126.46 0.28 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.207 -0.933 . . . . 0.0 109.83 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.563 ' CB ' ' O ' ' A' ' 22' ' ' CYS . 1.9 t 153.86 -23.23 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.007 -1.058 . . . . 0.0 108.164 -179.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.519 ' CB ' ' O ' ' A' ' 23' ' ' SER . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.688 0 O-C-N 121.834 -0.541 . . . . 0.0 109.837 -179.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.702 ' HB1' ' CZ ' ' A' ' 31' ' ' PHE . . . . . . . . 0 N--CA 1.493 1.724 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.856 ' NH1' HG22 ' A' ' 37' ' ' THR . 0.8 OUTLIER . . . . . 0 C--N 1.297 -1.681 0 O-C-N 120.575 -1.328 . . . . 0.0 110.85 -179.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.432 ' HB ' ' CD1' ' A' ' 31' ' ' PHE . 79.7 t . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 120.877 0.37 . . . . 0.0 110.072 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.702 ' CZ ' ' HB1' ' A' ' 27' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.494 1.773 0 O-C-N 120.792 -1.192 . . . . 0.0 111.516 -179.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.526 ' HB3' ' HG2' ' A' ' 36' ' ' GLN . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.488 0 CA-C-O 121.578 0.704 . . . . 0.0 111.234 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.502 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 N--CA 1.489 1.522 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 179.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.729 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.198 -1.634 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.856 HG22 ' NH1' ' A' ' 28' ' ' ARG . 0.0 OUTLIER -38.91 -57.71 1.2 Allowed 'General case' 0 N--CA 1.502 2.129 0 O-C-N 119.656 -1.903 . . . . 0.0 107.79 178.414 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.489 ' O ' ' N ' ' A' ' 41' ' ' TRP . 1.8 t70 . . . . . 0 C--N 1.295 -1.784 0 O-C-N 121.154 -0.966 . . . . 0.0 109.898 176.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.729 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 21.5 t80 . . . . . 0 N--CA 1.491 1.587 0 N-CA-C 107.294 -1.372 . . . . 0.0 107.294 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.684 ' CD1' ' O ' ' A' ' 37' ' ' THR . 11.3 m95 -80.65 -177.03 6.09 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 177.36 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.631 ' O ' ' CB ' ' A' ' 43' ' ' LYS . 0.4 OUTLIER 35.22 81.83 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.125 0 O-C-N 121.46 -0.775 . . . . 0.0 110.055 179.213 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.631 ' CB ' ' O ' ' A' ' 42' ' ' SER . 18.2 tptt 133.86 -26.0 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 105.708 -1.96 . . . . 0.0 105.708 -178.365 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.635 ' O ' ' N ' ' A' ' 46' ' ' ASP . 0.9 OUTLIER -46.55 -71.01 0.08 Allowed 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 115.263 -0.881 . . . . 0.0 108.66 179.035 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.544 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.1 OUTLIER -1.11 64.73 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.68 0 CA-C-O 121.459 0.647 . . . . 0.0 112.054 179.663 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.635 ' N ' ' O ' ' A' ' 44' ' ' TYR . 5.3 t0 -161.38 23.48 0.13 Allowed 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 -179.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.602 ' O ' ' HB3' ' A' ' 48' ' ' ASP . . . 82.78 -74.56 2.5 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 107.714 -2.154 . . . . 0.0 107.714 -178.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.602 ' HB3' ' O ' ' A' ' 47' ' ' GLY . 0.0 OUTLIER 168.25 13.58 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.02 0 O-C-N 122.239 -0.565 . . . . 0.0 109.75 178.129 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.587 ' HB2' ' O ' ' A' ' 48' ' ' ASP . 22.8 mp0 73.31 -27.27 0.19 Allowed 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.558 -0.714 . . . . 0.0 111.845 178.723 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 10.8 t -124.35 2.97 8.46 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 120.522 -1.361 . . . . 0.0 109.691 179.102 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.824 ' OE1' HD11 ' A' ' 18' ' ' LEU . 10.7 tt0 -57.62 -47.63 81.66 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.824 -1.172 . . . . 0.0 110.878 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -67.38 -0.34 10.94 Favored Glycine 0 N--CA 1.496 2.677 0 O-C-N 120.987 -1.07 . . . . 0.0 111.658 -178.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.532 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 2.2 t60 57.44 61.67 6.03 Favored Pre-proline 0 N--CA 1.492 1.657 0 O-C-N 120.656 -1.496 . . . . 0.0 109.105 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.532 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 1.3 Cg_endo -64.6 -45.77 8.3 Favored 'Trans proline' 0 C--N 1.31 -1.487 0 C-N-CA 122.561 2.174 . . . . 0.0 111.911 -178.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.464 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 2.1 m -63.73 161.12 15.7 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 120.901 -1.124 . . . . 0.0 109.378 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.495 ' HA ' HD23 ' A' ' 56' ' ' LEU . 4.9 mt -144.0 -174.94 4.41 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.141 -0.975 . . . . 0.0 109.927 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.61 ' O ' ' CD2' ' A' ' 76' ' ' PHE . 5.4 m-80 41.52 63.98 1.15 Allowed 'General case' 0 C--N 1.3 -1.551 0 CA-C-O 121.886 0.85 . . . . 0.0 109.56 -179.263 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.456 ' HG3' ' C ' ' A' ' 57' ' ' ASN . 4.3 mt-30 47.44 35.98 4.62 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.333 -0.854 . . . . 0.0 109.075 178.13 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -79.57 142.44 24.75 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.636 -1.386 . . . . 0.0 109.636 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.494 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 10.9 m170 -79.57 137.93 37.3 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.32 -1.106 . . . . 0.0 108.562 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.464 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 27.6 t -107.96 122.11 46.15 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.152 -0.967 . . . . 0.0 110.302 -179.026 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.489 ' HB2' ' OG1' ' A' ' 69' ' ' THR . 32.2 mmtt . . . . . 0 C--N 1.304 -1.382 0 N-CA-C 105.617 -1.994 . . . . 0.0 105.617 177.237 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.519 ' O ' ' OE1' ' A' ' 49' ' ' GLN . . . . . . . . 0 N--CA 1.488 2.134 0 N-CA-C 106.457 -2.657 . . . . 0.0 106.457 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.569 ' CG2' ' HG3' ' A' ' 43' ' ' LYS . 6.2 mm -98.6 -72.77 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 120.273 -1.722 . . . . 0.0 110.222 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.462 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . -42.54 -26.56 0.41 Allowed Glycine 0 N--CA 1.491 2.339 0 C-N-CA 119.553 -1.308 . . . . 0.0 110.263 -178.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.462 ' HB3' ' O ' ' A' ' 66' ' ' GLY . 2.3 p-10 179.93 -154.11 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.021 -1.282 . . . . 0.0 110.44 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.664 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 4.2 p90 -160.46 130.22 5.14 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 -178.328 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.489 ' OG1' ' HB2' ' A' ' 62' ' ' LYS . 43.5 p -98.79 117.15 32.61 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 120.71 -1.244 . . . . 0.0 109.333 -179.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 33.5 m -79.27 -169.24 1.79 Allowed 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.01 -1.056 . . . . 0.0 108.659 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.494 ' HB ' ' HB2' ' A' ' 60' ' ' HIS . 0.2 OUTLIER -160.48 149.82 17.34 Favored 'General case' 0 C--N 1.286 -2.159 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 179.94 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.547 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 92.8 m -114.06 118.39 33.94 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.146 -0.971 . . . . 0.0 108.945 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.864 ' HB3' ' CD1' ' A' ' 76' ' ' PHE . . . -48.26 -176.57 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.023 -1.048 . . . . 0.0 110.812 -179.223 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -80.29 101.85 9.17 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 123.278 1.513 . . . . 0.0 107.555 178.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . 0.531 ' HA2' ' HG3' ' A' ' 86' ' ' ARG . . . 118.3 20.44 4.36 Favored Glycine 0 C--N 1.268 -3.232 0 N-CA-C 108.91 -1.676 . . . . 0.0 108.91 -178.533 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.864 ' CD1' ' HB3' ' A' ' 73' ' ' ALA . 9.2 m-85 -119.55 156.04 31.06 Favored 'General case' 0 C--N 1.294 -1.827 0 O-C-N 121.621 -0.929 . . . . 0.0 109.462 -178.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.511 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 5.5 mm-40 -160.69 161.18 32.23 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.058 -1.026 . . . . 0.0 110.84 -179.33 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 109.97 169.7 19.96 Favored Glycine 0 N--CA 1.493 2.443 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.87 -58.87 5.2 Favored 'General case' 0 C--N 1.306 -1.324 0 O-C-N 121.094 -1.239 . . . . 0.0 109.033 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.485 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 19.2 m-20 -104.98 29.44 6.32 Favored 'General case' 0 C--N 1.289 -2.043 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 178.582 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . 0.511 ' HA ' ' O ' ' A' ' 77' ' ' GLU . 6.4 m 68.51 16.6 9.13 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.141 -0.975 . . . . 0.0 108.716 -179.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.443 ' C ' ' O ' ' A' ' 81' ' ' CYS . 83.2 tt0 -34.9 -32.92 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.328 0 O-C-N 121.739 -0.601 . . . . 0.0 111.763 -179.393 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.52 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.3 OUTLIER -104.35 -161.72 0.84 Allowed 'General case' 0 C--N 1.295 -1.786 0 CA-C-O 122.719 1.247 . . . . 0.0 109.379 -179.778 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.434 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 33.1 m -157.31 95.19 1.45 Allowed 'General case' 0 C--N 1.277 -2.583 0 CA-C-N 114.471 -1.241 . . . . 0.0 108.903 179.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.463 ' OG1' ' HA2' ' A' ' 75' ' ' GLY . 31.1 p -50.62 -35.7 31.67 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.321 -0.862 . . . . 0.0 110.234 -179.18 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.531 ' HG3' ' HA2' ' A' ' 75' ' ' GLY . 0.0 OUTLIER . . . . . 0 C--N 1.287 -2.144 0 CA-C-O 118.007 -0.996 . . . . 0.0 109.16 179.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.402 ' HB3' ' H ' ' A' ' 22' ' ' CYS . 84.7 m . . . . . 0 N--CA 1.5 2.059 0 CA-C-O 121.718 0.77 . . . . 0.0 109.546 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.422 HD12 ' OH ' ' A' ' 44' ' ' TYR . 0.2 OUTLIER . . . . . 0 N--CA 1.495 1.796 0 CA-C-O 121.491 0.662 . . . . 0.0 111.154 -178.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.419 ' C ' ' SG ' ' A' ' 22' ' ' CYS . . . . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 121.799 0.809 . . . . 0.0 109.544 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.419 ' SG ' ' C ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -152.22 -170.7 3.72 Favored 'General case' 0 C--N 1.29 -2.011 0 CA-C-O 121.52 0.676 . . . . 0.0 109.683 -179.816 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.667 ' C ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -102.34 24.55 10.12 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.913 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.672 HD22 ' N ' ' A' ' 24' ' ' LEU . 2.6 mm? . . . . . 0 N--CA 1.498 1.932 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.657 -179.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.403 ' HB1' ' HE1' ' A' ' 31' ' ' PHE . . . . . . . . 0 N--CA 1.494 1.758 0 CA-C-O 120.973 0.416 . . . . 0.0 110.605 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 8.5 mtt180 . . . . . 0 N--CA 1.489 1.497 0 O-C-N 120.735 -1.228 . . . . 0.0 109.589 179.592 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.522 HG12 ' CD1' ' A' ' 31' ' ' PHE . 2.8 p . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 121.404 0.621 . . . . 0.0 109.583 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.522 ' CD1' HG12 ' A' ' 30' ' ' VAL . 42.9 m-85 . . . . . 0 N--CA 1.493 1.684 0 O-C-N 121.38 -0.825 . . . . 0.0 109.491 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.56 ' HB2' ' HB2' ' A' ' 36' ' ' GLN . 23.0 m-20 . . . . . 0 C--O 1.191 -1.974 0 CA-C-O 120.422 0.154 . . . . 0.0 110.748 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.495 ' HA ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 N--CA 1.498 1.95 0 O-C-N 120.886 -1.134 . . . . 0.0 110.185 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.744 ' O ' ' HB3' ' A' ' 40' ' ' PHE . 42.6 mt-30 . . . . . 0 C--O 1.203 -1.359 0 N-CA-C 106.313 -1.736 . . . . 0.0 106.313 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.54 ' O ' ' HB3' ' A' ' 41' ' ' TRP . 1.4 m -35.94 -59.9 0.57 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.309 -0.869 . . . . 0.0 108.814 178.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.423 ' O ' ' N ' ' A' ' 42' ' ' SER . 5.7 m-20 . . . . . 0 C--N 1.298 -1.664 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 177.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.744 ' HB3' ' O ' ' A' ' 36' ' ' GLN . 7.7 t80 . . . . . 0 C--O 1.202 -1.411 0 CA-C-O 121.412 0.625 . . . . 0.0 110.259 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.556 ' CZ2' ' HD3' ' A' ' 45' ' ' LYS . 26.4 t-105 -82.32 -72.59 0.43 Allowed 'General case' 0 C--N 1.294 -1.844 0 O-C-N 121.353 -0.842 . . . . 0.0 112.499 -176.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.497 ' O ' ' HG3' ' A' ' 45' ' ' LYS . 35.4 p -47.96 -63.53 1.04 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.64 -1.288 . . . . 0.0 110.632 -178.313 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.7 tttm -52.32 -21.71 3.81 Favored 'General case' 0 C--N 1.291 -1.973 0 O-C-N 121.384 -0.822 . . . . 0.0 108.925 -179.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.717 ' HB2' ' O ' ' A' ' 40' ' ' PHE . 25.2 t80 -80.19 -96.16 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 178.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.556 ' HD3' ' CZ2' ' A' ' 41' ' ' TRP . 4.4 mtmt 33.37 34.56 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.13 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -179.433 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.57 ' N ' ' O ' ' A' ' 44' ' ' TYR . 1.4 t70 -131.39 -21.71 2.54 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.804 -176.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.523 ' HA2' ' OH ' ' A' ' 44' ' ' TYR . . . 49.06 60.12 6.36 Favored Glycine 0 N--CA 1.492 2.418 0 N-CA-C 105.845 -2.902 . . . . 0.0 105.845 -177.03 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.429 ' C ' ' OE1' ' A' ' 49' ' ' GLN . 27.1 t0 -126.41 -129.87 0.24 Allowed 'General case' 0 C--N 1.307 -1.268 0 O-C-N 121.546 -0.973 . . . . 0.0 110.658 -176.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.599 ' CD ' ' N ' ' A' ' 49' ' ' GLN . 8.4 mp0 57.3 -86.12 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.333 -0.854 . . . . 0.0 110.445 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . 0.559 ' HA ' ' CG ' ' A' ' 54' ' ' PRO . 4.6 t -98.2 -1.58 41.75 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.03 -1.044 . . . . 0.0 111.188 -178.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.469 ' HG3' ' O ' ' A' ' 51' ' ' GLU . 0.6 OUTLIER -55.47 -26.01 39.95 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 120.961 -1.087 . . . . 0.0 111.527 -179.078 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.434 ' O ' ' C ' ' A' ' 53' ' ' HIS . . . -86.13 28.22 5.22 Favored Glycine 0 N--CA 1.494 2.506 0 O-C-N 120.545 -1.347 . . . . 0.0 110.921 -178.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.6 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 3.4 t-160 41.68 53.2 7.24 Favored Pre-proline 0 N--CA 1.493 1.715 0 O-C-N 121.108 -1.231 . . . . 0.0 109.775 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.6 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 4.0 Cg_exo -56.77 -37.17 98.54 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 C-N-CA 122.562 2.175 . . . . 0.0 111.299 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.535 ' SG ' ' CB ' ' A' ' 61' ' ' CYS . 0.6 OUTLIER -89.43 168.29 12.32 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.371 -0.831 . . . . 0.0 110.19 -178.218 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.521 ' HA ' HD23 ' A' ' 56' ' ' LEU . 5.8 mt -146.13 -173.66 4.23 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 122.08 0.943 . . . . 0.0 110.562 -179.397 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.615 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 51.0 m-80 40.29 64.56 0.9 Allowed 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 122.038 0.923 . . . . 0.0 110.124 -179.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.437 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 2.2 mm-40 51.35 33.4 9.89 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-O 121.561 0.696 . . . . 0.0 109.835 177.393 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -81.41 127.3 7.84 Favored Glycine 0 N--CA 1.487 2.057 0 N-CA-C 109.174 -1.57 . . . . 0.0 109.174 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -78.97 168.01 20.3 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.115 -1.227 . . . . 0.0 107.951 179.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.535 ' CB ' ' SG ' ' A' ' 55' ' ' CYS . 0.5 OUTLIER -156.53 126.99 6.62 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 118.323 -1.351 . . . . 0.0 111.175 -178.878 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.8 mmtm . . . . . 0 N--CA 1.487 1.422 0 N-CA-C 106.944 -1.502 . . . . 0.0 106.944 177.638 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.538 ' O ' ' O ' ' A' ' 67' ' ' ASP . . . . . . . . 0 N--CA 1.489 2.232 0 N-CA-C 108.221 -1.952 . . . . 0.0 108.221 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.834 ' O ' HD12 ' A' ' 65' ' ' ILE . 2.2 pp -38.0 160.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.504 2.253 0 CA-C-N 118.935 1.367 . . . . 0.0 110.13 -178.209 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.537 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . 95.46 -47.55 1.92 Allowed Glycine 0 C--N 1.294 -1.759 0 N-CA-C 106.07 -2.812 . . . . 0.0 106.07 -177.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.538 ' O ' ' O ' ' A' ' 64' ' ' GLY . 14.7 p-10 169.69 -145.61 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 178.267 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.619 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 4.1 p90 -160.53 -167.16 1.81 Allowed 'General case' 0 C--N 1.298 -1.646 0 O-C-N 120.691 -1.256 . . . . 0.0 108.926 -179.427 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.476 ' O ' ' HA ' ' A' ' 61' ' ' CYS . 0.1 OUTLIER -147.99 152.08 36.86 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 178.675 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 61' ' ' CYS . 85.0 m -116.98 -170.16 1.78 Allowed 'General case' 0 C--N 1.302 -1.481 0 O-C-N 120.496 -1.378 . . . . 0.0 109.197 179.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 1.8 m -161.27 108.21 1.44 Allowed 'General case' 0 C--N 1.294 -1.829 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.523 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 89.2 m -80.16 138.29 36.86 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.96 -1.087 . . . . 0.0 109.213 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.931 ' HB3' ' CE1' ' A' ' 76' ' ' PHE . . . -72.43 -174.4 1.34 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.074 -1.016 . . . . 0.0 111.25 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -81.57 102.36 10.57 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-O 123.035 1.398 . . . . 0.0 108.185 178.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 120.37 18.0 4.24 Favored Glycine 0 C--N 1.267 -3.294 0 N-CA-C 109.213 -1.555 . . . . 0.0 109.213 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.931 ' CE1' ' HB3' ' A' ' 73' ' ' ALA . 4.2 m-85 -115.82 163.99 15.05 Favored 'General case' 0 C--N 1.294 -1.838 0 O-C-N 121.476 -1.014 . . . . 0.0 109.622 -178.38 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.485 ' HB3' ' HB2' ' A' ' 83' ' ' PHE . 1.9 tt0 -157.38 167.15 31.11 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.146 -0.971 . . . . 0.0 110.051 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 96.4 162.86 32.95 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.636 -1.386 . . . . 0.0 109.636 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 7.4 tptt -60.19 -33.74 72.64 Favored 'General case' 0 C--N 1.306 -1.306 0 O-C-N 121.249 -1.147 . . . . 0.0 109.727 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.5 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.2 OUTLIER -113.97 22.12 14.21 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.877 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . 0.532 ' O ' ' ND2' ' A' ' 57' ' ' ASN . 5.0 m 70.34 7.02 6.05 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.035 -1.041 . . . . 0.0 108.85 -179.236 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.564 ' HA ' ' ND2' ' A' ' 57' ' ' ASN . 56.3 tt0 -37.6 -47.19 0.92 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.573 -0.704 . . . . 0.0 111.305 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.579 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.6 OUTLIER -82.96 83.63 7.74 Favored 'General case' 0 C--N 1.294 -1.811 0 O-C-N 121.136 -0.977 . . . . 0.0 110.55 -178.625 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.452 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 1.6 p -70.97 91.38 0.86 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.275 -0.891 . . . . 0.0 108.802 178.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 10.2 p -60.76 -14.97 24.72 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.311 -0.868 . . . . 0.0 110.014 -179.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.505 ' CD ' ' O ' ' A' ' 86' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.293 -1.852 0 CA-C-O 118.055 -0.974 . . . . 0.0 109.454 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.444 ' SG ' ' HB2' ' A' ' 27' ' ' ALA . 7.6 p . . . . . 0 N--CA 1.505 2.278 0 CA-C-O 122.106 0.955 . . . . 0.0 111.108 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.61 HD21 ' OH ' ' A' ' 44' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.289 -2.05 0 CA-C-O 121.346 0.593 . . . . 0.0 109.552 -179.38 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.409 ' O ' ' CB ' ' A' ' 22' ' ' CYS . . . . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 121.375 0.607 . . . . 0.0 110.014 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.505 ' O ' ' CB ' ' A' ' 23' ' ' SER . 0.0 OUTLIER 172.11 -29.4 0.0 OUTLIER 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.402 -0.811 . . . . 0.0 109.442 179.884 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.505 ' CB ' ' O ' ' A' ' 22' ' ' CYS . 1.7 m 77.11 -76.26 0.05 Allowed 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 -178.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.484 ' O ' ' CD1' ' A' ' 24' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.586 0 O-C-N 121.216 -0.927 . . . . 0.0 108.829 179.189 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.444 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . . . . . . . . 0 N--CA 1.5 2.041 0 CA-C-O 121.42 0.628 . . . . 0.0 109.565 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.43 ' CG ' HH11 ' A' ' 28' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.303 -1.442 0 CA-C-O 121.968 0.889 . . . . 0.0 110.831 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.619 HG12 ' CD2' ' A' ' 31' ' ' PHE . 0.4 OUTLIER . . . . . 0 N--CA 1.493 1.687 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.691 ' CZ ' ' CZ ' ' A' ' 40' ' ' PHE . 88.6 m-85 . . . . . 0 N--CA 1.494 1.765 0 O-C-N 121.227 -0.921 . . . . 0.0 110.243 179.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.578 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 121.334 0.588 . . . . 0.0 111.078 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.543 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 N--CA 1.491 1.605 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 179.062 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.63 ' O ' ' HB2' ' A' ' 40' ' ' PHE . 55.2 mt-30 . . . . . 0 C--O 1.204 -1.323 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.704 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -42.19 -60.61 1.4 Allowed 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 117.759 -1.577 . . . . 0.0 107.172 178.499 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.521 ' O ' ' N ' ' A' ' 41' ' ' TRP . 0.3 OUTLIER . . . . . 0 C--N 1.296 -1.753 0 O-C-N 120.844 -1.16 . . . . 0.0 109.693 177.357 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.691 ' CZ ' ' CZ ' ' A' ' 31' ' ' PHE . 7.3 t80 . . . . . 0 N--CA 1.487 1.391 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.704 ' CD1' ' O ' ' A' ' 37' ' ' THR . 9.1 m95 -77.36 -63.73 1.31 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.309 -0.869 . . . . 0.0 112.185 -179.504 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.523 ' OG ' ' N ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -42.43 -70.06 0.12 Allowed 'General case' 0 N--CA 1.499 2.008 0 O-C-N 120.843 -1.161 . . . . 0.0 112.517 -177.556 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.523 ' N ' ' OG ' ' A' ' 42' ' ' SER . 0.1 OUTLIER -79.15 32.36 0.22 Allowed 'General case' 0 C--N 1.288 -2.081 0 O-C-N 121.482 -0.761 . . . . 0.0 110.543 -178.55 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.614 ' CD1' ' O ' ' A' ' 44' ' ' TYR . 1.0 OUTLIER -80.91 33.9 0.34 Allowed 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.126 -0.984 . . . . 0.0 110.414 179.7 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.14 37.99 1.21 Allowed 'General case' 0 C--N 1.302 -1.459 0 O-C-N 120.557 -1.339 . . . . 0.0 107.702 178.569 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -126.58 -1.1 6.81 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.724 -0.61 . . . . 0.0 109.912 -178.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.543 ' O ' ' CB ' ' A' ' 48' ' ' ASP . . . 71.64 6.71 63.36 Favored Glycine 0 N--CA 1.495 2.579 0 N-CA-C 109.179 -1.569 . . . . 0.0 109.179 -179.195 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.642 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER 85.62 5.32 0.48 Allowed 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.743 -0.857 . . . . 0.0 109.907 179.746 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.715 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 36.3 mm-40 82.37 -47.52 0.18 Allowed 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.819 -0.55 . . . . 0.0 111.723 178.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 11.2 t -83.04 -0.44 48.96 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.946 -1.096 . . . . 0.0 109.757 -179.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.493 ' OE1' ' CA ' ' A' ' 47' ' ' GLY . 47.3 tt0 -74.81 148.2 40.53 Favored 'General case' 0 N--CA 1.484 1.257 0 O-C-N 121.09 -1.007 . . . . 0.0 108.425 179.339 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 91.65 0.07 73.07 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.38 -1.488 . . . . 0.0 109.38 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.452 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 0.8 OUTLIER 54.41 63.3 7.5 Favored Pre-proline 0 C--N 1.307 -1.263 0 O-C-N 121.225 -1.162 . . . . 0.0 109.762 179.39 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.452 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 4.6 Cg_exo -56.88 -38.48 95.8 Favored 'Trans proline' 0 C--N 1.309 -1.506 0 C-N-CA 122.448 2.099 . . . . 0.0 110.325 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.474 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 0.3 OUTLIER -86.37 169.59 12.78 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.365 -0.835 . . . . 0.0 109.59 -179.714 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.507 ' O ' ' HB2' ' A' ' 81' ' ' CYS . 4.8 mt -147.13 -174.52 4.53 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.31 -0.869 . . . . 0.0 109.594 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.598 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 1.4 m-80 41.56 63.2 1.33 Allowed 'General case' 0 C--N 1.301 -1.531 0 CA-C-O 121.778 0.799 . . . . 0.0 109.824 -179.633 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.452 ' HG3' ' C ' ' A' ' 57' ' ' ASN . 1.8 mt-30 45.84 35.92 2.56 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.372 -0.83 . . . . 0.0 109.374 177.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -80.38 151.78 33.3 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -79.36 166.03 22.5 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.276 -1.132 . . . . 0.0 108.895 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.474 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 37.7 t -139.36 128.03 23.22 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.06 -1.025 . . . . 0.0 110.212 -179.515 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.512 ' HB2' ' OG1' ' A' ' 69' ' ' THR . 9.1 mmmt . . . . . 0 C--N 1.304 -1.373 0 N-CA-C 106.332 -1.729 . . . . 0.0 106.332 177.693 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.512 ' O ' ' O ' ' A' ' 67' ' ' ASP . . . . . . . . 0 N--CA 1.488 2.119 0 N-CA-C 107.688 -2.165 . . . . 0.0 107.688 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.498 HG22 ' N ' ' A' ' 66' ' ' GLY . 0.5 OUTLIER -46.15 -59.43 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.555 0 O-C-N 120.578 -1.542 . . . . 0.0 109.164 -179.128 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.498 ' N ' HG22 ' A' ' 65' ' ' ILE . . . -44.64 -38.2 5.4 Favored Glycine 0 N--CA 1.493 2.448 0 N-CA-C 110.552 -1.019 . . . . 0.0 110.552 -178.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.512 ' O ' ' O ' ' A' ' 64' ' ' GLY . 9.0 p-10 177.59 -147.7 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.172 -1.193 . . . . 0.0 110.555 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.715 ' CD1' ' HB3' ' A' ' 49' ' ' GLN . 1.7 p90 -156.86 -170.89 3.45 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.924 -1.11 . . . . 0.0 109.741 -179.424 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.512 ' OG1' ' HB2' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -160.62 112.9 1.96 Allowed 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.296 -0.877 . . . . 0.0 109.815 -179.739 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 35.6 m -80.42 -171.09 2.86 Favored 'General case' 0 C--N 1.296 -1.758 0 O-C-N 120.976 -1.077 . . . . 0.0 110.107 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.444 ' O ' ' SG ' ' A' ' 81' ' ' CYS . 0.2 OUTLIER -160.67 166.97 27.91 Favored 'General case' 0 C--N 1.288 -2.086 0 CA-C-N 115.362 -0.836 . . . . 0.0 108.779 179.927 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.534 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 90.4 m -128.96 125.59 37.78 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.025 -1.047 . . . . 0.0 109.269 179.589 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.9 ' HB3' ' CD1' ' A' ' 76' ' ' PHE . . . -51.0 179.95 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.017 -1.052 . . . . 0.0 110.552 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -80.95 102.27 10.02 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 123.119 1.437 . . . . 0.0 107.735 178.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . 0.485 ' CA ' ' OG1' ' A' ' 85' ' ' THR . . . 118.68 23.04 3.49 Favored Glycine 0 C--N 1.268 -3.218 0 N-CA-C 108.756 -1.738 . . . . 0.0 108.756 -178.516 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.9 ' CD1' ' HB3' ' A' ' 73' ' ' ALA . 8.7 m-85 -119.14 159.35 24.14 Favored 'General case' 0 C--N 1.294 -1.817 0 O-C-N 121.67 -0.9 . . . . 0.0 109.451 -178.167 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.477 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 0.2 OUTLIER -156.16 165.7 35.63 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 120.879 -1.138 . . . . 0.0 110.59 -179.06 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 101.77 165.52 27.12 Favored Glycine 0 N--CA 1.493 2.47 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -58.01 -39.51 78.48 Favored 'General case' 0 C--N 1.307 -1.263 0 O-C-N 121.13 -1.218 . . . . 0.0 109.404 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.489 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 3.8 m-20 -113.56 24.42 12.2 Favored 'General case' 0 C--N 1.291 -1.946 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 179.577 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . 0.509 ' HB2' ' HB2' ' A' ' 57' ' ' ASN . 4.6 m 71.14 6.1 5.71 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 120.985 -1.072 . . . . 0.0 109.305 -179.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.462 ' C ' ' O ' ' A' ' 81' ' ' CYS . 15.0 tt0 -33.15 -46.81 0.17 Allowed 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.341 0.591 . . . . 0.0 111.579 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.613 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.2 OUTLIER -88.16 89.63 8.07 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.472 -0.767 . . . . 0.0 110.576 -178.517 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.486 ' N ' ' OD1' ' A' ' 57' ' ' ASN . 3.8 p -70.58 92.64 0.86 Allowed 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 178.588 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.485 ' OG1' ' CA ' ' A' ' 75' ' ' GLY . 16.6 p -42.87 -28.87 0.28 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.246 -0.909 . . . . 0.0 110.242 -178.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.593 ' CZ ' ' CB ' ' A' ' 86' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.289 -2.025 0 CA-C-O 118.029 -0.986 . . . . 0.0 109.526 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.482 ' O ' ' HB2' ' A' ' 18' ' ' LEU . 5.7 m . . . . . 0 N--CA 1.497 1.877 0 CA-C-O 121.155 0.503 . . . . 0.0 109.822 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.645 HD12 ' CB ' ' A' ' 48' ' ' ASP . 2.5 mm? . . . . . 0 N--CA 1.489 1.508 0 CA-C-O 121.873 0.844 . . . . 0.0 110.254 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.434 ' O ' ' CB ' ' A' ' 22' ' ' CYS . . . . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 121.587 0.708 . . . . 0.0 109.351 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.434 ' CB ' ' O ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER 172.63 -22.76 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.705 0 O-C-N 121.612 -0.68 . . . . 0.0 109.465 179.703 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.501 ' O ' ' HB2' ' A' ' 27' ' ' ALA . 5.9 p 53.81 -147.04 0.51 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.004 -1.06 . . . . 0.0 110.23 179.052 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.628 ' HG ' ' CZ2' ' A' ' 41' ' ' TRP . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.546 0 O-C-N 121.389 -0.82 . . . . 0.0 110.063 -179.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.58 ' O ' ' CD1' ' A' ' 31' ' ' PHE . . . . . . . . 0 N--CA 1.493 1.709 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.496 1.862 0 O-C-N 120.672 -1.268 . . . . 0.0 111.008 -179.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.61 HG12 ' CD1' ' A' ' 31' ' ' PHE . 1.2 t . . . . . 0 N--CA 1.494 1.775 0 CA-C-O 121.262 0.554 . . . . 0.0 109.678 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.61 ' CD1' HG12 ' A' ' 30' ' ' VAL . 7.4 m-85 . . . . . 0 C--N 1.295 -1.771 0 O-C-N 121.1 -1.0 . . . . 0.0 113.32 -177.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.495 ' HB3' ' HB2' ' A' ' 36' ' ' GLN . 69.7 m-20 . . . . . 0 N--CA 1.483 1.215 0 CA-C-O 121.093 0.473 . . . . 0.0 111.325 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.513 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 C--N 1.305 -1.357 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 177.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.672 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 22.4 mm-40 . . . . . 0 C--O 1.202 -1.427 0 N-CA-C 108.753 -0.832 . . . . 0.0 108.753 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.66 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -47.14 -60.23 2.61 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 119.506 -1.996 . . . . 0.0 107.082 177.76 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.43 ' O ' ' N ' ' A' ' 41' ' ' TRP . 0.5 OUTLIER . . . . . 0 N--CA 1.493 1.693 0 O-C-N 121.331 -0.856 . . . . 0.0 109.655 177.336 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.672 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 19.8 t80 . . . . . 0 N--CA 1.493 1.714 0 N-CA-C 107.259 -1.386 . . . . 0.0 107.259 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.66 ' CD1' ' O ' ' A' ' 37' ' ' THR . 7.9 m95 -80.73 178.61 8.26 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 177.419 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.523 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 23.2 t 63.63 105.31 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.821 -1.175 . . . . 0.0 110.757 179.092 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.65 ' HD2' HG22 ' A' ' 65' ' ' ILE . 0.0 OUTLIER 79.21 14.17 1.1 Allowed 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.667 0.746 . . . . 0.0 108.988 179.514 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.529 ' CD1' ' O ' ' A' ' 44' ' ' TYR . 1.1 t80 -81.38 34.14 0.37 Allowed 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.417 -0.802 . . . . 0.0 110.208 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 2.1 mmmt -92.72 32.81 1.19 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 120.932 -1.105 . . . . 0.0 109.217 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -116.33 3.39 13.34 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.329 -0.857 . . . . 0.0 109.539 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.575 ' O ' ' CB ' ' A' ' 48' ' ' ASP . . . 88.4 -40.04 3.09 Favored Glycine 0 N--CA 1.494 2.547 0 N-CA-C 108.937 -1.665 . . . . 0.0 108.937 -179.418 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.645 ' CB ' HD12 ' A' ' 18' ' ' LEU . 5.5 p30 152.04 15.83 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.036 0 O-C-N 122.11 -0.641 . . . . 0.0 110.027 179.184 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.571 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 68.2 mm-40 69.72 -11.39 0.53 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.229 -0.919 . . . . 0.0 111.1 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . 0.472 ' SG ' ' HD2' ' A' ' 54' ' ' PRO . 49.3 t -135.26 10.69 3.52 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 120.749 -1.22 . . . . 0.0 109.729 179.123 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.492 ' HB2' ' OD1' ' A' ' 48' ' ' ASP . 3.2 tt0 -58.58 -53.14 61.69 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.834 -1.166 . . . . 0.0 110.199 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.478 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . -68.37 -3.81 34.09 Favored Glycine 0 N--CA 1.492 2.426 0 C-N-CA 120.257 -0.973 . . . . 0.0 110.776 -179.043 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.478 ' HB3' ' O ' ' A' ' 52' ' ' GLY . 5.2 t-160 68.32 70.18 0.43 Allowed Pre-proline 0 N--CA 1.492 1.657 0 O-C-N 120.942 -1.328 . . . . 0.0 109.363 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.495 ' CB ' ' CE2' ' A' ' 68' ' ' TYR . 5.8 Cg_exo -60.29 -38.25 76.74 Favored 'Trans proline' 0 C--N 1.308 -1.568 0 C-N-CA 122.599 2.199 . . . . 0.0 111.35 -179.701 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.482 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 1.8 m -78.07 172.52 13.39 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.217 -0.927 . . . . 0.0 109.891 -178.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.5 mt -149.47 -173.41 4.39 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.061 -1.024 . . . . 0.0 110.373 -179.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.597 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 2.1 m-80 41.79 63.55 1.28 Allowed 'General case' 0 C--N 1.303 -1.452 0 CA-C-O 121.855 0.836 . . . . 0.0 110.132 -179.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 47.98 33.53 3.49 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.376 -0.828 . . . . 0.0 109.856 177.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -78.74 143.67 26.95 Favored Glycine 0 N--CA 1.488 2.105 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.479 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 68.6 m80 -78.84 123.33 27.11 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 179.037 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.482 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 41.2 t -101.12 113.46 26.51 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.187 -0.946 . . . . 0.0 111.507 -177.635 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.507 ' HB3' ' OG1' ' A' ' 69' ' ' THR . 0.1 OUTLIER . . . . . 0 C--N 1.301 -1.534 0 N-CA-C 105.955 -1.869 . . . . 0.0 105.955 176.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.528 ' O ' ' CG ' ' A' ' 49' ' ' GLN . . . . . . . . 0 N--CA 1.488 2.103 0 N-CA-C 107.479 -2.249 . . . . 0.0 107.479 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.65 HG22 ' HD2' ' A' ' 43' ' ' LYS . 19.3 mm -93.63 -61.6 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 120.609 -1.524 . . . . 0.0 109.8 -179.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.492 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . -47.63 -25.0 3.08 Favored Glycine 0 N--CA 1.488 2.111 0 N-CA-C 108.645 -1.782 . . . . 0.0 108.645 179.446 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.492 ' HB3' ' O ' ' A' ' 66' ' ' GLY . 3.3 p-10 176.78 -149.36 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.645 -0.915 . . . . 0.0 109.69 179.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.641 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 4.3 p90 -160.31 -167.09 1.82 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.37 -0.831 . . . . 0.0 109.248 -179.065 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.507 ' OG1' ' HB3' ' A' ' 62' ' ' LYS . 0.1 OUTLIER -144.96 171.63 14.18 Favored 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 178.651 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 20.6 m -136.27 -174.5 3.7 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 120.843 -1.161 . . . . 0.0 108.313 179.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.479 ' HB ' ' HB2' ' A' ' 60' ' ' HIS . 0.2 OUTLIER -160.54 150.85 18.1 Favored 'General case' 0 C--N 1.292 -1.909 0 O-C-N 121.518 -0.739 . . . . 0.0 109.249 179.478 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.53 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 88.3 m -120.95 124.86 45.94 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.114 -0.991 . . . . 0.0 109.133 179.712 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.868 ' HB3' ' CE1' ' A' ' 76' ' ' PHE . . . -57.13 -179.81 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.019 -1.051 . . . . 0.0 111.103 -179.27 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.26 100.97 6.04 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 123.425 1.583 . . . . 0.0 108.702 178.633 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . 0.487 ' HA2' ' OG1' ' A' ' 85' ' ' THR . . . 119.5 20.42 3.91 Favored Glycine 0 C--N 1.266 -3.309 0 CA-C-N 113.21 -1.814 . . . . 0.0 108.834 -178.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.868 ' CE1' ' HB3' ' A' ' 73' ' ' ALA . 6.5 m-85 -117.51 158.03 25.26 Favored 'General case' 0 C--N 1.296 -1.749 0 O-C-N 121.61 -0.935 . . . . 0.0 109.89 -178.036 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.607 ' HG2' HG23 ' A' ' 85' ' ' THR . 0.9 OUTLIER -160.08 163.33 33.97 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.18 -0.95 . . . . 0.0 110.487 -179.505 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 108.23 166.33 21.24 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.14 -39.42 72.24 Favored 'General case' 0 C--N 1.308 -1.216 0 O-C-N 121.167 -1.196 . . . . 0.0 109.17 179.716 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.514 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 70.8 m-20 -119.03 29.5 7.66 Favored 'General case' 0 C--N 1.292 -1.933 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 179.315 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . 0.521 ' HB2' ' HB2' ' A' ' 57' ' ' ASN . 6.8 m 68.41 10.73 8.03 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.035 -1.041 . . . . 0.0 108.575 -179.13 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.461 ' C ' ' O ' ' A' ' 81' ' ' CYS . 22.1 tt0 -29.47 -45.45 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 121.186 0.517 . . . . 0.0 112.232 -179.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.468 ' HB2' ' HG3' ' A' ' 77' ' ' GLU . 0.4 OUTLIER -101.41 -161.06 0.83 Allowed 'General case' 0 C--N 1.294 -1.832 0 CA-C-O 122.84 1.305 . . . . 0.0 109.834 -178.895 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.416 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 1.5 p -147.94 115.04 6.16 Favored 'General case' 0 C--N 1.278 -2.518 0 CA-C-N 114.23 -1.35 . . . . 0.0 108.877 179.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.607 HG23 ' HG2' ' A' ' 77' ' ' GLU . 18.2 p -63.44 -18.24 63.54 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.128 -0.983 . . . . 0.0 109.729 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.1 ptt180 . . . . . 0 C--N 1.293 -1.87 0 CA-C-O 118.01 -0.995 . . . . 0.0 109.504 -179.987 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.561 ' HA ' ' HB3' ' A' ' 22' ' ' CYS . 1.7 m . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 121.375 0.607 . . . . 0.0 110.194 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 1.043 HD13 ' O ' ' A' ' 18' ' ' LEU . 2.8 tm? . . . . . 0 C--N 1.298 -1.667 0 CA-C-O 121.943 0.878 . . . . 0.0 108.709 178.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 121.059 0.457 . . . . 0.0 109.918 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.561 ' HB3' ' HA ' ' A' ' 17' ' ' CYS . 7.0 t 179.33 158.87 0.64 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.116 -0.99 . . . . 0.0 109.259 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.538 ' O ' ' CB ' ' A' ' 17' ' ' CYS . 3.1 m -99.62 -161.5 0.88 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.964 -1.085 . . . . 0.0 110.721 -178.461 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.915 HD12 ' CZ3' ' A' ' 41' ' ' TRP . 3.9 mm? . . . . . 0 N--CA 1.488 1.463 0 O-C-N 121.541 -0.724 . . . . 0.0 109.5 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.652 ' O ' ' CE1' ' A' ' 31' ' ' PHE . . . . . . . . 0 N--CA 1.492 1.657 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.449 ' CG ' HH11 ' A' ' 28' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.691 0 O-C-N 120.658 -1.277 . . . . 0.0 109.752 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 53.3 t . . . . . 0 N--CA 1.488 1.434 0 N-CA-C 109.964 -0.384 . . . . 0.0 109.964 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.652 ' CE1' ' O ' ' A' ' 27' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.57 0 O-C-N 120.848 -1.158 . . . . 0.0 110.38 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.566 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 0.8 OUTLIER . . . . . 0 N--CA 1.482 1.159 0 CA-C-O 121.067 0.46 . . . . 0.0 110.442 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.522 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 N--CA 1.491 1.603 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.683 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 3.4 mm100 . . . . . 0 C--O 1.203 -1.37 0 N-CA-C 107.834 -1.173 . . . . 0.0 107.834 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.688 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -40.28 -59.82 1.21 Allowed 'General case' 0 N--CA 1.502 2.133 0 O-C-N 120.203 -1.561 . . . . 0.0 107.787 178.812 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.453 ' O ' ' N ' ' A' ' 41' ' ' TRP . 0.5 OUTLIER . . . . . 0 C--N 1.297 -1.714 0 O-C-N 120.969 -1.082 . . . . 0.0 109.46 177.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.683 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 14.9 t80 . . . . . 0 C--O 1.203 -1.386 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.915 ' CZ3' HD12 ' A' ' 24' ' ' LEU . 10.2 m95 -81.22 -68.78 0.66 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.933 -1.104 . . . . 0.0 112.427 -179.156 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.527 ' O ' ' CG ' ' A' ' 45' ' ' LYS . 0.3 OUTLIER -49.16 -53.25 21.94 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.65 -1.281 . . . . 0.0 111.476 -177.377 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.545 ' HG2' ' HB ' ' A' ' 65' ' ' ILE . 0.4 OUTLIER -62.74 -27.35 69.21 Favored 'General case' 0 C--N 1.283 -2.3 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 179.793 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.612 ' CA ' HG21 ' A' ' 65' ' ' ILE . 25.4 t80 -81.35 -95.63 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.381 0 O-C-N 121.425 -0.797 . . . . 0.0 108.857 179.368 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.556 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.0 OUTLIER 29.32 38.2 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.365 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 -178.782 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.601 ' N ' ' O ' ' A' ' 44' ' ' TYR . 19.7 t0 -127.91 -18.89 4.13 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.672 -176.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.472 ' HA2' ' OH ' ' A' ' 44' ' ' TYR . . . 49.73 49.36 34.52 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 105.897 -2.881 . . . . 0.0 105.897 -177.338 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.502 ' O ' ' C ' ' A' ' 49' ' ' GLN . 15.1 t0 -117.31 -138.18 0.36 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 122.089 -0.653 . . . . 0.0 110.625 -177.245 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.64 ' O ' ' CB ' ' A' ' 50' ' ' CYS . 7.3 mt-30 24.0 80.15 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.893 0 CA-C-O 121.617 0.722 . . . . 0.0 111.487 -179.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . 0.64 ' CB ' ' O ' ' A' ' 49' ' ' GLN . 50.5 t 112.8 -30.59 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 115.279 -0.873 . . . . 0.0 108.863 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.457 ' CB ' ' O ' ' A' ' 47' ' ' GLY . 1.4 tm-20 -61.47 -53.17 59.95 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.359 -0.838 . . . . 0.0 109.985 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.56 ' O ' ' CB ' ' A' ' 53' ' ' HIS . . . -61.28 -9.61 17.25 Favored Glycine 0 N--CA 1.493 2.474 0 N-CA-C 110.035 -1.226 . . . . 0.0 110.035 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.703 ' CE1' HD23 ' A' ' 56' ' ' LEU . 1.0 OUTLIER 80.74 53.73 0.1 Allowed Pre-proline 0 N--CA 1.486 1.355 0 O-C-N 121.372 -1.076 . . . . 0.0 110.193 179.563 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.548 ' CD ' ' N ' ' A' ' 53' ' ' HIS . 3.4 Cg_exo -57.91 -38.16 93.41 Favored 'Trans proline' 0 C--N 1.312 -1.377 0 C-N-CA 122.457 2.105 . . . . 0.0 109.731 178.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.45 ' O ' ' ND1' ' A' ' 53' ' ' HIS . 1.6 m -96.1 174.29 6.99 Favored 'General case' 0 C--N 1.298 -1.657 0 CA-C-O 121.157 0.503 . . . . 0.0 109.844 -178.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.703 HD23 ' CE1' ' A' ' 53' ' ' HIS . 5.1 mt -149.6 -174.78 4.78 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.114 -0.991 . . . . 0.0 110.309 -179.568 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.624 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 1.0 OUTLIER 45.54 62.18 2.29 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-O 121.769 0.795 . . . . 0.0 109.929 -179.578 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.45 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 1.8 mm100 49.94 28.04 2.68 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.55 -0.719 . . . . 0.0 110.653 177.193 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -65.57 132.77 35.2 Favored Glycine 0 N--CA 1.489 2.201 0 N-CA-C 109.012 -1.635 . . . . 0.0 109.012 179.555 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 57.7 t60 -79.07 136.28 37.12 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.106 -1.232 . . . . 0.0 108.288 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 70' ' ' CYS . 1.1 p -120.52 150.85 40.19 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 120.969 -1.082 . . . . 0.0 111.344 -178.373 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.502 ' HB2' ' OG1' ' A' ' 69' ' ' THR . 8.3 mttp . . . . . 0 C--N 1.299 -1.614 0 N-CA-C 105.364 -2.087 . . . . 0.0 105.364 177.037 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.521 ' O ' ' O ' ' A' ' 65' ' ' ILE . . . . . . . . 0 N--CA 1.483 1.797 0 N-CA-C 107.031 -2.428 . . . . 0.0 107.031 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.824 ' O ' HD12 ' A' ' 65' ' ' ILE . 2.4 pp -35.63 154.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 CA-C-N 118.322 1.061 . . . . 0.0 110.016 -177.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.499 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . 103.47 -44.42 1.49 Allowed Glycine 0 N--CA 1.483 1.812 0 N-CA-C 104.432 -3.467 . . . . 0.0 104.432 -176.104 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.499 ' HB3' ' O ' ' A' ' 66' ' ' GLY . 5.2 p-10 171.81 -152.35 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 176.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.61 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 6.4 p90 -158.43 115.05 2.79 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 -179.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.502 ' OG1' ' HB2' ' A' ' 62' ' ' LYS . 76.8 p -79.67 115.11 19.1 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 120.659 -1.275 . . . . 0.0 109.438 -178.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 61' ' ' CYS . 0.0 OUTLIER -103.12 -172.54 2.13 Favored 'General case' 0 C--N 1.304 -1.384 0 O-C-N 121.195 -0.94 . . . . 0.0 109.303 179.814 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 7.8 m -162.03 131.4 4.49 Favored 'General case' 0 C--N 1.291 -1.976 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 179.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.537 ' HB3' ' CB ' ' A' ' 76' ' ' PHE . 94.1 m -82.05 116.49 21.67 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.832 -1.167 . . . . 0.0 108.569 179.152 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.887 ' HB3' ' CD1' ' A' ' 76' ' ' PHE . . . -43.67 172.56 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.014 -1.054 . . . . 0.0 111.319 -179.075 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.02 100.41 3.57 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-O 123.583 1.659 . . . . 0.0 108.586 178.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . 0.552 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 118.96 28.96 1.92 Allowed Glycine 0 C--N 1.264 -3.47 0 N-CA-C 108.066 -2.013 . . . . 0.0 108.066 -178.284 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.887 ' CD1' ' HB3' ' A' ' 73' ' ' ALA . 17.7 m-85 -128.0 148.78 50.54 Favored 'General case' 0 C--N 1.296 -1.759 0 O-C-N 121.833 -0.804 . . . . 0.0 110.367 -178.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.757 ' HB2' HG23 ' A' ' 85' ' ' THR . 0.7 OUTLIER -152.58 166.55 31.69 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.252 -0.905 . . . . 0.0 110.514 -179.73 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 109.24 163.97 20.15 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.476 -1.45 . . . . 0.0 109.476 179.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.6 tptt -57.84 -33.61 68.83 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.113 -1.228 . . . . 0.0 109.106 179.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.506 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.4 OUTLIER -121.9 27.76 7.93 Favored 'General case' 0 C--N 1.291 -1.963 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 179.644 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . 0.515 ' O ' ' HB2' ' A' ' 57' ' ' ASN . 4.7 m 62.53 14.24 6.87 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 -178.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.448 ' C ' ' O ' ' A' ' 81' ' ' CYS . 45.9 tt0 -33.54 -36.94 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.323 0 O-C-N 121.666 -0.646 . . . . 0.0 111.923 -179.101 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.475 ' O ' ' OD1' ' A' ' 57' ' ' ASN . 1.3 m-85 -106.19 -166.49 1.2 Allowed 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 122.809 1.29 . . . . 0.0 109.492 -179.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.498 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 0.7 OUTLIER -138.82 107.27 5.83 Favored 'General case' 0 C--N 1.275 -2.659 0 CA-C-N 114.415 -1.266 . . . . 0.0 109.113 -179.871 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.757 HG23 ' HB2' ' A' ' 77' ' ' GLU . 2.4 p -62.36 96.49 0.08 Allowed 'General case' 0 C--N 1.302 -1.464 0 O-C-N 120.913 -1.117 . . . . 0.0 110.032 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.527 ' HG2' ' NH1' ' A' ' 86' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.294 -1.829 0 CA-C-O 118.052 -0.975 . . . . 0.0 110.099 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.831 ' O ' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.691 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.619 ' C ' HD12 ' A' ' 18' ' ' LEU . 0.3 OUTLIER . . . . . 0 C--N 1.301 -1.539 0 O-C-N 121.394 -0.816 . . . . 0.0 109.998 179.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.831 ' HB3' ' O ' ' A' ' 17' ' ' CYS . . . . . . . . 0 N--CA 1.487 1.395 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.517 ' HB3' ' HB2' ' A' ' 17' ' ' CYS . 1.0 OUTLIER -113.37 173.98 6.14 Favored 'General case' 0 N--CA 1.496 1.827 0 C-N-CA 119.656 -0.818 . . . . 0.0 109.412 179.281 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.614 ' O ' ' HB2' ' A' ' 24' ' ' LEU . 29.7 t -121.84 14.33 10.8 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.227 -0.92 . . . . 0.0 109.461 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.702 HD22 ' N ' ' A' ' 24' ' ' LEU . 3.5 mm? . . . . . 0 N--CA 1.503 2.195 0 O-C-N 122.162 -0.336 . . . . 0.0 110.61 -179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.664 ' O ' HG12 ' A' ' 30' ' ' VAL . . . . . . . . 0 N--CA 1.49 1.573 0 CA-C-O 121.216 0.531 . . . . 0.0 109.626 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.44 ' CG ' HH11 ' A' ' 28' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 122.309 1.052 . . . . 0.0 110.105 -179.568 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.664 HG12 ' O ' ' A' ' 27' ' ' ALA . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 120.49 0.186 . . . . 0.0 110.763 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.648 ' CE2' ' CE2' ' A' ' 40' ' ' PHE . 0.1 OUTLIER . . . . . 0 N--CA 1.495 1.808 0 O-C-N 120.474 -1.391 . . . . 0.0 111.626 -179.784 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.574 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 6.8 m-20 . . . . . 0 N--CA 1.482 1.134 0 CA-C-O 121.433 0.635 . . . . 0.0 111.417 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.507 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 N--CA 1.487 1.413 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 178.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.662 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 11.1 mm100 . . . . . 0 C--O 1.203 -1.37 0 N-CA-C 108.01 -1.108 . . . . 0.0 108.01 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.64 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.1 OUTLIER -40.88 -59.1 1.51 Allowed 'General case' 0 N--CA 1.498 1.943 0 C-N-CA 118.23 -1.388 . . . . 0.0 108.631 179.31 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.4 ' O ' ' N ' ' A' ' 41' ' ' TRP . 0.8 OUTLIER . . . . . 0 N--CA 1.493 1.718 0 O-C-N 121.043 -1.036 . . . . 0.0 110.196 178.796 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.662 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 10.0 t80 . . . . . 0 N--CA 1.485 1.284 0 N-CA-C 109.928 -0.397 . . . . 0.0 109.928 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.64 ' CD1' ' O ' ' A' ' 37' ' ' THR . 9.4 m95 -81.3 -69.32 0.62 Allowed 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.522 -0.736 . . . . 0.0 112.802 -178.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.489 ' OG ' ' N ' ' A' ' 43' ' ' LYS . 0.1 OUTLIER -42.89 -73.74 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.026 0 O-C-N 120.831 -1.168 . . . . 0.0 112.646 -176.906 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.55 ' HD2' ' CG2' ' A' ' 65' ' ' ILE . 1.4 ptpt -78.2 31.88 0.18 Allowed 'General case' 0 C--N 1.287 -2.113 0 O-C-N 121.649 -0.657 . . . . 0.0 110.57 -178.509 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.59 ' HB2' ' O ' ' A' ' 40' ' ' PHE . 0.8 OUTLIER -80.26 23.37 0.49 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.014 -1.054 . . . . 0.0 110.693 179.747 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -90.21 31.92 0.97 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 120.776 -1.202 . . . . 0.0 108.619 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.52 ' OD2' ' NE2' ' A' ' 49' ' ' GLN . 1.6 t0 -111.12 4.12 19.09 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.464 -0.773 . . . . 0.0 109.827 -179.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.546 ' O ' ' CB ' ' A' ' 48' ' ' ASP . . . 69.42 16.13 71.17 Favored Glycine 0 N--CA 1.492 2.395 0 N-CA-C 108.577 -1.809 . . . . 0.0 108.577 -179.086 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.584 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER 83.58 7.96 0.64 Allowed 'General case' 0 N--CA 1.501 2.106 0 O-C-N 121.779 -0.836 . . . . 0.0 109.527 -179.815 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.631 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 33.7 mm-40 72.33 -21.91 0.22 Allowed 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.462 -0.774 . . . . 0.0 111.838 179.273 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . 0.497 ' O ' ' HD3' ' A' ' 54' ' ' PRO . 25.1 t -105.97 -20.05 13.55 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.426 -1.421 . . . . 0.0 109.436 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.486 ' HB2' ' O ' ' A' ' 47' ' ' GLY . 72.5 tt0 -49.83 136.45 17.97 Favored 'General case' 0 N--CA 1.485 1.281 0 O-C-N 121.088 -1.007 . . . . 0.0 109.073 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 100.0 -11.9 60.59 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 110.094 -1.203 . . . . 0.0 110.094 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.452 ' CD2' ' O ' ' A' ' 55' ' ' CYS . 3.8 t-160 60.82 65.74 1.96 Allowed Pre-proline 0 N--CA 1.491 1.582 0 O-C-N 121.088 -1.242 . . . . 0.0 109.436 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.497 ' HD3' ' O ' ' A' ' 50' ' ' CYS . 5.7 Cg_exo -58.86 -38.57 87.78 Favored 'Trans proline' 0 C--N 1.308 -1.558 0 C-N-CA 122.415 2.077 . . . . 0.0 110.751 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.466 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 1.8 m -72.4 172.45 10.39 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.353 -0.842 . . . . 0.0 109.233 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.487 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 4.7 mt -144.88 -174.99 4.5 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.238 -0.914 . . . . 0.0 109.934 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.614 ' O ' ' CD2' ' A' ' 76' ' ' PHE . 1.0 OUTLIER 44.76 61.9 2.29 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-O 121.666 0.746 . . . . 0.0 109.538 -179.857 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.455 ' HG3' ' C ' ' A' ' 57' ' ' ASN . 1.4 mt-30 45.18 33.84 1.24 Allowed 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.232 -0.917 . . . . 0.0 109.387 177.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -80.27 152.28 34.12 Favored Glycine 0 N--CA 1.489 2.182 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.467 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 0.0 OUTLIER -79.85 169.31 18.1 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.337 -1.096 . . . . 0.0 108.631 179.502 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.466 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 19.2 t -140.72 125.87 18.51 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.024 -1.047 . . . . 0.0 110.125 -179.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.529 ' O ' ' HB2' ' A' ' 68' ' ' TYR . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.375 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 178.148 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.557 ' O ' ' N ' ' A' ' 66' ' ' GLY . . . . . . . . 0 N--CA 1.49 2.262 0 N-CA-C 110.026 -1.23 . . . . 0.0 110.026 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.698 HG22 ' N ' ' A' ' 66' ' ' GLY . 2.2 mm 47.67 -86.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 121.432 -1.04 . . . . 0.0 110.081 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.698 ' N ' HG22 ' A' ' 65' ' ' ILE . . . -31.26 -38.24 0.03 OUTLIER Glycine 0 N--CA 1.5 2.938 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.517 ' N ' ' O ' ' A' ' 65' ' ' ILE . 5.0 p-10 -175.29 -150.42 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.393 -1.063 . . . . 0.0 109.549 178.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.644 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 1.8 p90 -160.38 139.16 10.43 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.198 -0.939 . . . . 0.0 109.606 -178.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.494 ' O ' ' HD3' ' A' ' 62' ' ' LYS . 50.1 p -104.64 120.14 40.63 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.11 -0.994 . . . . 0.0 109.341 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 6.9 m -79.33 -166.64 0.99 Allowed 'General case' 0 C--N 1.303 -1.419 0 O-C-N 120.663 -1.273 . . . . 0.0 108.82 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.467 ' HB ' ' HB2' ' A' ' 60' ' ' HIS . 4.7 m -160.37 159.3 30.97 Favored 'General case' 0 C--N 1.288 -2.084 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.55 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 87.2 m -125.65 123.04 38.1 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.026 -1.046 . . . . 0.0 109.484 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.835 ' HB3' ' CD1' ' A' ' 76' ' ' PHE . . . -50.34 -176.15 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.073 -1.017 . . . . 0.0 110.757 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -81.03 102.11 9.98 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-O 123.067 1.413 . . . . 0.0 107.869 178.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . 0.495 ' HA2' ' OG1' ' A' ' 85' ' ' THR . . . 117.37 21.21 4.47 Favored Glycine 0 C--N 1.267 -3.283 0 N-CA-C 108.583 -1.807 . . . . 0.0 108.583 -178.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.835 ' CD1' ' HB3' ' A' ' 73' ' ' ALA . 8.3 m-85 -119.8 157.32 28.88 Favored 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.632 -0.922 . . . . 0.0 110.156 -177.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.553 ' HG2' ' N ' ' A' ' 85' ' ' THR . 0.6 OUTLIER -160.17 163.03 33.98 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.048 -1.032 . . . . 0.0 110.955 -179.25 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 109.84 166.03 19.83 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.352 -1.499 . . . . 0.0 109.352 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.64 -34.82 69.74 Favored 'General case' 0 C--N 1.306 -1.313 0 O-C-N 121.155 -1.203 . . . . 0.0 109.12 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.487 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.7 OUTLIER -121.84 27.07 8.32 Favored 'General case' 0 C--N 1.291 -1.962 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 179.363 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . 0.513 ' HA ' ' O ' ' A' ' 77' ' ' GLU . 7.1 m 65.99 10.63 7.13 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.23 -0.919 . . . . 0.0 109.198 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.542 ' HB3' ' CE1' ' A' ' 83' ' ' PHE . 28.5 tt0 -32.78 -43.03 0.09 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.868 -0.52 . . . . 0.0 111.821 -179.499 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.562 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -99.6 -160.3 0.79 Allowed 'General case' 0 C--N 1.296 -1.742 0 CA-C-O 122.864 1.316 . . . . 0.0 109.738 -179.043 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.522 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 1.0 OUTLIER -148.43 123.02 9.8 Favored 'General case' 0 C--N 1.278 -2.53 0 CA-C-N 114.314 -1.312 . . . . 0.0 109.051 179.603 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.553 ' N ' ' HG2' ' A' ' 77' ' ' GLU . 14.2 p -69.38 -16.23 63.47 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.205 -0.934 . . . . 0.0 109.656 -179.56 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.406 ' OXT' ' O ' ' A' ' 85' ' ' THR . 1.5 mtt180 . . . . . 0 C--N 1.295 -1.798 0 CA-C-O 118.03 -0.986 . . . . 0.0 109.588 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.548 ' HA ' ' HB3' ' A' ' 22' ' ' CYS . 1.6 t . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 121.717 0.77 . . . . 0.0 109.52 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.74 HD21 ' HB2' ' A' ' 48' ' ' ASP . 0.4 OUTLIER . . . . . 0 N--CA 1.491 1.599 0 O-C-N 120.526 -1.359 . . . . 0.0 110.197 179.56 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.475 0 CA-C-O 120.71 0.29 . . . . 0.0 110.804 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.548 ' HB3' ' HA ' ' A' ' 17' ' ' CYS . 11.9 p -139.68 -150.62 0.33 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.704 -1.247 . . . . 0.0 110.803 -179.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.913 ' O ' HD22 ' A' ' 24' ' ' LEU . 47.1 t -166.52 -70.5 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.913 HD22 ' O ' ' A' ' 23' ' ' SER . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.544 0 O-C-N 121.276 -0.89 . . . . 0.0 109.726 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.595 ' O ' ' CE1' ' A' ' 31' ' ' PHE . . . . . . . . 0 N--CA 1.492 1.668 0 N-CA-C 110.242 -0.281 . . . . 0.0 110.242 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.683 HH22 HD12 ' A' ' 24' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.907 0 O-C-N 120.59 -1.318 . . . . 0.0 110.396 179.569 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 58.8 t . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 120.703 0.287 . . . . 0.0 110.833 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.595 ' CE1' ' O ' ' A' ' 27' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.874 0 O-C-N 120.713 -1.242 . . . . 0.0 112.233 -178.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.828 ' O ' HG23 ' A' ' 37' ' ' THR . 51.3 p-10 . . . . . 0 N--CA 1.476 0.829 0 CA-C-O 121.759 0.79 . . . . 0.0 111.795 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.563 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 N--CA 1.489 1.479 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 178.143 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.647 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 81.1 mt-30 . . . . . 0 C--O 1.203 -1.393 0 N-CA-C 108.299 -1.001 . . . . 0.0 108.299 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.828 HG23 ' O ' ' A' ' 33' ' ' ASP . 1.0 OUTLIER -42.26 -57.46 2.54 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.292 -1.505 . . . . 0.0 107.774 179.061 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.441 ' O ' ' N ' ' A' ' 41' ' ' TRP . 1.9 t70 . . . . . 0 N--CA 1.494 1.743 0 O-C-N 120.875 -1.141 . . . . 0.0 108.666 176.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.647 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 14.2 t80 . . . . . 0 N--CA 1.488 1.454 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.676 ' CD1' ' O ' ' A' ' 37' ' ' THR . 7.7 m95 -77.64 -66.0 0.89 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.563 -0.71 . . . . 0.0 112.648 -178.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.496 ' OG ' ' N ' ' A' ' 43' ' ' LYS . 0.1 OUTLIER -42.55 -73.4 0.05 OUTLIER 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.738 -1.226 . . . . 0.0 112.223 -177.344 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.602 ' HD2' HG23 ' A' ' 65' ' ' ILE . 0.0 OUTLIER -81.32 35.9 0.4 Allowed 'General case' 0 C--N 1.286 -2.162 0 O-C-N 121.544 -0.723 . . . . 0.0 109.814 -178.874 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.578 ' CE1' ' OD1' ' A' ' 48' ' ' ASP . 0.6 OUTLIER -80.03 12.9 2.5 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.135 -0.978 . . . . 0.0 110.695 -179.709 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 4.6 mttm -86.77 55.01 3.37 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 120.964 -1.085 . . . . 0.0 108.377 179.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -131.64 4.5 4.25 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.501 -0.749 . . . . 0.0 110.128 -178.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.558 ' O ' ' CB ' ' A' ' 51' ' ' GLU . . . 72.49 29.23 66.21 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 108.606 -1.798 . . . . 0.0 108.606 -179.308 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.74 ' HB2' HD21 ' A' ' 18' ' ' LEU . 0.0 OUTLIER 46.58 21.57 0.14 Allowed 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.482 -1.01 . . . . 0.0 110.329 -179.868 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.639 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 33.2 mm-40 59.06 -92.29 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.453 0 O-C-N 120.973 -1.079 . . . . 0.0 111.157 178.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . 0.499 ' O ' ' HD3' ' A' ' 54' ' ' PRO . 36.5 t -45.87 -25.64 0.56 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.183 -0.948 . . . . 0.0 110.862 -178.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.558 ' CB ' ' O ' ' A' ' 47' ' ' GLY . 20.1 tt0 -49.43 148.55 2.67 Favored 'General case' 0 N--CA 1.485 1.312 0 O-C-N 120.577 -1.327 . . . . 0.0 108.708 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.465 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . 90.8 -15.92 59.47 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 110.078 -1.209 . . . . 0.0 110.078 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.472 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 30.7 t60 65.03 64.26 1.06 Allowed Pre-proline 0 N--CA 1.493 1.72 0 O-C-N 121.144 -1.209 . . . . 0.0 109.599 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.499 ' HD3' ' O ' ' A' ' 50' ' ' CYS . 4.9 Cg_exo -61.19 -39.5 58.08 Favored 'Trans proline' 0 C--N 1.31 -1.5 0 C-N-CA 122.604 2.203 . . . . 0.0 110.604 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.464 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 1.8 m -71.51 173.05 8.48 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.381 -0.824 . . . . 0.0 109.304 -179.576 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.565 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.6 mt -146.6 -176.84 5.34 Favored 'General case' 0 N--CA 1.492 1.635 0 CA-C-O 122.231 1.015 . . . . 0.0 109.906 179.466 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.615 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 1.6 m120 45.84 61.33 2.7 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.513 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.411 ' HG3' ' C ' ' A' ' 57' ' ' ASN . 3.4 mt-30 46.54 33.36 1.96 Allowed 'General case' 0 C--N 1.299 -1.591 0 C-N-CA 119.468 -0.893 . . . . 0.0 109.384 177.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -73.93 145.71 35.53 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.669 -1.373 . . . . 0.0 109.669 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.468 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 1.3 t60 -79.91 115.8 19.7 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.208 -1.172 . . . . 0.0 109.021 179.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.464 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 44.5 t -91.92 134.37 34.85 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.102 -0.999 . . . . 0.0 110.092 -179.438 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.508 ' HB2' ' O ' ' A' ' 69' ' ' THR . 2.1 tttp . . . . . 0 N--CA 1.486 1.342 0 N-CA-C 106.919 -1.511 . . . . 0.0 106.919 178.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.513 ' O ' ' O ' ' A' ' 67' ' ' ASP . . . . . . . . 0 N--CA 1.488 2.161 0 N-CA-C 107.71 -2.156 . . . . 0.0 107.71 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.602 HG23 ' HD2' ' A' ' 43' ' ' LYS . 0.4 OUTLIER -53.31 -61.98 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 O-C-N 120.461 -1.611 . . . . 0.0 109.216 -179.088 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.58 ' N ' HG22 ' A' ' 65' ' ' ILE . . . -43.68 -38.46 4.26 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 110.029 -1.228 . . . . 0.0 110.029 -179.469 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.523 ' OD1' ' N ' ' A' ' 68' ' ' TYR . 1.6 p30 179.29 -157.16 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.255 -1.144 . . . . 0.0 110.094 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.647 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 3.1 p90 -150.66 124.84 9.39 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.121 -0.987 . . . . 0.0 108.919 -178.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.508 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 70.3 p -95.34 119.33 33.67 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 120.898 -1.126 . . . . 0.0 109.201 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 9.5 m -79.11 -171.46 2.67 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.664 -1.273 . . . . 0.0 108.382 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.468 ' HB ' ' HB3' ' A' ' 60' ' ' HIS . 5.1 m -161.19 145.1 13.21 Favored 'General case' 0 C--N 1.285 -2.198 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 179.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.5 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 73.8 m -109.06 118.34 36.53 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.176 -0.953 . . . . 0.0 108.974 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.908 ' HB3' ' CD1' ' A' ' 76' ' ' PHE . . . -47.89 -178.02 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.066 -1.021 . . . . 0.0 110.42 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -80.51 100.67 8.67 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-O 123.2 1.476 . . . . 0.0 108.065 178.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . 0.46 ' O ' ' OG1' ' A' ' 85' ' ' THR . . . 119.17 18.5 4.58 Favored Glycine 0 C--N 1.269 -3.148 0 CA-C-N 113.575 -1.648 . . . . 0.0 108.994 -179.208 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.908 ' CD1' ' HB3' ' A' ' 73' ' ' ALA . 4.8 m-85 -115.58 160.07 20.46 Favored 'General case' 0 C--N 1.294 -1.813 0 O-C-N 121.372 -1.076 . . . . 0.0 109.726 -178.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.647 ' OE2' HG22 ' A' ' 85' ' ' THR . 19.3 pt-20 -160.72 167.26 27.26 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.158 -0.964 . . . . 0.0 110.304 -179.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 108.28 166.68 21.22 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 110.105 -1.198 . . . . 0.0 110.105 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.39 -47.49 72.66 Favored 'General case' 0 C--N 1.307 -1.251 0 O-C-N 121.371 -1.076 . . . . 0.0 109.638 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.565 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 2.9 m-20 -111.79 32.57 5.36 Favored 'General case' 0 C--N 1.287 -2.129 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 179.272 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . 0.492 ' O ' ' HB2' ' A' ' 57' ' ' ASN . 3.3 m 52.27 67.82 0.92 Allowed 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 105.67 -1.974 . . . . 0.0 105.67 -177.215 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.433 ' C ' ' OD1' ' A' ' 57' ' ' ASN . 37.9 tt0 -103.52 -25.2 13.31 Favored 'General case' 0 C--N 1.306 -1.29 0 O-C-N 121.589 -0.694 . . . . 0.0 111.067 -176.558 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.632 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -99.53 74.84 1.91 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.898 -1.126 . . . . 0.0 109.212 -179.827 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.444 ' C ' ' O ' ' A' ' 83' ' ' PHE . 0.3 OUTLIER -43.66 94.97 0.01 OUTLIER 'General case' 0 C--N 1.293 -1.862 0 C-N-CA 119.697 -0.801 . . . . 0.0 109.521 -179.82 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.647 HG22 ' OE2' ' A' ' 77' ' ' GLU . 5.8 p -68.38 -11.69 59.98 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.339 -0.851 . . . . 0.0 109.822 -179.639 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.439 ' OXT' ' O ' ' A' ' 85' ' ' THR . 3.5 mtp180 . . . . . 0 C--N 1.299 -1.605 0 CA-C-O 118.034 -0.984 . . . . 0.0 109.936 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.515 ' O ' ' HB2' ' A' ' 22' ' ' CYS . 0.6 OUTLIER . . . . . 0 N--CA 1.489 1.514 0 N-CA-C 108.091 -1.078 . . . . 0.0 108.091 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.525 ' CD1' ' OH ' ' A' ' 44' ' ' TYR . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.568 0 O-C-N 121.873 -0.517 . . . . 0.0 110.011 -179.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.414 ' O ' ' HA ' ' A' ' 17' ' ' CYS . . . . . . . . 0 N--CA 1.488 1.472 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.826 ' SG ' ' HB2' ' A' ' 27' ' ' ALA . 1.7 t -130.67 173.24 11.1 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.397 -0.814 . . . . 0.0 109.379 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.525 ' O ' ' CB ' ' A' ' 24' ' ' LEU . 30.4 t -135.91 -0.74 2.52 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.217 -0.927 . . . . 0.0 109.934 179.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.525 ' CB ' ' O ' ' A' ' 23' ' ' SER . 0.1 OUTLIER . . . . . 0 N--CA 1.495 1.811 0 O-C-N 121.212 -0.93 . . . . 0.0 110.465 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.826 ' HB2' ' SG ' ' A' ' 22' ' ' CYS . . . . . . . . 0 N--CA 1.494 1.735 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.489 1.479 0 CA-C-O 122.19 0.995 . . . . 0.0 110.394 -179.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 5.3 t . . . . . 0 N--CA 1.492 1.667 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.584 ' CE2' ' CE2' ' A' ' 40' ' ' PHE . 1.9 m-85 . . . . . 0 N--CA 1.488 1.45 0 O-C-N 120.885 -1.134 . . . . 0.0 109.831 -179.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.596 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 22.6 m-20 . . . . . 0 N--CA 1.482 1.164 0 CA-C-O 121.255 0.55 . . . . 0.0 110.69 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.52 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 N--CA 1.487 1.375 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 178.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.661 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 5.8 mm100 . . . . . 0 C--O 1.203 -1.376 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.614 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -41.55 -60.09 1.42 Allowed 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.164 -1.585 . . . . 0.0 107.926 179.056 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.432 ' O ' ' N ' ' A' ' 41' ' ' TRP . 1.8 t70 . . . . . 0 N--CA 1.494 1.731 0 O-C-N 121.337 -0.852 . . . . 0.0 109.263 177.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.661 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 20.6 t80 . . . . . 0 N--CA 1.489 1.521 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.614 ' CD1' ' O ' ' A' ' 37' ' ' THR . 9.5 m95 -80.94 -71.85 0.45 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.778 -0.576 . . . . 0.0 112.101 -179.176 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.52 ' OG ' ' N ' ' A' ' 43' ' ' LYS . 1.1 p -53.77 -60.34 3.45 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.435 -1.416 . . . . 0.0 110.711 -178.113 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.52 ' N ' ' OG ' ' A' ' 42' ' ' SER . 0.3 OUTLIER -62.38 -13.71 32.21 Favored 'General case' 0 C--N 1.284 -2.246 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 -179.738 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.707 ' O ' ' N ' ' A' ' 46' ' ' ASP . 0.9 OUTLIER -43.23 -65.72 0.46 Allowed 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.31 -0.869 . . . . 0.0 109.0 -179.769 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.543 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.2 OUTLIER -15.58 73.34 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.719 0 CA-C-O 121.203 0.525 . . . . 0.0 111.272 -179.938 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.707 ' N ' ' O ' ' A' ' 44' ' ' TYR . 2.6 t0 -161.71 -30.26 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.215 -0.928 . . . . 0.0 110.414 -178.602 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.491 ' O ' ' OD2' ' A' ' 48' ' ' ASP . . . 105.34 16.15 17.19 Favored Glycine 0 N--CA 1.486 1.999 0 N-CA-C 108.15 -1.98 . . . . 0.0 108.15 -178.199 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.658 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER 72.21 9.23 5.93 Favored 'General case' 0 N--CA 1.504 2.244 0 O-C-N 121.777 -0.837 . . . . 0.0 109.988 -179.704 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.658 ' HB2' ' O ' ' A' ' 48' ' ' ASP . 32.5 mm-40 79.42 -25.13 0.19 Allowed 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.77 -0.581 . . . . 0.0 111.807 178.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 19.2 t -111.8 -14.49 13.55 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.676 -1.265 . . . . 0.0 110.349 -179.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.487 ' CB ' ' O ' ' A' ' 47' ' ' GLY . 13.9 tt0 -54.98 -20.39 9.0 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 120.943 -1.098 . . . . 0.0 111.514 -179.34 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.415 ' O ' ' C ' ' A' ' 53' ' ' HIS . . . -95.94 21.74 43.31 Favored Glycine 0 N--CA 1.497 2.708 0 O-C-N 120.701 -1.25 . . . . 0.0 111.244 -178.518 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.582 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 13.2 t60 42.94 54.66 10.27 Favored Pre-proline 0 N--CA 1.493 1.717 0 O-C-N 120.956 -1.32 . . . . 0.0 109.721 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.582 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 6.3 Cg_exo -57.89 -39.43 86.71 Favored 'Trans proline' 0 C--N 1.309 -1.542 0 C-N-CA 122.537 2.158 . . . . 0.0 111.846 -179.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.464 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 1.0 OUTLIER -83.84 158.84 21.52 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.083 -1.011 . . . . 0.0 110.348 -178.405 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.531 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.4 mt -144.69 -172.84 3.9 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.434 -0.791 . . . . 0.0 109.516 -179.83 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.646 ' HB3' ' CD2' ' A' ' 76' ' ' PHE . 8.1 m-80 46.78 58.81 4.38 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-O 121.827 0.822 . . . . 0.0 110.363 178.662 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.566 ' OE1' ' CZ ' ' A' ' 76' ' ' PHE . 8.4 mt-30 52.64 30.16 8.31 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-O 121.489 0.662 . . . . 0.0 109.54 177.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.438 ' HA2' ' O ' ' A' ' 71' ' ' THR . . . -82.31 141.32 21.29 Favored Glycine 0 N--CA 1.489 2.217 0 N-CA-C 109.728 -1.349 . . . . 0.0 109.728 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -79.39 149.71 31.57 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.193 -1.18 . . . . 0.0 108.036 179.137 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.464 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 41.0 t -119.55 113.79 21.26 Favored 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 119.027 -1.069 . . . . 0.0 111.254 -178.529 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.429 ' HB3' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.299 -1.589 0 N-CA-C 105.454 -2.054 . . . . 0.0 105.454 176.595 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.503 ' O ' ' O ' ' A' ' 67' ' ' ASP . . . . . . . . 0 N--CA 1.488 2.142 0 N-CA-C 107.438 -2.265 . . . . 0.0 107.438 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.595 HG22 ' N ' ' A' ' 66' ' ' GLY . 0.0 OUTLIER -45.53 -56.21 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 120.662 -1.493 . . . . 0.0 109.132 -178.826 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.595 ' N ' HG22 ' A' ' 65' ' ' ILE . . . -44.04 -43.58 7.09 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.503 ' O ' ' O ' ' A' ' 64' ' ' GLY . 2.1 p-10 178.44 -154.87 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.408 -1.054 . . . . 0.0 109.686 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.648 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 1.9 p90 -144.82 157.73 44.06 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 120.859 -1.151 . . . . 0.0 109.962 -179.211 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.429 ' OG1' ' HB3' ' A' ' 62' ' ' LYS . 73.7 p -122.52 115.15 21.69 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.429 -0.795 . . . . 0.0 109.181 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 65.8 m -84.63 -167.61 1.87 Allowed 'General case' 0 C--N 1.298 -1.643 0 O-C-N 120.889 -1.132 . . . . 0.0 108.937 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.438 ' O ' ' HA2' ' A' ' 59' ' ' GLY . 1.3 m -160.85 120.93 2.74 Favored 'General case' 0 C--N 1.29 -2.011 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.442 ' O ' ' O ' ' A' ' 73' ' ' ALA . 91.4 m -89.56 115.88 27.29 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.126 -0.983 . . . . 0.0 109.437 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.442 ' O ' ' O ' ' A' ' 72' ' ' CYS . . . -49.51 -179.42 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.481 0 O-C-N 120.915 -1.116 . . . . 0.0 110.162 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -81.03 101.3 9.47 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-O 122.97 1.367 . . . . 0.0 107.799 178.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . 0.583 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 130.99 5.11 3.97 Favored Glycine 0 C--N 1.269 -3.149 0 CA-C-N 114.003 -1.453 . . . . 0.0 110.003 -179.315 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.646 ' CD2' ' HB3' ' A' ' 57' ' ' ASN . 45.4 m-85 -133.45 154.16 51.02 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.111 -1.229 . . . . 0.0 110.606 -177.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.467 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 0.0 OUTLIER -155.92 168.22 27.91 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.247 -0.908 . . . . 0.0 110.206 -179.233 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 116.79 171.99 16.11 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 109.452 -1.459 . . . . 0.0 109.452 179.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.469 ' C ' ' HD3' ' A' ' 79' ' ' LYS . 0.4 OUTLIER -50.98 -56.26 13.32 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.152 -1.205 . . . . 0.0 108.65 179.687 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.531 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 1.3 m-20 -108.39 26.87 9.95 Favored 'General case' 0 C--N 1.287 -2.122 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . 0.538 ' O ' ' ND2' ' A' ' 57' ' ' ASN . 4.1 m 63.87 14.63 8.49 Favored 'General case' 0 C--N 1.305 -1.342 0 O-C-N 121.083 -1.01 . . . . 0.0 108.372 -178.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 36.8 tt0 -38.24 -25.5 0.01 OUTLIER 'General case' 0 C--N 1.309 -1.179 0 O-C-N 121.861 -0.525 . . . . 0.0 111.71 -179.53 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.551 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.4 OUTLIER -97.43 -161.44 0.87 Allowed 'General case' 0 C--N 1.299 -1.599 0 CA-C-O 122.836 1.303 . . . . 0.0 109.597 -179.743 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.469 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 54.7 m -161.44 93.1 0.92 Allowed 'General case' 0 C--N 1.277 -2.555 0 CA-C-N 114.302 -1.317 . . . . 0.0 109.098 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.439 ' C ' ' HG3' ' A' ' 86' ' ' ARG . 82.7 p -51.92 -58.81 5.4 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.191 -0.943 . . . . 0.0 109.885 -179.519 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.444 ' O ' ' HA3' ' A' ' 75' ' ' GLY . 2.5 ppt_? . . . . . 0 C--N 1.285 -2.225 0 CA-C-O 117.997 -1.002 . . . . 0.0 109.445 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.71 ' HA ' ' HB3' ' A' ' 22' ' ' CYS . 44.6 t . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 122.227 1.013 . . . . 0.0 109.287 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.854 HD11 ' O ' ' A' ' 48' ' ' ASP . 0.1 OUTLIER . . . . . 0 C--N 1.298 -1.636 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.146 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.694 0 CA-C-O 120.827 0.346 . . . . 0.0 110.801 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.71 ' HB3' ' HA ' ' A' ' 17' ' ' CYS . 18.1 p -134.5 -163.59 1.39 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.842 -1.161 . . . . 0.0 110.491 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.427 ' O ' ' C ' ' A' ' 24' ' ' LEU . 84.4 p -170.62 137.8 1.38 Allowed 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 179.317 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.846 HD22 ' O ' ' A' ' 24' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.616 0 O-C-N 121.227 -0.92 . . . . 0.0 111.042 -179.278 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.702 ' HB3' ' CZ2' ' A' ' 41' ' ' TRP . . . . . . . . 0 N--CA 1.488 1.471 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.548 ' HG3' ' O ' ' A' ' 24' ' ' LEU . 4.1 mtp180 . . . . . 0 N--CA 1.491 1.578 0 O-C-N 121.252 -0.905 . . . . 0.0 110.801 -179.345 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 1.9 t . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.653 ' HZ ' ' HB1' ' A' ' 27' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.611 0 C-N-CA 119.138 -1.025 . . . . 0.0 110.014 178.265 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.595 ' HB2' ' CG ' ' A' ' 36' ' ' GLN . 4.8 m-20 . . . . . 0 N--CA 1.484 1.229 0 CA-C-O 121.561 0.696 . . . . 0.0 111.44 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.526 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 C--N 1.305 -1.364 0 N-CA-C 106.12 -1.808 . . . . 0.0 106.12 177.078 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.691 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--O 1.202 -1.417 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.604 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -41.89 -61.89 1.03 Allowed 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 117.548 -1.661 . . . . 0.0 106.969 178.698 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.554 ' O ' ' N ' ' A' ' 41' ' ' TRP . 0.4 OUTLIER . . . . . 0 N--CA 1.493 1.679 0 O-C-N 121.358 -0.839 . . . . 0.0 109.544 176.397 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.763 ' O ' ' HB2' ' A' ' 44' ' ' TYR . 21.0 t80 . . . . . 0 C--O 1.189 -2.103 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.702 ' CZ2' ' HB3' ' A' ' 27' ' ' ALA . 16.2 m95 -80.94 -66.06 0.93 Allowed 'General case' 0 C--N 1.294 -1.817 0 O-C-N 120.656 -1.278 . . . . 0.0 112.019 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.55 ' O ' ' CB ' ' A' ' 43' ' ' LYS . 0.6 OUTLIER -71.85 79.62 0.88 Allowed 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 122.334 1.064 . . . . 0.0 109.565 -178.81 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.55 ' CB ' ' O ' ' A' ' 42' ' ' SER . 0.0 OUTLIER 153.68 -26.69 0.0 OUTLIER 'General case' 0 C--N 1.283 -2.324 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 -179.46 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.976 ' HA ' HD11 ' A' ' 65' ' ' ILE . 22.1 t80 -80.38 -97.55 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 179.034 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.551 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.1 OUTLIER 35.84 33.41 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 -179.057 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.563 ' HB2' ' O ' ' A' ' 44' ' ' TYR . 7.4 t0 -134.21 -17.59 2.08 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.712 -176.308 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.524 ' HA2' ' CE1' ' A' ' 44' ' ' TYR . . . 45.06 60.88 3.75 Favored Glycine 0 N--CA 1.496 2.685 0 N-CA-C 106.328 -2.709 . . . . 0.0 106.328 -177.31 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.854 ' O ' HD11 ' A' ' 18' ' ' LEU . 13.0 t70 -129.18 -129.22 0.21 Allowed 'General case' 0 C--N 1.308 -1.228 0 O-C-N 121.445 -1.032 . . . . 0.0 111.434 -176.166 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.542 ' HG3' ' N ' ' A' ' 67' ' ' ASP . 0.1 OUTLIER 52.04 -86.0 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.425 -0.797 . . . . 0.0 111.343 -179.385 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . 0.502 ' HA ' ' CG ' ' A' ' 54' ' ' PRO . 46.1 t -101.33 12.63 37.1 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.948 -1.095 . . . . 0.0 111.221 -178.542 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -70.19 146.05 51.02 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 120.714 -1.241 . . . . 0.0 109.008 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 90.94 -1.85 78.62 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 110.107 -1.197 . . . . 0.0 110.107 179.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.43 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 10.2 t60 62.59 66.52 1.3 Allowed Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.114 -1.227 . . . . 0.0 109.411 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.502 ' CG ' ' HA ' ' A' ' 50' ' ' CYS . 3.0 Cg_exo -61.97 -52.93 2.4 Favored 'Trans proline' 0 C--N 1.309 -1.502 0 C-N-CA 122.42 2.08 . . . . 0.0 111.259 -179.666 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.491 ' SG ' ' CB ' ' A' ' 61' ' ' CYS . 1.8 m -65.76 160.72 22.35 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.093 -1.005 . . . . 0.0 109.178 -179.349 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.502 ' HA ' HD23 ' A' ' 56' ' ' LEU . 5.3 mt -145.21 -173.83 4.21 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.195 -0.941 . . . . 0.0 110.026 -179.573 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.658 ' HB3' ' CD2' ' A' ' 76' ' ' PHE . 8.2 m-80 45.68 59.7 3.51 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-O 121.995 0.902 . . . . 0.0 110.281 178.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.443 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 2.2 mm-40 53.66 30.18 10.58 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-O 121.521 0.677 . . . . 0.0 109.709 177.678 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.498 ' HA2' ' O ' ' A' ' 71' ' ' THR . . . -81.58 131.13 10.17 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.435 -1.466 . . . . 0.0 109.435 179.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -79.63 123.48 27.67 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.116 -1.226 . . . . 0.0 109.019 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.491 ' CB ' ' SG ' ' A' ' 55' ' ' CYS . 39.0 t -91.96 148.98 21.79 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.383 -0.823 . . . . 0.0 110.397 -179.046 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 69' ' ' THR . 0.9 OUTLIER . . . . . 0 C--N 1.305 -1.369 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 178.446 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.556 ' O ' ' O ' ' A' ' 65' ' ' ILE . . . . . . . . 0 N--CA 1.488 2.106 0 N-CA-C 110.95 -0.86 . . . . 0.0 110.95 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.976 HD11 ' HA ' ' A' ' 44' ' ' TYR . 0.1 OUTLIER 54.97 143.34 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.258 -1.142 . . . . 0.0 109.975 179.776 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 85.07 -43.47 3.26 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 108.223 -1.951 . . . . 0.0 108.223 -178.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.542 ' N ' ' HG3' ' A' ' 49' ' ' GLN . 1.8 p-10 -176.15 -157.46 0.05 Allowed 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.488 -1.007 . . . . 0.0 109.162 178.51 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.704 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 4.0 p90 -160.71 125.46 3.69 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.303 -0.873 . . . . 0.0 108.759 -177.724 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.473 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 73.3 p -85.48 128.21 34.66 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 120.492 -1.38 . . . . 0.0 109.66 179.691 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 31.0 m -92.89 -170.91 2.56 Favored 'General case' 0 C--N 1.306 -1.287 0 O-C-N 120.972 -1.08 . . . . 0.0 108.422 179.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.498 ' O ' ' HA2' ' A' ' 59' ' ' GLY . 9.0 m -161.34 112.65 1.76 Allowed 'General case' 0 C--N 1.289 -2.06 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.571 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 99.6 m -79.74 121.19 25.03 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 120.96 -1.088 . . . . 0.0 108.766 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -52.05 175.34 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.403 0 O-C-N 120.937 -1.102 . . . . 0.0 109.732 -179.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -80.75 101.33 9.25 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-O 123.022 1.391 . . . . 0.0 107.788 178.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . 0.553 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 131.45 5.99 3.53 Favored Glycine 0 C--N 1.27 -3.126 0 CA-C-N 113.905 -1.498 . . . . 0.0 110.184 -179.374 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.658 ' CD2' ' HB3' ' A' ' 57' ' ' ASN . 27.1 m-85 -130.64 160.78 33.22 Favored 'General case' 0 C--N 1.299 -1.626 0 O-C-N 121.041 -1.27 . . . . 0.0 110.6 -178.238 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.482 ' C ' ' HA ' ' A' ' 81' ' ' CYS . 0.8 OUTLIER -159.44 169.23 24.37 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.119 -0.988 . . . . 0.0 110.494 -179.387 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 115.83 173.49 17.35 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 109.322 -1.511 . . . . 0.0 109.322 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.55 -57.47 7.02 Favored 'General case' 0 C--N 1.306 -1.301 0 O-C-N 121.088 -1.242 . . . . 0.0 109.018 179.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.488 ' O ' ' CB ' ' A' ' 81' ' ' CYS . 2.7 m-20 -108.51 23.94 13.78 Favored 'General case' 0 C--N 1.29 -2.013 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 178.762 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . 0.589 ' HB2' ' HB2' ' A' ' 57' ' ' ASN . 3.3 m 72.05 15.47 5.55 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.078 -1.014 . . . . 0.0 108.566 -179.451 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 34.8 tt0 -39.42 -25.13 0.02 OUTLIER 'General case' 0 C--N 1.308 -1.239 0 O-C-N 121.772 -0.58 . . . . 0.0 112.348 -179.266 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.52 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.4 OUTLIER -101.96 -161.84 0.88 Allowed 'General case' 0 C--N 1.299 -1.608 0 CA-C-O 122.91 1.338 . . . . 0.0 110.092 -179.079 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.505 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 8.0 m -156.36 99.07 1.89 Allowed 'General case' 0 C--N 1.278 -2.515 0 CA-C-N 114.13 -1.396 . . . . 0.0 109.069 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 77.9 p -58.29 -55.48 34.46 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.085 -1.009 . . . . 0.0 109.764 -179.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.517 ' HG2' ' HA2' ' A' ' 75' ' ' GLY . 0.0 OUTLIER . . . . . 0 C--N 1.285 -2.208 0 CA-C-O 117.984 -1.008 . . . . 0.0 109.411 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.775 ' HB3' ' C ' ' A' ' 21' ' ' ALA . 3.6 m . . . . . 0 N--CA 1.481 1.118 0 CA-C-O 123.024 1.392 . . . . 0.0 107.891 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.902 HD21 ' CG ' ' A' ' 48' ' ' ASP . 0.4 OUTLIER . . . . . 0 C--N 1.286 -2.176 0 CA-C-N 114.43 -1.259 . . . . 0.0 107.62 177.488 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.775 ' C ' ' HB3' ' A' ' 17' ' ' CYS . . . . . . . . 0 C--O 1.215 -0.761 0 CA-C-O 122.746 1.26 . . . . 0.0 108.698 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.483 ' C ' ' O ' ' A' ' 21' ' ' ALA . 17.0 p 20.14 -142.2 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 CA-C-N 113.342 -1.754 . . . . 0.0 112.397 177.599 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 32.2 t -127.21 58.47 1.45 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.849 -1.157 . . . . 0.0 111.168 -178.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.596 ' HA ' ' CH2' ' A' ' 41' ' ' TRP . 0.2 OUTLIER . . . . . 0 N--CA 1.493 1.688 0 O-C-N 121.234 -0.916 . . . . 0.0 111.229 178.372 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.61 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . . . . . . . . 0 N--CA 1.493 1.689 0 CA-C-O 121.011 0.434 . . . . 0.0 110.427 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.3 ptm180 . . . . . 0 N--CA 1.494 1.763 0 O-C-N 120.929 -1.107 . . . . 0.0 110.077 -179.305 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.482 HG12 ' O ' ' A' ' 27' ' ' ALA . 1.7 p . . . . . 0 N--CA 1.491 1.625 0 CA-C-O 120.932 0.396 . . . . 0.0 109.954 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.595 ' CE1' ' O ' ' A' ' 27' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.494 1.729 0 O-C-N 120.922 -1.111 . . . . 0.0 111.025 -179.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.592 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 0.8 OUTLIER . . . . . 0 N--CA 1.48 1.06 0 CA-C-O 121.472 0.653 . . . . 0.0 111.583 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.468 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 C--N 1.306 -1.296 0 N-CA-C 106.477 -1.675 . . . . 0.0 106.477 177.432 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.632 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 23.1 mt-30 . . . . . 0 C--O 1.205 -1.289 0 N-CA-C 108.445 -0.946 . . . . 0.0 108.445 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.67 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -43.11 -59.35 2.08 Favored 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 117.709 -1.596 . . . . 0.0 107.317 178.502 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.481 ' O ' ' N ' ' A' ' 41' ' ' TRP . 1.0 OUTLIER . . . . . 0 N--CA 1.493 1.715 0 O-C-N 121.277 -0.89 . . . . 0.0 109.405 177.195 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.632 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 10.9 t80 . . . . . 0 N--CA 1.486 1.364 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.67 ' CD1' ' O ' ' A' ' 37' ' ' THR . 9.9 m95 -77.07 177.35 7.88 Favored 'General case' 0 C--N 1.306 -1.304 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 176.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . 0.567 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 0.1 OUTLIER 62.65 110.97 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.345 0 O-C-N 120.506 -1.371 . . . . 0.0 108.625 -179.992 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.567 ' CG ' ' O ' ' A' ' 42' ' ' SER . 0.0 OUTLIER 84.59 -25.48 0.13 Allowed 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 -178.617 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.714 ' O ' ' N ' ' A' ' 46' ' ' ASP . 1.0 OUTLIER -40.6 -63.72 0.61 Allowed 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.545 -179.948 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.513 ' C ' ' O ' ' A' ' 44' ' ' TYR . 5.6 ptmt -20.84 74.35 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.557 0 CA-C-O 121.238 0.542 . . . . 0.0 111.185 -179.469 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.714 ' N ' ' O ' ' A' ' 44' ' ' TYR . 3.8 t70 -161.82 18.46 0.1 Allowed 'General case' 0 N--CA 1.486 1.341 0 O-C-N 121.238 -0.914 . . . . 0.0 109.709 -178.382 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.552 ' O ' HD11 ' A' ' 18' ' ' LEU . . . 67.35 11.44 59.31 Favored Glycine 0 N--CA 1.492 2.403 0 N-CA-C 107.906 -2.078 . . . . 0.0 107.906 -177.685 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.902 ' CG ' HD21 ' A' ' 18' ' ' LEU . 0.3 OUTLIER 71.61 5.89 5.53 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.612 -0.934 . . . . 0.0 109.785 -179.644 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.595 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 2.9 mm100 78.09 -18.38 0.51 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.312 -0.867 . . . . 0.0 111.255 178.254 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . 0.484 ' O ' ' HD3' ' A' ' 54' ' ' PRO . 0.1 OUTLIER -108.38 -18.27 13.79 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 120.756 -1.215 . . . . 0.0 110.157 -179.683 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.44 ' HG3' ' O ' ' A' ' 51' ' ' GLU . 1.9 tt0 -50.62 -20.07 1.1 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.173 -0.954 . . . . 0.0 111.238 -179.247 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.416 ' O ' ' C ' ' A' ' 53' ' ' HIS . . . -85.63 19.94 21.58 Favored Glycine 0 N--CA 1.495 2.585 0 O-C-N 120.813 -1.179 . . . . 0.0 110.867 -178.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.56 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 20.3 t-160 45.03 59.55 14.02 Favored Pre-proline 0 N--CA 1.492 1.647 0 O-C-N 120.892 -1.358 . . . . 0.0 109.086 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.56 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 5.5 Cg_exo -57.74 -53.11 4.88 Favored 'Trans proline' 0 C--N 1.309 -1.541 0 C-N-CA 122.658 2.239 . . . . 0.0 111.869 -179.568 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.559 ' SG ' ' CB ' ' A' ' 61' ' ' CYS . 3.6 m -60.32 175.41 0.43 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 120.836 -1.165 . . . . 0.0 110.046 -178.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.509 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 4.9 mt -148.87 -174.98 4.77 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-O 121.647 0.737 . . . . 0.0 109.121 179.198 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.634 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 54.5 m-80 39.14 64.01 0.87 Allowed 'General case' 0 C--N 1.299 -1.591 0 CA-C-O 121.886 0.851 . . . . 0.0 109.662 -179.664 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.449 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 0.2 OUTLIER 51.75 35.74 16.02 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 121.667 0.746 . . . . 0.0 109.328 178.148 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -86.99 131.12 10.38 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.775 -1.33 . . . . 0.0 109.775 -179.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.484 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 88.9 m-70 -79.43 142.26 36.07 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.309 -1.112 . . . . 0.0 108.561 179.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.576 ' HA ' ' HA ' ' A' ' 70' ' ' CYS . 0.1 OUTLIER -116.13 127.23 54.66 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.075 -1.016 . . . . 0.0 110.137 -179.039 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.548 ' HB3' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.36 0 N-CA-C 106.595 -1.632 . . . . 0.0 106.595 177.569 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.523 0 N-CA-C 108.389 -1.884 . . . . 0.0 108.389 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.692 HG23 ' HA ' ' A' ' 44' ' ' TYR . 35.9 mm -86.68 -66.59 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 120.744 -1.444 . . . . 0.0 110.341 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.425 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . -61.19 -12.57 31.55 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 -179.544 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.496 ' HA ' HE21 ' A' ' 49' ' ' GLN . 1.5 p-10 -178.1 -157.3 0.04 OUTLIER 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.201 -1.176 . . . . 0.0 110.357 179.378 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.697 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 2.0 p90 -156.15 -160.37 1.0 Allowed 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -178.632 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.548 ' OG1' ' HB3' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -151.04 177.67 9.94 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 177.955 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . 0.576 ' HA ' ' HA ' ' A' ' 61' ' ' CYS . 1.3 m -137.09 -174.47 3.75 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 120.674 -1.266 . . . . 0.0 109.4 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.484 ' HB ' ' HB2' ' A' ' 60' ' ' HIS . 0.7 OUTLIER -161.09 123.63 3.14 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 179.362 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.513 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 84.7 m -97.84 140.34 32.36 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.93 -1.106 . . . . 0.0 109.571 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.851 ' HB3' ' CE1' ' A' ' 76' ' ' PHE . . . -73.76 -176.39 2.39 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.073 -1.017 . . . . 0.0 110.659 -179.621 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -81.45 102.31 10.45 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-O 123.119 1.438 . . . . 0.0 108.265 178.362 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . 0.464 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 123.31 17.57 3.24 Favored Glycine 0 C--N 1.268 -3.238 0 CA-C-N 113.765 -1.561 . . . . 0.0 109.459 -179.332 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.851 ' CE1' ' HB3' ' A' ' 73' ' ' ALA . 4.8 m-85 -119.92 167.79 11.79 Favored 'General case' 0 C--N 1.294 -1.805 0 O-C-N 121.44 -1.035 . . . . 0.0 109.578 -178.316 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.51 ' CB ' ' HB2' ' A' ' 83' ' ' PHE . 3.7 mt-10 -160.41 171.01 19.83 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.038 -1.039 . . . . 0.0 110.355 -179.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.33 169.01 40.41 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 179.573 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.441 ' C ' ' HD3' ' A' ' 79' ' ' LYS . 1.0 OUTLIER -57.89 -55.81 30.1 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.303 -1.116 . . . . 0.0 109.318 179.897 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.509 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.2 OUTLIER -95.56 25.46 4.5 Favored 'General case' 0 C--N 1.287 -2.119 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.585 179.999 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . 0.507 ' O ' ' ND2' ' A' ' 57' ' ' ASN . 6.6 m 69.7 11.6 7.9 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.84 -1.163 . . . . 0.0 109.021 -179.619 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.518 ' HA ' ' ND2' ' A' ' 57' ' ' ASN . 26.7 tt0 -42.06 -47.4 4.49 Favored 'General case' 0 N--CA 1.489 1.517 0 CA-C-O 121.446 0.641 . . . . 0.0 111.39 -179.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.619 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.6 OUTLIER -79.77 84.63 5.54 Favored 'General case' 0 C--N 1.295 -1.794 0 O-C-N 121.223 -0.923 . . . . 0.0 110.66 -178.328 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.451 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 3.9 p -67.42 94.5 0.4 Allowed 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.583 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.457 ' H ' HG23 ' A' ' 85' ' ' THR . 18.5 p -54.92 -21.38 11.44 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.172 -0.955 . . . . 0.0 109.924 -179.041 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.417 ' HD2' ' HA3' ' A' ' 75' ' ' GLY . 14.4 ptm180 . . . . . 0 C--N 1.289 -2.044 0 CA-C-O 118.033 -0.985 . . . . 0.0 109.556 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.81 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 28.2 m . . . . . 0 N--CA 1.493 1.697 0 CA-C-O 120.499 0.19 . . . . 0.0 111.199 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.423 ' C ' ' O ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.505 0 C-N-CA 118.641 -1.224 . . . . 0.0 108.061 179.252 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.81 ' HB3' ' HA ' ' A' ' 17' ' ' CYS . . . . . . . . 0 N--CA 1.496 1.865 0 CA-C-O 121.503 0.668 . . . . 0.0 110.07 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.504 ' HB2' ' HB3' ' A' ' 17' ' ' CYS . 1.4 m -149.57 168.59 23.11 Favored 'General case' 0 C--N 1.292 -1.909 0 O-C-N 121.549 -0.719 . . . . 0.0 109.178 178.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.548 ' O ' ' CB ' ' A' ' 24' ' ' LEU . 0.7 OUTLIER -85.29 31.62 0.57 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.158 -0.964 . . . . 0.0 110.502 -178.986 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.548 ' CB ' ' O ' ' A' ' 23' ' ' SER . 0.1 OUTLIER . . . . . 0 N--CA 1.495 1.809 0 O-C-N 121.409 -0.807 . . . . 0.0 110.31 179.665 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 121.311 0.577 . . . . 0.0 110.213 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.516 ' O ' ' CG ' ' A' ' 28' ' ' ARG . 26.3 ptt180 . . . . . 0 C--N 1.3 -1.577 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 178.416 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.1 t . . . . . 0 N--CA 1.485 1.292 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.693 ' CD1' ' N ' ' A' ' 31' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.304 -1.397 0 O-C-N 121.381 -0.825 . . . . 0.0 109.772 -179.695 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.64 ' HB2' ' CD2' ' A' ' 31' ' ' PHE . 0.9 OUTLIER . . . . . 0 N--CA 1.488 1.442 0 CA-C-O 121.379 0.609 . . . . 0.0 110.57 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.471 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 N--CA 1.486 1.361 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 179.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.68 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 65.8 mt-30 . . . . . 0 C--O 1.202 -1.41 0 N-CA-C 108.261 -1.015 . . . . 0.0 108.261 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.647 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -42.54 -59.3 1.94 Allowed 'General case' 0 N--CA 1.499 2.014 0 O-C-N 119.797 -1.814 . . . . 0.0 107.571 178.4 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . 0.477 ' O ' ' O ' ' A' ' 41' ' ' TRP . 2.0 t70 . . . . . 0 N--CA 1.491 1.619 0 O-C-N 121.43 -0.794 . . . . 0.0 109.305 177.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.68 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 18.5 t80 . . . . . 0 N--CA 1.493 1.685 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.647 ' CD1' ' O ' ' A' ' 37' ' ' THR . 9.1 m95 -80.99 172.02 14.26 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.878 -0.514 . . . . 0.0 109.857 178.505 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 76.47 -59.8 0.49 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.532 -0.73 . . . . 0.0 112.254 177.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.74 11.05 39.43 Favored 'General case' 0 C--N 1.28 -2.432 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 178.489 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.607 ' O ' ' N ' ' A' ' 46' ' ' ASP . 0.8 OUTLIER -56.9 -76.22 0.04 OUTLIER 'General case' 0 C--N 1.307 -1.248 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 179.589 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.549 ' C ' ' O ' ' A' ' 44' ' ' TYR . 7.1 mttt 9.85 55.55 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.419 0 CA-C-O 121.172 0.511 . . . . 0.0 112.144 179.095 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.607 ' N ' ' O ' ' A' ' 44' ' ' TYR . 0.9 OUTLIER -156.35 8.55 0.22 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.131 -0.981 . . . . 0.0 110.056 -179.667 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.571 ' O ' ' CB ' ' A' ' 48' ' ' ASP . . . 86.03 -48.46 3.95 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 108.636 -1.785 . . . . 0.0 108.636 -179.147 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.571 ' CB ' ' O ' ' A' ' 47' ' ' GLY . 16.1 p-10 140.42 -10.04 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.247 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 179.561 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.594 ' NE2' ' O ' ' A' ' 65' ' ' ILE . 0.0 OUTLIER 77.78 -15.99 0.7 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.754 -0.591 . . . . 0.0 110.858 -179.547 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . 0.48 ' HB3' ' OD2' ' A' ' 48' ' ' ASP . 20.2 t -99.23 -21.09 16.26 Favored 'General case' 0 N--CA 1.487 1.403 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 176.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.489 ' HB2' ' OD1' ' A' ' 48' ' ' ASP . 21.9 tt0 -58.93 148.89 28.74 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 121.319 -0.863 . . . . 0.0 108.899 179.248 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.462 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . 102.2 -22.25 38.57 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 109.357 -1.497 . . . . 0.0 109.357 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.546 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 0.6 OUTLIER 68.8 58.24 0.64 Allowed Pre-proline 0 N--CA 1.49 1.56 0 O-C-N 121.456 -1.026 . . . . 0.0 109.847 -179.954 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.546 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 3.2 Cg_exo -57.05 -35.09 98.8 Favored 'Trans proline' 0 C--N 1.31 -1.494 0 C-N-CA 122.36 2.04 . . . . 0.0 110.317 179.327 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.538 ' O ' ' CE1' ' A' ' 53' ' ' HIS . 0.2 OUTLIER -75.28 164.2 26.69 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.576 -0.703 . . . . 0.0 109.197 -179.617 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.505 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.8 mt -145.0 -175.34 4.65 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.241 -0.912 . . . . 0.0 110.037 179.724 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.602 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 0.9 OUTLIER 42.59 63.63 1.38 Allowed 'General case' 0 C--N 1.299 -1.605 0 CA-C-O 121.931 0.872 . . . . 0.0 109.143 -179.965 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.433 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 0.2 OUTLIER 51.61 32.66 9.45 Favored 'General case' 0 C--N 1.301 -1.532 0 C-N-CA 119.934 -0.706 . . . . 0.0 109.771 177.938 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -82.2 139.35 19.66 Favored Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.367 -1.493 . . . . 0.0 109.367 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -79.76 149.69 31.03 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.264 -1.139 . . . . 0.0 109.095 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.446 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 44.3 t -116.12 124.78 51.21 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.106 -0.996 . . . . 0.0 110.144 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.546 ' HB2' ' OG1' ' A' ' 69' ' ' THR . 80.5 mttt . . . . . 0 C--N 1.302 -1.482 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 177.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.651 ' O ' ' N ' ' A' ' 66' ' ' GLY . . . . . . . . 0 N--CA 1.492 2.385 0 N-CA-C 109.121 -1.592 . . . . 0.0 109.121 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.892 HD12 ' H ' ' A' ' 66' ' ' GLY . 0.6 OUTLIER 19.74 -71.01 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.511 2.611 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -178.726 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.892 ' H ' HD12 ' A' ' 65' ' ' ILE . . . -32.7 -36.33 0.04 OUTLIER Glycine 0 N--CA 1.502 3.05 0 N-CA-C 109.222 -1.551 . . . . 0.0 109.222 -179.295 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.556 ' HA ' ' OE1' ' A' ' 49' ' ' GLN . 3.1 p-10 175.84 -162.87 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 177.584 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.644 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 1.0 OUTLIER -131.18 -176.48 4.03 Favored 'General case' 0 C--N 1.291 -1.971 0 O-C-N 121.01 -1.056 . . . . 0.0 108.341 179.934 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.546 ' OG1' ' HB2' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -148.5 109.83 4.39 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 120.821 -1.174 . . . . 0.0 109.537 179.342 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 66.8 m -84.47 -174.15 5.12 Favored 'General case' 0 C--N 1.292 -1.904 0 CA-C-O 122.149 0.976 . . . . 0.0 109.608 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 10.3 m -161.35 144.21 12.41 Favored 'General case' 0 C--N 1.286 -2.195 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.31 179.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . 0.542 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 99.1 m -106.81 134.31 50.15 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.144 -0.973 . . . . 0.0 108.991 179.522 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.916 ' HB3' ' CE1' ' A' ' 76' ' ' PHE . . . -64.92 -175.12 0.17 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.943 -1.098 . . . . 0.0 111.076 -179.092 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -81.5 101.56 10.0 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-O 123.114 1.435 . . . . 0.0 108.307 178.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . 0.437 ' O ' ' OG1' ' A' ' 85' ' ' THR . . . 120.3 16.54 4.71 Favored Glycine 0 C--N 1.269 -3.192 0 N-CA-C 109.146 -1.581 . . . . 0.0 109.146 -179.23 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.916 ' CE1' ' HB3' ' A' ' 73' ' ' ALA . 4.2 m-85 -113.31 164.38 13.64 Favored 'General case' 0 C--N 1.293 -1.856 0 O-C-N 121.443 -1.034 . . . . 0.0 109.23 -178.434 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.487 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 0.0 OUTLIER -160.52 170.11 21.59 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.004 -1.06 . . . . 0.0 110.335 -179.372 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 97.2 173.36 34.19 Favored Glycine 0 N--CA 1.488 2.14 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 179.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.3 tmtt? -60.2 -57.8 11.24 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.343 -1.092 . . . . 0.0 109.234 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.505 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 1.0 OUTLIER -98.59 27.47 4.81 Favored 'General case' 0 C--N 1.287 -2.113 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 179.428 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 57' ' ' ASN . 4.6 m 71.71 7.83 6.0 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.99 -1.069 . . . . 0.0 109.422 -179.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.424 ' C ' ' O ' ' A' ' 81' ' ' CYS . 41.1 tt0 -36.34 -44.62 0.43 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.542 -0.724 . . . . 0.0 111.489 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.607 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.9 OUTLIER -80.47 86.82 5.73 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.269 -0.894 . . . . 0.0 110.424 -178.607 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.544 ' CB ' ' OD1' ' A' ' 57' ' ' ASN . 0.2 OUTLIER -74.66 92.2 2.42 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.416 -0.802 . . . . 0.0 109.164 179.345 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.437 ' OG1' ' O ' ' A' ' 75' ' ' GLY . 10.5 p -72.61 -14.4 61.6 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.22 -0.925 . . . . 0.0 109.694 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.466 ' HD3' ' CZ ' ' A' ' 76' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.78 0 CA-C-O 117.995 -1.002 . . . . 0.0 109.633 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.751 ' SG ' ' HB2' ' A' ' 27' ' ' ALA . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 124.013 1.863 . . . . 0.0 107.991 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.789 HD11 ' HB3' ' A' ' 48' ' ' ASP . 0.2 OUTLIER . . . . . 0 C--N 1.29 -1.987 0 O-C-N 120.857 -1.152 . . . . 0.0 109.319 178.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.44 0 CA-C-O 121.205 0.526 . . . . 0.0 109.766 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' CYS . . . . . 0.598 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 11.5 t -150.82 -47.67 0.12 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.334 -0.854 . . . . 0.0 110.341 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.558 ' O ' ' CB ' ' A' ' 24' ' ' LEU . 7.8 t 84.26 -2.46 1.03 Allowed 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 -178.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.558 ' CB ' ' O ' ' A' ' 23' ' ' SER . 0.4 OUTLIER . . . . . 0 N--CA 1.495 1.806 0 O-C-N 121.614 -0.679 . . . . 0.0 110.436 179.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.751 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . . . . . . . . 0 N--CA 1.493 1.703 0 CA-C-O 121.11 0.481 . . . . 0.0 109.814 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 . . . . . 0 N--CA 1.494 1.738 0 O-C-N 120.934 -1.104 . . . . 0.0 110.654 -179.27 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.464 ' O ' ' CG1' ' A' ' 30' ' ' VAL . 0.9 OUTLIER . . . . . 0 N--CA 1.495 1.824 0 CA-C-O 120.881 0.372 . . . . 0.0 110.125 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.59 ' CD1' ' O ' ' A' ' 27' ' ' ALA . 25.7 m-85 . . . . . 0 C--N 1.301 -1.535 0 O-C-N 120.893 -1.129 . . . . 0.0 111.055 -178.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.562 ' O ' HG23 ' A' ' 37' ' ' THR . 3.9 m-20 . . . . . 0 N--CA 1.482 1.157 0 CA-C-O 121.151 0.501 . . . . 0.0 110.325 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.521 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . . . . . . 0 N--CA 1.488 1.426 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 178.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.639 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 2.3 mm100 . . . . . 0 C--O 1.205 -1.278 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.671 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.2 OUTLIER -46.12 -59.0 3.14 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.259 -1.526 . . . . 0.0 107.797 178.952 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.0 t70 . . . . . 0 C--N 1.298 -1.665 0 O-C-N 121.17 -0.956 . . . . 0.0 109.91 178.733 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.639 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 6.4 t80 . . . . . 0 N--CA 1.485 1.325 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.671 ' CD1' ' O ' ' A' ' 37' ' ' THR . 6.8 m95 -80.35 -67.5 0.76 Allowed 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.452 -0.78 . . . . 0.0 112.304 -178.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -57.34 -50.08 74.08 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.516 -1.365 . . . . 0.0 110.356 -177.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LYS . . . . . 0.789 ' HD3' HG23 ' A' ' 65' ' ' ILE . 0.7 OUTLIER -81.87 2.14 31.75 Favored 'General case' 0 C--N 1.287 -2.136 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 179.624 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . 0.687 ' O ' ' N ' ' A' ' 46' ' ' ASP . 1.0 OUTLIER -46.43 -70.39 0.1 Allowed 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.379 -0.826 . . . . 0.0 109.182 -179.913 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.542 ' C ' ' O ' ' A' ' 44' ' ' TYR . 3.1 ptmt -9.75 69.05 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.647 0 CA-C-O 121.366 0.603 . . . . 0.0 111.797 -179.481 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.687 ' N ' ' O ' ' A' ' 44' ' ' TYR . 2.4 t0 -162.13 -30.44 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.4 -0.813 . . . . 0.0 110.077 -179.109 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.48 ' O ' ' OD2' ' A' ' 48' ' ' ASP . . . 98.61 13.97 39.23 Favored Glycine 0 N--CA 1.486 2.003 0 N-CA-C 107.83 -2.108 . . . . 0.0 107.83 -177.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.789 ' HB3' HD11 ' A' ' 18' ' ' LEU . 0.0 OUTLIER 74.6 11.35 3.94 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.784 -0.833 . . . . 0.0 109.358 -179.628 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.66 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 34.5 mm-40 73.85 -10.79 1.04 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.807 -0.558 . . . . 0.0 111.125 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 15.0 t -114.83 -11.45 12.24 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.665 -1.272 . . . . 0.0 110.088 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.471 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 53.5 tt0 -74.12 152.73 39.81 Favored 'General case' 0 N--CA 1.483 1.223 0 O-C-N 120.888 -1.132 . . . . 0.0 109.135 179.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.463 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . 94.27 -14.07 66.05 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . 0.463 ' HB3' ' O ' ' A' ' 52' ' ' GLY . 1.2 t60 68.42 69.6 0.44 Allowed Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.336 -1.096 . . . . 0.0 109.343 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' PRO . . . . . 0.45 ' HG2' ' SG ' ' A' ' 61' ' ' CYS . 5.7 Cg_exo -59.67 -39.83 70.35 Favored 'Trans proline' 0 C--N 1.31 -1.479 0 C-N-CA 122.45 2.1 . . . . 0.0 110.61 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.494 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 0.6 OUTLIER -84.77 177.89 7.85 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.338 -0.851 . . . . 0.0 109.302 -179.863 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.518 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.5 mt -140.08 -175.37 4.22 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 179.199 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ASN . . . . . 0.586 ' HB3' ' CD2' ' A' ' 76' ' ' PHE . 4.9 m-80 48.49 56.43 7.53 Favored 'General case' 0 C--N 1.296 -1.729 0 CA-C-O 121.718 0.771 . . . . 0.0 110.943 178.013 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 47.06 30.15 1.25 Allowed 'General case' 0 C--N 1.301 -1.507 0 CA-C-O 121.439 0.638 . . . . 0.0 109.873 177.455 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -79.08 150.92 34.49 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.198 -1.561 . . . . 0.0 109.198 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.518 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 3.1 t60 -79.64 156.47 27.6 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.98 -1.306 . . . . 0.0 108.772 179.585 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' CYS . . . . . 0.494 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 0.6 OUTLIER -124.56 116.98 23.32 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.18 -0.95 . . . . 0.0 109.948 -179.082 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.503 ' HB3' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER . . . . . 0 C--N 1.301 -1.523 0 N-CA-C 106.91 -1.515 . . . . 0.0 106.91 177.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLY . . . . . 0.574 ' O ' ' O ' ' A' ' 67' ' ' ASP . . . . . . . . 0 N--CA 1.493 2.479 0 N-CA-C 108.079 -2.008 . . . . 0.0 108.079 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ILE . . . . . 0.789 HG23 ' HD3' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -51.76 -61.94 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 119.881 -1.952 . . . . 0.0 109.316 -179.136 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.69 ' N ' HG22 ' A' ' 65' ' ' ILE . . . -43.19 -50.1 6.47 Favored Glycine 0 N--CA 1.493 2.482 0 N-CA-C 109.964 -1.254 . . . . 0.0 109.964 -179.34 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ASP . . . . . 0.574 ' O ' ' O ' ' A' ' 64' ' ' GLY . 6.4 p-10 -164.89 -147.8 0.1 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.41 -1.053 . . . . 0.0 109.278 179.71 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.66 ' CD1' ' HB3' ' A' ' 49' ' ' GLN . 2.5 p90 -159.8 -165.15 1.45 Allowed 'General case' 0 C--N 1.296 -1.751 0 O-C-N 120.501 -1.374 . . . . 0.0 109.352 -179.45 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.503 ' OG1' ' HB3' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -149.43 -177.48 5.88 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 107.324 -1.362 . . . . 0.0 107.324 178.989 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.7 m -139.61 -173.29 3.58 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 120.601 -1.312 . . . . 0.0 108.563 179.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.518 ' HB ' ' HB3' ' A' ' 60' ' ' HIS . 1.5 m -161.08 139.92 10.08 Favored 'General case' 0 C--N 1.292 -1.931 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 179.334 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 95.0 m -104.15 141.99 35.28 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.952 -1.093 . . . . 0.0 109.365 179.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.557 ' HB3' ' CD1' ' A' ' 76' ' ' PHE . . . -77.16 177.66 7.67 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.222 -0.924 . . . . 0.0 109.8 -179.756 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -80.56 102.34 9.71 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-O 123.399 1.571 . . . . 0.0 107.839 178.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . 0.632 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 127.27 25.58 1.17 Allowed Glycine 0 C--N 1.267 -3.302 0 CA-C-N 113.299 -1.773 . . . . 0.0 109.896 -179.556 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.632 ' CD1' ' C ' ' A' ' 75' ' ' GLY . 58.2 m-85 -141.37 159.88 41.28 Favored 'General case' 0 C--N 1.287 -2.115 0 O-C-N 121.174 -1.192 . . . . 0.0 110.05 -177.815 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . 0.503 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 2.5 mt-10 -150.36 175.21 12.04 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.172 -0.955 . . . . 0.0 110.239 -178.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 95.47 168.02 35.48 Favored Glycine 0 N--CA 1.491 2.327 0 N-CA-C 110.191 -1.164 . . . . 0.0 110.191 179.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.469 ' C ' ' HD3' ' A' ' 79' ' ' LYS . 4.6 tmtt? -55.86 -57.77 10.65 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.466 -1.02 . . . . 0.0 109.158 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ASN . . . . . 0.518 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 1.1 m-20 -94.43 25.86 3.69 Favored 'General case' 0 C--N 1.287 -2.113 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 179.418 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . 0.579 ' HB2' ' HB2' ' A' ' 57' ' ' ASN . 4.1 m 66.36 14.85 9.89 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 120.818 -1.176 . . . . 0.0 108.41 -179.211 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -46.53 -42.44 15.77 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.769 -0.582 . . . . 0.0 112.122 -179.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.607 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.8 OUTLIER -79.32 85.09 5.18 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.169 -0.957 . . . . 0.0 111.135 -178.035 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' SER . . . . . 0.546 ' CB ' ' OD1' ' A' ' 57' ' ' ASN . 0.4 OUTLIER -68.64 109.27 3.7 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 178.232 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.46 ' O ' ' C ' ' A' ' 86' ' ' ARG . 33.3 p -92.02 -32.91 15.03 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.997 -1.064 . . . . 0.0 109.807 -179.334 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ARG . . . . . 0.46 ' C ' ' O ' ' A' ' 85' ' ' THR . 0.1 OUTLIER . . . . . 0 C--N 1.289 -2.05 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.202 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.427 ' O ' ' OG ' ' A' ' 3' ' ' SER . 40.6 m-20 -108.8 115.07 29.38 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.223 -0.923 . . . . 0.0 109.384 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.427 ' OG ' ' O ' ' A' ' 2' ' ' ASN . 2.2 m -167.06 -135.35 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.258 -0.901 . . . . 0.0 109.458 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.681 ' CE2' HD12 ' A' ' 5' ' ' LEU . 50.3 p90 -55.52 -16.92 4.39 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 120.927 -1.108 . . . . 0.0 109.49 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.681 HD12 ' CE2' ' A' ' 4' ' ' PHE . 0.0 OUTLIER -76.56 -42.09 44.1 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.187 -0.946 . . . . 0.0 109.791 -179.912 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' CGU . . . . . 0.528 ' C ' ' O ' ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' CGU . . . . . 0.664 ' H ' ' C ' ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.835 HG11 OE11 ' A' ' 26' ' ' CGU . 20.6 m -39.93 96.06 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.307 -1.255 0 CA-C-O 122.166 0.984 . . . . 0.0 109.895 -178.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.513 ' N ' ' O ' ' A' ' 7' ' ' CGU . 1.0 OUTLIER -44.73 -28.37 0.61 Allowed 'General case' 0 C--N 1.284 -2.257 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 179.123 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.5 ' HB2' ' O ' ' A' ' 9' ' ' LYS . 0.3 OUTLIER 168.03 130.98 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 179.441 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -108.39 122.4 6.65 Favored Glycine 0 N--CA 1.491 2.348 0 C-N-CA 119.84 -1.171 . . . . 0.0 110.186 -179.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.579 ' HB3' ' CB ' ' A' ' 16' ' ' CGU . 15.7 t30 -109.93 -172.63 2.08 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.225 -1.162 . . . . 0.0 108.847 179.469 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.684 ' N ' HD23 ' A' ' 13' ' ' LEU . 0.9 OUTLIER -77.18 -125.69 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.211 0 O-C-N 120.836 -1.165 . . . . 0.0 109.4 -179.881 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' CGU . . . . . 0.731 ' O ' HD12 ' A' ' 18' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 65.7 mtm180 -76.73 -45.62 28.57 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.108 -0.995 . . . . 0.0 110.229 -179.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' CGU . . . . . 0.589 ' CD1' ' C ' ' A' ' 16' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.864 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 84.9 m -84.56 42.51 0.91 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.103 -0.998 . . . . 0.0 109.758 -179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.801 HD11 ' CG ' ' A' ' 48' ' ' ASP . 0.2 OUTLIER -81.75 -19.07 42.13 Favored 'General case' 0 C--N 1.299 -1.622 0 CA-C-O 121.795 0.807 . . . . 0.0 110.018 -179.677 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.864 ' HB3' ' HA ' ' A' ' 17' ' ' CYS . . . -48.82 -54.11 16.51 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 179.207 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.49 ' HB3' ' HB2' ' A' ' 26' ' ' CGU . 0.5 OUTLIER -151.98 -170.35 3.62 Favored 'General case' 0 C--N 1.289 -2.024 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 178.936 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 35.5 p -175.96 -35.27 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.575 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 179.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.771 ' O ' HD13 ' A' ' 24' ' ' LEU . 0.4 OUTLIER -165.21 -36.99 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 179.591 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' CGU . . . . . 0.514 ' O ' ' HG2' ' A' ' 28' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' CGU . . . . . 0.835 OE11 HG11 ' A' ' 8' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -82.31 55.18 2.79 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.977 -1.077 . . . . 0.0 110.602 -179.3 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.581 ' O ' ' HG3' ' A' ' 28' ' ' ARG . 24.6 ptt180 -153.21 121.44 6.21 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 106.634 -1.617 . . . . 0.0 106.634 177.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' CGU . . . . . 0.533 ' CB ' ' O ' ' A' ' 28' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 2.4 t -78.96 -22.28 12.76 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 179.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.7 ' CD1' ' N ' ' A' ' 31' ' ' PHE . 0.0 OUTLIER -123.92 154.94 39.02 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 108.596 -0.89 . . . . 0.0 108.596 -179.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' CGU . . . . . 0.541 ' O ' ' N ' ' A' ' 34' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.667 ' O ' HG23 ' A' ' 37' ' ' THR . 50.7 p-10 -37.71 88.45 0.0 OUTLIER 'General case' 0 C--N 1.299 -1.613 0 CA-C-O 121.211 0.529 . . . . 0.0 111.559 -178.553 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.541 ' N ' ' O ' ' A' ' 32' ' ' CGU . . . -81.05 -54.92 5.13 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.272 -0.892 . . . . 0.0 109.056 178.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' CGU . . . . . 0.454 ' C ' ' N ' ' A' ' 37' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.744 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 2.0 mt-30 -51.19 -28.12 10.53 Favored 'General case' 0 C--O 1.2 -1.522 0 N-CA-C 105.907 -1.886 . . . . 0.0 105.907 177.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.753 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 40.7 p -41.37 -59.46 1.55 Allowed 'General case' 0 N--CA 1.497 1.905 0 O-C-N 120.045 -1.659 . . . . 0.0 106.763 177.037 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.582 ' O ' ' C ' ' A' ' 39' ' ' CGU . 0.4 OUTLIER -82.22 -65.06 1.06 Allowed 'General case' 0 C--N 1.287 -2.109 0 O-C-N 121.166 -0.959 . . . . 0.0 109.745 177.152 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' CGU . . . . . 0.582 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.744 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 12.5 t80 -41.51 -57.55 2.19 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 177.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.753 ' CD1' ' O ' ' A' ' 37' ' ' THR . 7.6 m95 -80.63 -171.0 2.88 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 177.239 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.599 ' O ' ' CB ' ' A' ' 43' ' ' LYS . 54.8 p 42.13 87.74 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.874 0 O-C-N 120.577 -1.327 . . . . 0.0 109.904 179.098 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.933 ' HD2' HD13 ' A' ' 65' ' ' ILE . 4.9 ptpt 115.19 5.55 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 -179.27 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.66 ' CE1' ' CD2' ' A' ' 14' ' ' CGU . 0.7 OUTLIER -80.7 -95.34 0.04 OUTLIER 'General case' 0 C--O 1.206 -1.212 0 N-CA-C 108.005 -1.109 . . . . 0.0 108.005 179.489 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.599 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.0 OUTLIER 12.61 55.3 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.597 0 CA-C-O 121.326 0.584 . . . . 0.0 111.17 179.346 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.599 ' N ' ' O ' ' A' ' 44' ' ' TYR . 11.6 t0 -143.98 16.76 1.76 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.325 -0.859 . . . . 0.0 108.979 -178.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.646 ' O ' HD21 ' A' ' 18' ' ' LEU . . . 75.29 2.86 68.53 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 107.86 -2.096 . . . . 0.0 107.86 -177.477 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.801 ' CG ' HD11 ' A' ' 18' ' ' LEU . 0.0 OUTLIER 88.55 7.16 0.16 Allowed 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -179.358 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.719 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 1.6 mt-30 72.47 -23.44 0.2 Allowed 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 120.403 -0.519 . . . . 0.0 112.275 178.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.52 ' HB2' ' OB ' ' A' ' 63' ' ' BHD . 17.1 t -93.55 -21.24 19.56 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 120.632 -1.292 . . . . 0.0 107.727 178.311 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -55.99 139.65 45.86 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 179.105 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 101.65 -13.04 58.1 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.46 -1.456 . . . . 0.0 109.46 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.427 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 31.7 t60 65.85 63.33 0.99 Allowed Pre-proline 0 N--CA 1.489 1.486 0 O-C-N 121.333 -1.098 . . . . 0.0 109.968 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.486 ' HD3' ' O ' ' A' ' 50' ' ' CYS . 3.5 Cg_exo -60.77 -39.35 63.6 Favored 'Trans proline' 0 C--N 1.31 -1.449 0 C-N-CA 122.25 1.966 . . . . 0.0 110.167 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.469 ' SG ' ' O ' ' A' ' 60' ' ' HIS . 1.9 m -78.42 162.24 26.55 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.56 -0.712 . . . . 0.0 109.372 -179.466 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.528 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 6.0 mt -145.57 -173.85 4.24 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.994 -1.066 . . . . 0.0 110.658 -179.299 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.603 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 0.9 OUTLIER 43.83 64.51 1.25 Allowed 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 121.831 0.824 . . . . 0.0 108.99 -179.486 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.447 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 5.2 mm-40 51.14 31.02 6.13 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 120.157 -0.617 . . . . 0.0 110.226 177.715 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.433 ' HA2' ' O ' ' A' ' 71' ' ' THR . . . -83.05 141.61 20.9 Favored Glycine 0 N--CA 1.488 2.135 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.475 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 97.8 m-70 -79.23 -164.04 0.57 Allowed 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.219 -1.165 . . . . 0.0 108.059 179.16 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.457 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 12.5 t -160.77 120.03 2.64 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.553 -1.342 . . . . 0.0 110.922 -179.393 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -107.29 102.49 11.79 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 178.132 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' BHD . . . . . 0.52 ' OB ' ' HB2' ' A' ' 50' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.608 ' O ' HD12 ' A' ' 65' ' ' ILE . . . 132.04 43.84 0.16 Allowed Glycine 0 N--CA 1.495 2.599 0 C-N-CA 120.404 -0.903 . . . . 0.0 111.459 179.314 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.933 HD13 ' HD2' ' A' ' 43' ' ' LYS . 2.4 pp 34.59 -165.22 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.511 2.585 0 CA-C-N 118.299 1.049 . . . . 0.0 109.964 -179.184 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.498 ' O ' ' CG ' ' A' ' 67' ' ' ASP . . . 47.51 30.67 6.38 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 106.326 -2.71 . . . . 0.0 106.326 -178.248 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.602 ' OD1' ' N ' ' A' ' 68' ' ' TYR . 0.4 OUTLIER 85.58 -171.75 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.507 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 -176.287 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.719 ' CD1' ' HB3' ' A' ' 49' ' ' GLN . 1.0 OUTLIER -137.67 -162.14 1.26 Allowed 'General case' 0 C--N 1.285 -2.229 0 O-C-N 120.345 -1.472 . . . . 0.0 108.376 -178.218 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -148.76 165.22 32.07 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 178.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 0.416 ' HA ' ' HA ' ' A' ' 61' ' ' CYS . 22.6 m -132.05 -165.57 1.61 Allowed 'General case' 0 C--N 1.293 -1.856 0 O-C-N 120.637 -1.29 . . . . 0.0 108.019 179.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.475 ' HB ' ' HB2' ' A' ' 60' ' ' HIS . 0.7 OUTLIER -160.15 118.41 2.65 Favored 'General case' 0 C--N 1.297 -1.705 0 O-C-N 121.1 -1.0 . . . . 0.0 109.618 179.516 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.556 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 59.3 m -96.76 139.56 32.64 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.137 -0.977 . . . . 0.0 109.33 -179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.996 ' HB3' ' CE1' ' A' ' 76' ' ' PHE . . . -71.64 -176.05 1.5 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.114 -0.991 . . . . 0.0 110.467 -179.6 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -81.42 102.02 10.23 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-O 123.149 1.452 . . . . 0.0 108.152 178.334 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . 0.485 ' HA3' ' HD3' ' A' ' 86' ' ' ARG . . . 121.21 21.7 3.04 Favored Glycine 0 C--N 1.268 -3.236 0 CA-C-N 113.663 -1.608 . . . . 0.0 109.195 -179.122 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.996 ' CE1' ' HB3' ' A' ' 73' ' ' ALA . 4.7 m-85 -116.43 166.22 12.33 Favored 'General case' 0 C--N 1.295 -1.801 0 O-C-N 121.581 -0.952 . . . . 0.0 109.423 -178.225 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.476 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 3.6 mt-10 -159.95 170.76 20.69 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 120.775 -1.203 . . . . 0.0 110.458 -179.331 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.83 166.0 39.6 Favored Glycine 0 N--CA 1.489 2.2 0 N-CA-C 109.678 -1.369 . . . . 0.0 109.678 179.608 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.467 ' C ' ' HD3' ' A' ' 79' ' ' LYS . 2.3 tmtt? -55.77 -56.19 23.39 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.255 -1.144 . . . . 0.0 109.139 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.528 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.9 OUTLIER -94.06 30.19 1.95 Allowed 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 179.856 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.486 ' O ' ' HB2' ' A' ' 57' ' ' ASN . 3.1 m 61.2 14.43 5.54 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.867 -1.146 . . . . 0.0 108.622 -179.527 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -44.5 -46.54 9.8 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.601 -0.687 . . . . 0.0 111.456 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.601 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.5 OUTLIER -81.16 84.45 6.55 Favored 'General case' 0 C--N 1.297 -1.687 0 O-C-N 121.401 -0.812 . . . . 0.0 110.751 -178.406 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.518 ' N ' ' OD1' ' A' ' 57' ' ' ASN . 0.1 OUTLIER -66.73 94.42 0.3 Allowed 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 178.473 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.459 ' OG1' ' HG3' ' A' ' 86' ' ' ARG . 20.0 p -49.05 -29.62 5.28 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.185 -0.947 . . . . 0.0 110.239 -178.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.485 ' HD3' ' HA3' ' A' ' 75' ' ' GLY . 9.4 mtp180 . . . . . 0 C--N 1.289 -2.055 0 CA-C-O 117.995 -1.003 . . . . 0.0 109.642 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.545 -0.539 . . . . 0.0 109.545 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -102.38 -29.46 11.63 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.277 -0.889 . . . . 0.0 109.419 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -47.74 133.27 13.97 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.229 -0.92 . . . . 0.0 109.538 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.485 ' C ' ' CD1' ' A' ' 4' ' ' PHE . 0.1 OUTLIER -80.3 9.34 5.88 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.156 -0.965 . . . . 0.0 110.212 -179.752 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.567 ' O ' HG13 ' A' ' 8' ' ' VAL . 0.4 OUTLIER -61.16 -40.36 93.59 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 120.946 -1.096 . . . . 0.0 109.568 -179.761 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' CGU . . . . . 0.507 ' C ' ' O ' ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' CGU . . . . . 0.461 ' O ' ' C ' ' A' ' 8' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.793 HG23 ' O ' ' A' ' 8' ' ' VAL . 11.7 m -39.59 99.12 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.309 -1.177 0 CA-C-O 122.516 1.15 . . . . 0.0 109.634 -178.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.59 ' O ' ' CB ' ' A' ' 10' ' ' GLN . 2.3 tttp -50.3 -18.85 0.68 Allowed 'General case' 0 C--N 1.286 -2.166 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.57 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.59 ' CB ' ' O ' ' A' ' 9' ' ' LYS . 30.6 tt0 89.76 58.26 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.863 0 CA-C-O 121.247 0.546 . . . . 0.0 109.569 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -142.02 17.74 2.55 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.589 -1.405 . . . . 0.0 109.589 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.567 ' O ' ' CE1' ' A' ' 31' ' ' PHE . 5.0 m-80 -88.87 51.99 2.3 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.247 -1.149 . . . . 0.0 109.622 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.53 ' C ' ' CE2' ' A' ' 31' ' ' PHE . 0.1 OUTLIER -125.1 8.27 7.96 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-O 121.769 0.795 . . . . 0.0 109.373 179.915 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.603 ' C ' ' H ' ' A' ' 17' ' ' CYS . 50.1 mtm180 -82.31 99.12 9.15 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 106.34 -1.726 . . . . 0.0 106.34 177.121 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' CGU . . . . . 0.613 ' O ' ' CB ' ' A' ' 17' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.692 ' O ' ' HB2' ' A' ' 18' ' ' LEU . 9.9 p 115.9 -45.41 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.112 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 -178.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.692 ' HB2' ' O ' ' A' ' 17' ' ' CYS . 1.9 mm? 113.67 -103.43 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.182 0 C-N-CA 124.059 0.943 . . . . 0.0 109.891 178.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' CGU . . . . . 0.642 ' CD1' ' N ' ' A' ' 19' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' CGU . . . . . 0.535 ' C ' ' N ' ' A' ' 22' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.457 ' C ' ' O ' ' A' ' 20' ' ' CGU . . . -35.22 -32.18 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.768 0 CA-C-O 121.912 0.863 . . . . 0.0 109.745 179.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.535 ' N ' ' C ' ' A' ' 20' ' ' CGU . 30.1 p -119.66 167.87 11.6 Favored 'General case' 0 C--N 1.292 -1.932 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 179.437 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.513 ' O ' ' CB ' ' A' ' 24' ' ' LEU . 42.3 t -87.76 1.33 54.14 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.214 -0.929 . . . . 0.0 109.082 179.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.513 ' CB ' ' O ' ' A' ' 23' ' ' SER . 0.2 OUTLIER 77.74 -5.27 2.14 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.429 -0.794 . . . . 0.0 109.832 -179.858 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' CGU . . . . . 0.542 ' O ' ' HB ' ' A' ' 30' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.568 ' HB3' OE12 ' A' ' 16' ' ' CGU . . . -58.28 -8.94 1.28 Allowed 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.789 -1.194 . . . . 0.0 110.637 -179.287 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.507 ' HG2' ' NH1' ' A' ' 28' ' ' ARG . 0.0 OUTLIER -79.94 -78.21 0.17 Allowed 'General case' 0 N--CA 1.487 1.423 0 O-C-N 120.766 -1.209 . . . . 0.0 111.571 -179.276 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.542 ' HB ' ' O ' ' A' ' 26' ' ' CGU . 2.0 p -83.98 -29.15 7.33 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 120.358 -1.464 . . . . 0.0 109.736 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.567 ' CE1' ' O ' ' A' ' 12' ' ' ASN . 42.4 m-85 -78.87 92.81 4.92 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.351 -0.843 . . . . 0.0 109.944 -179.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.602 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 1.5 m-20 -41.45 117.68 0.94 Allowed 'General case' 0 C--N 1.304 -1.41 0 CA-C-O 121.274 0.559 . . . . 0.0 110.752 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.515 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -78.38 -30.64 48.02 Favored 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 107.494 -1.298 . . . . 0.0 107.494 178.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' CGU . . . . . 0.4 ' O ' ' C ' ' A' ' 36' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.635 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 13.2 mm100 -50.36 -35.65 28.9 Favored 'General case' 0 C--O 1.206 -1.218 0 C-N-CA 118.261 -1.376 . . . . 0.0 108.023 178.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.72 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -40.97 -58.43 1.72 Allowed 'General case' 0 N--CA 1.499 1.991 0 C-N-CA 117.743 -1.583 . . . . 0.0 107.33 178.569 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.596 ' O ' ' C ' ' A' ' 39' ' ' CGU . 0.6 OUTLIER -81.58 -67.32 0.79 Allowed 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.115 -0.99 . . . . 0.0 109.493 177.291 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' CGU . . . . . 0.596 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.663 ' O ' ' HB2' ' A' ' 44' ' ' TYR . 9.6 t80 -42.81 -54.7 4.0 Favored 'General case' 0 C--N 1.3 -1.562 0 N-CA-C 107.777 -1.194 . . . . 0.0 107.777 178.37 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.72 ' CD1' ' O ' ' A' ' 37' ' ' THR . 7.1 m95 -79.46 -179.79 7.01 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 120.83 -1.169 . . . . 0.0 108.593 177.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.665 ' O ' ' CB ' ' A' ' 43' ' ' LYS . 1.5 t 36.84 92.86 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.659 -0.651 . . . . 0.0 110.2 179.259 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.665 ' CB ' ' O ' ' A' ' 42' ' ' SER . 0.0 OUTLIER 123.14 -33.33 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 106.235 -1.765 . . . . 0.0 106.235 -178.789 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.663 ' HB2' ' O ' ' A' ' 40' ' ' PHE . 0.1 OUTLIER -55.05 -73.66 0.05 Allowed 'General case' 0 C--N 1.299 -1.614 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.58 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.593 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.0 OUTLIER -0.69 68.96 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.662 0 CA-C-O 121.457 0.646 . . . . 0.0 111.137 179.435 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.602 ' N ' ' O ' ' A' ' 44' ' ' TYR . 8.2 t70 -160.45 28.0 0.16 Allowed 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.381 -0.825 . . . . 0.0 109.204 -178.476 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.547 ' O ' HD11 ' A' ' 18' ' ' LEU . . . 67.31 12.1 60.33 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 108.272 -1.931 . . . . 0.0 108.272 -178.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.577 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 33.7 t70 71.72 21.4 4.32 Favored 'General case' 0 N--CA 1.502 2.163 0 O-C-N 121.817 -0.813 . . . . 0.0 109.611 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.61 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 52.9 mm-40 70.53 -10.63 0.68 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.843 -0.536 . . . . 0.0 112.142 178.473 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.493 ' HB2' ' OB ' ' A' ' 63' ' ' BHD . 52.9 t -114.6 -10.11 12.55 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.446 -1.409 . . . . 0.0 109.986 179.555 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.533 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 12.1 tm-20 -62.1 152.26 33.3 Favored 'General case' 0 N--CA 1.482 1.169 0 O-C-N 120.819 -1.176 . . . . 0.0 108.851 179.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.445 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . 93.52 -12.77 68.95 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 110.173 -1.171 . . . . 0.0 110.173 179.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.452 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 6.1 t60 68.84 66.08 0.52 Allowed Pre-proline 0 N--CA 1.492 1.651 0 O-C-N 120.982 -1.305 . . . . 0.0 109.234 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.461 ' HD3' ' O ' ' A' ' 50' ' ' CYS . 5.4 Cg_exo -60.86 -40.09 56.49 Favored 'Trans proline' 0 C--N 1.31 -1.494 0 C-N-CA 122.651 2.234 . . . . 0.0 111.302 -179.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.486 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 1.0 OUTLIER -83.61 174.05 10.87 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.118 -0.989 . . . . 0.0 109.947 -179.044 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.598 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.2 mt -147.07 -171.77 3.85 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.487 -0.758 . . . . 0.0 108.967 179.574 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.737 ' HB3' ' CD2' ' A' ' 76' ' ' PHE . 0.9 OUTLIER 48.71 57.14 6.66 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.419 -0.801 . . . . 0.0 110.055 179.727 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.45 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 0.7 OUTLIER 44.69 33.84 1.03 Allowed 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 178.17 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -83.3 153.7 30.76 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 110.23 -1.148 . . . . 0.0 110.23 -179.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.465 ' O ' ' SG ' ' A' ' 55' ' ' CYS . 0.1 OUTLIER -79.53 164.96 23.47 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.4 -1.059 . . . . 0.0 108.319 179.035 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.486 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 20.4 t -134.31 111.69 10.41 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.018 -1.051 . . . . 0.0 110.519 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.507 ' HB3' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER -80.38 176.79 9.46 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 177.46 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' BHD . . . . . 0.513 ' HA ' ' CB ' ' A' ' 68' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.427 ' O ' ' CG ' ' A' ' 49' ' ' GLN . . . 153.39 -175.36 31.83 Favored Glycine 0 N--CA 1.489 2.172 0 N-CA-C 107.618 -2.193 . . . . 0.0 107.618 -179.11 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.63 HD12 ' HA ' ' A' ' 44' ' ' TYR . 10.2 mm -94.37 -67.42 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 120.619 -1.518 . . . . 0.0 110.014 179.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.5 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . -43.47 -26.94 0.72 Allowed Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.189 -1.565 . . . . 0.0 109.189 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.5 ' HB3' ' O ' ' A' ' 66' ' ' GLY . 6.6 p-10 175.54 -149.47 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.635 -0.921 . . . . 0.0 109.592 179.275 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.626 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 2.8 p90 -160.43 -165.1 1.36 Allowed 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 -179.399 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.507 ' OG1' ' HB3' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -147.82 179.26 7.85 Favored 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 178.535 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 3.8 m -141.23 -170.83 3.15 Favored 'General case' 0 C--N 1.297 -1.702 0 O-C-N 120.898 -1.126 . . . . 0.0 108.253 179.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.429 ' HB ' ' HB2' ' A' ' 60' ' ' HIS . 4.0 m -160.78 140.92 11.18 Favored 'General case' 0 C--N 1.292 -1.901 0 O-C-N 121.461 -0.775 . . . . 0.0 109.315 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 55.9 m -105.77 139.17 40.75 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.147 -0.971 . . . . 0.0 109.37 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.37 175.64 5.27 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.076 -1.015 . . . . 0.0 109.66 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -80.66 102.13 9.67 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-O 123.065 1.412 . . . . 0.0 107.668 178.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . 0.592 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 130.46 8.15 3.29 Favored Glycine 0 C--N 1.269 -3.17 0 CA-C-N 113.902 -1.499 . . . . 0.0 110.186 -179.352 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.737 ' CD2' ' HB3' ' A' ' 57' ' ' ASN . 13.8 m-85 -130.64 169.19 15.95 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 120.779 -1.424 . . . . 0.0 110.155 -178.547 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.473 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 2.3 mt-10 -160.56 174.52 13.92 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.104 -0.998 . . . . 0.0 110.046 -178.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 112.24 169.37 18.06 Favored Glycine 0 N--CA 1.493 2.47 0 N-CA-C 110.12 -1.192 . . . . 0.0 110.12 179.167 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.46 ' HD3' ' O ' ' A' ' 79' ' ' LYS . 3.1 tmtt? -56.98 -55.71 31.18 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.268 -1.137 . . . . 0.0 108.428 179.447 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.598 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.7 OUTLIER -99.75 26.97 5.73 Favored 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 178.183 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.521 ' HB2' ' HB2' ' A' ' 57' ' ' ASN . 1.8 m 55.84 71.7 0.54 Allowed 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 105.389 -2.078 . . . . 0.0 105.389 -177.088 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.436 ' O ' ' HG3' ' A' ' 82' ' ' GLU . 0.5 OUTLIER -108.24 -30.9 8.12 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.373 -0.829 . . . . 0.0 110.266 -176.894 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.66 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -87.12 81.52 7.99 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.043 -1.035 . . . . 0.0 109.996 -179.792 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -55.22 108.88 0.46 Allowed 'General case' 0 C--N 1.299 -1.629 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 179.124 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.421 ' O ' ' OXT' ' A' ' 86' ' ' ARG . 5.0 p -85.89 -11.78 52.34 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.083 -1.011 . . . . 0.0 109.974 -179.29 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.554 ' NH1' ' HG3' ' A' ' 86' ' ' ARG . 0.3 OUTLIER . . . . . 0 C--N 1.297 -1.699 0 CA-C-O 118.104 -0.951 . . . . 0.0 109.467 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.561 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -159.75 134.34 7.76 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.26 -0.9 . . . . 0.0 109.297 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 6.2 t -155.18 143.15 20.03 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.199 -0.938 . . . . 0.0 109.584 -179.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.583 ' CZ ' ' O ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -71.71 -20.41 61.91 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.389 -0.82 . . . . 0.0 109.24 179.895 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.793 ' O ' HG13 ' A' ' 8' ' ' VAL . 0.2 OUTLIER -80.21 0.58 31.89 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.11 -0.993 . . . . 0.0 109.735 -179.807 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' CGU . . . . . 0.528 ' O ' ' CG ' ' A' ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.797 HG23 ' O ' ' A' ' 8' ' ' VAL . 13.3 m -40.06 96.8 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.307 -1.27 0 CA-C-O 122.469 1.128 . . . . 0.0 110.047 -179.216 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.562 ' O ' ' CB ' ' A' ' 10' ' ' GLN . 1.3 ptpm? -48.84 -34.5 12.61 Favored 'General case' 0 C--N 1.283 -2.313 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.562 ' CB ' ' O ' ' A' ' 9' ' ' LYS . 5.8 tt0 151.75 -27.41 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 179.409 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.79 ' HA3' HG21 ' A' ' 30' ' ' VAL . . . 79.19 147.62 4.04 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.234 -1.546 . . . . 0.0 109.234 -179.727 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.549 ' HB2' ' HB2' ' A' ' 16' ' ' CGU . 42.2 t30 -103.97 -168.77 1.54 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.088 -1.242 . . . . 0.0 109.723 -179.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.624 ' O ' ' CB ' ' A' ' 14' ' ' CGU . 0.1 OUTLIER -77.44 -10.82 59.69 Favored 'General case' 0 C--O 1.2 -1.551 0 O-C-N 120.847 -1.158 . . . . 0.0 110.4 -178.877 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' CGU . . . . . 0.624 ' CB ' ' O ' ' A' ' 13' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.503 ' NH1' ' CB ' ' A' ' 50' ' ' CYS . 0.0 OUTLIER -73.26 -33.13 65.1 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.975 -1.078 . . . . 0.0 111.237 -178.189 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' CGU . . . . . 0.549 ' HB2' ' HB2' ' A' ' 12' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 1.027 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 42.1 m -104.1 10.31 35.99 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.795 -1.191 . . . . 0.0 110.435 -179.627 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.5 HD22 ' HA ' ' A' ' 18' ' ' LEU . 0.2 OUTLIER -61.8 -14.97 37.79 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 120.802 -1.186 . . . . 0.0 108.569 179.018 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 1.027 ' HB3' ' HA ' ' A' ' 17' ' ' CYS . . . -52.36 -50.02 63.2 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.072 -1.017 . . . . 0.0 109.928 -179.582 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.53 ' HB3' ' CB ' ' A' ' 26' ' ' CGU . 2.4 m -143.33 -44.35 0.29 Allowed 'General case' 0 C--N 1.289 -2.031 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 179.268 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.511 ' O ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER 61.28 -85.3 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.57 -0.706 . . . . 0.0 110.515 179.328 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.716 HD13 ' CZ2' ' A' ' 41' ' ' TRP . 0.9 OUTLIER -124.94 -27.61 3.57 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.964 -1.085 . . . . 0.0 110.139 -179.059 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' CGU . . . . . 0.634 OE21 HD13 ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' CGU . . . . . 0.53 ' CB ' ' HB3' ' A' ' 22' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -80.06 8.47 7.06 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 120.482 -1.386 . . . . 0.0 110.175 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 28.7 mtt180 -111.13 -56.38 2.38 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.114 -0.992 . . . . 0.0 110.523 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.79 HG21 ' HA3' ' A' ' 11' ' ' GLY . 1.0 OUTLIER -84.13 -6.94 10.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 120.76 -1.213 . . . . 0.0 108.894 179.78 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.622 ' CE2' ' O ' ' A' ' 13' ' ' LEU . 69.1 m-85 -110.49 113.45 26.1 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.131 -0.981 . . . . 0.0 111.413 -179.326 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.559 ' CB ' ' HG2' ' A' ' 36' ' ' GLN . 0.5 OUTLIER -60.31 114.59 2.99 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 121.822 -0.549 . . . . 0.0 110.974 -179.109 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.469 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -78.26 -27.75 47.56 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 106.368 -1.716 . . . . 0.0 106.368 177.252 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.628 ' O ' ' HB2' ' A' ' 40' ' ' PHE . 0.0 OUTLIER -54.72 -34.29 62.25 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 117.911 -1.515 . . . . 0.0 107.543 179.413 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.693 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -42.22 -59.6 1.74 Allowed 'General case' 0 N--CA 1.496 1.839 0 C-N-CA 117.63 -1.628 . . . . 0.0 106.694 178.46 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.625 ' O ' ' C ' ' A' ' 39' ' ' CGU . 0.7 OUTLIER -82.12 -70.78 0.52 Allowed 'General case' 0 C--N 1.297 -1.689 0 O-C-N 121.131 -0.981 . . . . 0.0 109.023 176.305 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' CGU . . . . . 0.625 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.628 ' HB2' ' O ' ' A' ' 36' ' ' GLN . 9.2 t80 -41.75 -60.04 1.48 Allowed 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 106.872 -1.529 . . . . 0.0 106.872 178.013 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.716 ' CZ2' HD13 ' A' ' 24' ' ' LEU . 8.7 m95 -81.34 -177.56 6.54 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 176.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.475 ' OG ' ' N ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER 73.05 -71.62 0.13 Allowed 'General case' 0 N--CA 1.496 1.848 0 CA-C-O 121.934 0.873 . . . . 0.0 111.646 177.168 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.475 ' N ' ' OG ' ' A' ' 42' ' ' SER . 0.1 OUTLIER -87.48 18.75 3.67 Favored 'General case' 0 C--N 1.278 -2.543 0 N-CA-C 108.255 -1.017 . . . . 0.0 108.255 -179.903 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.519 ' OH ' ' HB3' ' A' ' 48' ' ' ASP . 0.3 OUTLIER -81.03 31.78 0.32 Allowed 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 119.764 -0.775 . . . . 0.0 110.6 -179.977 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 8.0 pttm -91.0 19.57 5.56 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 120.993 -1.067 . . . . 0.0 108.474 179.113 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -103.7 3.82 34.67 Favored 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.51 ' O ' ' CB ' ' A' ' 48' ' ' ASP . . . 91.72 -71.98 1.72 Allowed Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.252 -1.539 . . . . 0.0 109.252 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.548 ' O ' ' N ' ' A' ' 50' ' ' CYS . 1.5 p-10 159.59 37.24 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.554 -0.968 . . . . 0.0 109.136 179.66 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.618 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 21.9 mp0 51.96 -86.87 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.449 -0.782 . . . . 0.0 110.043 178.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.548 ' N ' ' O ' ' A' ' 48' ' ' ASP . 2.7 t -39.6 -26.24 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.342 -0.849 . . . . 0.0 109.867 179.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.507 ' N ' ' O ' ' A' ' 49' ' ' GLN . 1.1 tt0 -53.64 134.77 41.45 Favored 'General case' 0 N--CA 1.484 1.254 0 O-C-N 120.562 -1.336 . . . . 0.0 108.466 179.522 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.471 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . 103.28 -14.07 54.94 Favored Glycine 0 N--CA 1.495 2.614 0 O-C-N 120.732 -1.23 . . . . 0.0 110.12 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.564 ' CE1' ' O ' ' A' ' 55' ' ' CYS . 0.9 OUTLIER 70.55 61.58 0.48 Allowed Pre-proline 0 N--CA 1.493 1.717 0 O-C-N 121.123 -1.222 . . . . 0.0 109.825 179.912 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.545 ' CB ' ' CE2' ' A' ' 68' ' ' TYR . 3.4 Cg_exo -58.83 -44.9 32.27 Favored 'Trans proline' 0 C--N 1.309 -1.502 0 C-N-CA 122.544 2.162 . . . . 0.0 111.205 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.564 ' O ' ' CE1' ' A' ' 53' ' ' HIS . 0.8 OUTLIER -85.52 165.12 17.37 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.235 -0.916 . . . . 0.0 109.447 -179.114 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.508 ' O ' ' HB2' ' A' ' 81' ' ' CYS . 5.9 mt -149.66 -173.93 4.55 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 120.99 -1.069 . . . . 0.0 110.739 -179.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.61 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 1.1 m120 43.77 63.46 1.58 Allowed 'General case' 0 C--N 1.3 -1.561 0 CA-C-O 121.812 0.815 . . . . 0.0 109.414 179.821 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.45 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 0.2 OUTLIER 53.93 29.19 9.56 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.641 -0.662 . . . . 0.0 110.19 177.618 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -84.32 145.65 22.28 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.38 -1.488 . . . . 0.0 109.38 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.467 ' O ' ' SG ' ' A' ' 55' ' ' CYS . 1.7 t-160 -79.05 173.23 12.78 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.047 -1.266 . . . . 0.0 108.094 179.264 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.449 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 13.5 t -140.65 105.74 5.0 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.83 -1.169 . . . . 0.0 110.922 -179.137 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.586 ' O ' ' CG ' ' A' ' 63' ' ' BHD . 3.2 mtmm -92.77 169.96 10.07 Favored 'General case' 0 C--N 1.296 -1.73 0 N-CA-C 106.072 -1.825 . . . . 0.0 106.072 177.134 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' BHD . . . . . 0.586 ' CG ' ' O ' ' A' ' 62' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.559 ' O ' ' O ' ' A' ' 65' ' ' ILE . . . 131.24 57.7 0.09 OUTLIER Glycine 0 N--CA 1.492 2.418 0 N-CA-C 110.444 -1.062 . . . . 0.0 110.444 -179.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.574 HG23 ' N ' ' A' ' 66' ' ' GLY . 0.0 OUTLIER 45.36 173.9 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.128 0 O-C-N 121.532 -0.981 . . . . 0.0 110.673 179.742 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.574 ' N ' HG23 ' A' ' 65' ' ' ILE . . . 58.96 -80.99 0.01 OUTLIER Glycine 0 N--CA 1.496 2.671 0 N-CA-C 108.98 -1.648 . . . . 0.0 108.98 -179.135 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.586 ' O ' ' HG2' ' A' ' 49' ' ' GLN . 5.5 p-10 -135.29 -162.57 1.28 Allowed 'General case' 0 C--N 1.298 -1.634 0 N-CA-C 108.115 -1.069 . . . . 0.0 108.115 178.378 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.688 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 4.5 p90 -150.76 -159.15 0.99 Allowed 'General case' 0 C--N 1.292 -1.915 0 O-C-N 120.904 -1.122 . . . . 0.0 109.709 -177.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -149.7 171.04 17.34 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 178.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 52.8 m -140.48 -169.1 2.7 Favored 'General case' 0 C--N 1.304 -1.404 0 O-C-N 120.847 -1.158 . . . . 0.0 108.726 179.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -160.46 124.68 3.64 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.538 -0.726 . . . . 0.0 109.318 179.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.52 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 66.9 m -100.93 142.05 32.95 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.038 -1.038 . . . . 0.0 109.518 -179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.935 ' HB3' ' CE1' ' A' ' 76' ' ' PHE . . . -73.49 -176.35 2.26 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.189 -0.945 . . . . 0.0 110.678 -179.639 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 12.9 tt0 -81.23 102.44 10.35 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-O 123.139 1.447 . . . . 0.0 107.983 178.202 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . 0.466 ' HA2' ' OG1' ' A' ' 85' ' ' THR . . . 121.28 21.43 3.08 Favored Glycine 0 C--N 1.267 -3.293 0 N-CA-C 109.09 -1.604 . . . . 0.0 109.09 -179.048 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.935 ' CE1' ' HB3' ' A' ' 73' ' ' ALA . 6.0 m-85 -119.58 163.77 16.84 Favored 'General case' 0 C--N 1.294 -1.806 0 O-C-N 121.447 -1.031 . . . . 0.0 109.586 -178.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.493 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 1.8 mm-40 -157.21 174.41 15.51 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.956 -1.09 . . . . 0.0 110.317 -179.599 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 91.39 163.6 38.66 Favored Glycine 0 N--CA 1.489 2.198 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.44 -34.04 73.4 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.299 -1.118 . . . . 0.0 109.532 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.507 ' HB3' ' O ' ' A' ' 54' ' ' PRO . 0.1 OUTLIER -112.34 26.92 10.1 Favored 'General case' 0 C--N 1.292 -1.917 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 179.929 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.508 ' HB2' ' O ' ' A' ' 56' ' ' LEU . 3.0 m 63.22 12.06 5.82 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 120.804 -1.185 . . . . 0.0 108.516 -179.03 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -47.88 -43.57 28.69 Favored 'General case' 0 C--N 1.308 -1.198 0 O-C-N 121.585 -0.697 . . . . 0.0 111.462 -179.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.565 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.8 OUTLIER -81.8 83.49 7.14 Favored 'General case' 0 C--N 1.297 -1.702 0 O-C-N 121.294 -0.879 . . . . 0.0 110.585 -178.838 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.467 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 89.7 p -65.0 94.62 0.14 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.152 -0.967 . . . . 0.0 108.586 178.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.466 ' H ' HG23 ' A' ' 85' ' ' THR . 12.0 p -58.84 -17.01 20.02 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.337 -0.852 . . . . 0.0 110.099 -179.163 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.48 ' HG2' ' NH1' ' A' ' 86' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.291 -1.969 0 CA-C-O 117.964 -1.017 . . . . 0.0 109.525 -179.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.555 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.7 p30 -170.81 -175.92 1.91 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.269 -0.894 . . . . 0.0 109.461 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.456 ' OG ' OE12 ' A' ' 6' ' ' CGU . 0.1 OUTLIER -105.33 153.23 21.91 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.161 -0.962 . . . . 0.0 109.479 -179.917 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.476 ' CE2' ' O ' ' A' ' 22' ' ' CYS . 21.3 p90 -49.98 -38.7 38.13 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.184 -0.948 . . . . 0.0 109.966 -179.561 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.844 HD22 ' HB3' ' A' ' 26' ' ' CGU . 0.3 OUTLIER -74.34 -138.21 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.335 0 C-N-CA 117.691 -1.604 . . . . 0.0 107.796 178.41 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' CGU . . . . . 0.565 ' C ' ' O ' ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' CGU . . . . . 0.601 ' CD1' ' C ' ' A' ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.787 HG23 ' O ' ' A' ' 8' ' ' VAL . 33.7 m -44.55 97.88 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.207 -1.182 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 179.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.518 ' O ' ' C ' ' A' ' 10' ' ' GLN . 0.0 OUTLIER -48.26 88.14 0.0 OUTLIER 'General case' 0 C--N 1.286 -2.194 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 179.648 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.623 ' N ' ' O ' ' A' ' 8' ' ' VAL . 22.9 mp0 27.53 93.75 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 121.274 0.559 . . . . 0.0 110.355 -178.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -102.48 -147.17 18.93 Favored Glycine 0 N--CA 1.489 2.203 0 N-CA-C 110.117 -1.193 . . . . 0.0 110.117 -179.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.519 ' HB3' ' HB3' ' A' ' 16' ' ' CGU . 8.0 t30 -103.11 -169.91 1.72 Allowed 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.493 -1.004 . . . . 0.0 109.615 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 1.087 HD13 ' O ' ' A' ' 13' ' ' LEU . 0.0 OUTLIER -134.94 142.57 46.55 Favored 'General case' 0 C--N 1.306 -1.287 0 O-C-N 121.191 -0.943 . . . . 0.0 108.568 179.861 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' CGU . . . . . 0.998 ' N ' HD22 ' A' ' 13' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.536 ' CZ ' ' OB ' ' A' ' 63' ' ' BHD . 0.0 OUTLIER -71.54 -52.34 18.76 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.157 -0.964 . . . . 0.0 108.468 179.741 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' CGU . . . . . 0.519 ' HB3' ' HB3' ' A' ' 12' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.534 ' SG ' ' O ' ' A' ' 17' ' ' CYS . 28.7 t -104.73 17.96 23.17 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.405 -0.809 . . . . 0.0 109.51 -179.143 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.824 HD11 ' OE1' ' A' ' 51' ' ' GLU . 0.3 OUTLIER -40.79 -85.24 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.76 -1.212 . . . . 0.0 110.426 -179.907 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' CGU . . . . . 0.466 ' O ' ' CD2' ' A' ' 4' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.412 ' HB1' OE22 ' A' ' 16' ' ' CGU . . . -105.41 8.89 33.78 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.906 -1.121 . . . . 0.0 109.606 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.563 ' O ' ' CB ' ' A' ' 23' ' ' SER . 12.8 t -111.4 -126.46 0.28 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.207 -0.933 . . . . 0.0 109.83 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.563 ' CB ' ' O ' ' A' ' 22' ' ' CYS . 1.9 t 153.86 -23.23 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.007 -1.058 . . . . 0.0 108.164 -179.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.519 ' CB ' ' O ' ' A' ' 23' ' ' SER . 0.1 OUTLIER 82.72 -41.91 0.11 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.834 -0.541 . . . . 0.0 109.837 -179.801 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' CGU . . . . . 0.844 ' HB3' HD22 ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.702 ' HB1' ' CZ ' ' A' ' 31' ' ' PHE . . . -48.14 -61.69 1.86 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.668 -1.27 . . . . 0.0 108.998 -179.652 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.856 ' NH1' HG22 ' A' ' 37' ' ' THR . 0.8 OUTLIER -49.93 -57.9 6.53 Favored 'General case' 0 C--N 1.297 -1.681 0 O-C-N 120.575 -1.328 . . . . 0.0 110.85 -179.792 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' CGU . . . . . 0.431 ' C ' ' O ' ' A' ' 28' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.631 HG23 OE12 ' A' ' 26' ' ' CGU . 79.7 t -79.79 -36.17 17.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.631 0 O-C-N 121.352 -0.843 . . . . 0.0 110.072 -179.701 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.903 ' CZ ' HD23 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -136.91 129.86 30.8 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.792 -1.192 . . . . 0.0 111.516 -179.459 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' CGU . . . . . 0.43 ' O ' ' C ' ' A' ' 33' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.526 ' HB3' ' HG2' ' A' ' 36' ' ' GLN . 0.1 OUTLIER -39.22 115.5 0.5 Allowed 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.398 -0.814 . . . . 0.0 111.234 -177.601 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.502 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -80.54 -31.86 36.9 Favored 'General case' 0 N--CA 1.489 1.522 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 179.375 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.729 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 0.0 OUTLIER -56.93 -37.68 71.84 Favored 'General case' 0 C--O 1.198 -1.634 0 N-CA-C 107.463 -1.31 . . . . 0.0 107.463 178.542 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.856 HG22 ' NH1' ' A' ' 28' ' ' ARG . 0.0 OUTLIER -38.91 -57.71 1.2 Allowed 'General case' 0 N--CA 1.502 2.129 0 O-C-N 119.656 -1.903 . . . . 0.0 107.79 178.414 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.615 ' O ' ' C ' ' A' ' 39' ' ' CGU . 1.8 t70 -82.4 -69.34 0.63 Allowed 'General case' 0 C--N 1.295 -1.784 0 O-C-N 121.154 -0.966 . . . . 0.0 109.898 176.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' CGU . . . . . 0.615 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.755 ' CE1' HD21 ' A' ' 13' ' ' LEU . 21.5 t80 -39.45 -59.48 1.08 Allowed 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 107.294 -1.372 . . . . 0.0 107.294 177.261 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.684 ' CD1' ' O ' ' A' ' 37' ' ' THR . 11.3 m95 -80.65 -177.03 6.09 Favored 'General case' 0 C--N 1.303 -1.435 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 177.36 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.631 ' O ' ' CB ' ' A' ' 43' ' ' LYS . 0.4 OUTLIER 35.22 81.83 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.125 0 O-C-N 121.46 -0.775 . . . . 0.0 110.055 179.213 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.631 ' CB ' ' O ' ' A' ' 42' ' ' SER . 18.2 tptt 133.86 -26.0 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 105.708 -1.96 . . . . 0.0 105.708 -178.365 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.635 ' O ' ' N ' ' A' ' 46' ' ' ASP . 0.9 OUTLIER -46.55 -71.01 0.08 Allowed 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 115.263 -0.881 . . . . 0.0 108.66 179.035 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.544 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.1 OUTLIER -1.11 64.73 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.68 0 CA-C-O 121.459 0.647 . . . . 0.0 112.054 179.663 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.635 ' N ' ' O ' ' A' ' 44' ' ' TYR . 5.3 t0 -161.38 23.48 0.13 Allowed 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 -179.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.602 ' O ' ' HB3' ' A' ' 48' ' ' ASP . . . 82.78 -74.56 2.5 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 107.714 -2.154 . . . . 0.0 107.714 -178.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.602 ' HB3' ' O ' ' A' ' 47' ' ' GLY . 0.0 OUTLIER 168.25 13.58 0.0 OUTLIER 'General case' 0 N--CA 1.499 2.02 0 O-C-N 122.239 -0.565 . . . . 0.0 109.75 178.129 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.587 ' HB2' ' O ' ' A' ' 48' ' ' ASP . 22.8 mp0 73.31 -27.27 0.19 Allowed 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.558 -0.714 . . . . 0.0 111.845 178.723 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.491 ' HB2' ' OB ' ' A' ' 63' ' ' BHD . 10.8 t -124.35 2.97 8.46 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 120.522 -1.361 . . . . 0.0 109.691 179.102 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.824 ' OE1' HD11 ' A' ' 18' ' ' LEU . 10.7 tt0 -57.62 -47.63 81.66 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.824 -1.172 . . . . 0.0 110.878 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -67.38 -0.34 10.94 Favored Glycine 0 N--CA 1.496 2.677 0 O-C-N 120.987 -1.07 . . . . 0.0 111.658 -178.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.532 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 2.2 t60 57.44 61.67 6.03 Favored Pre-proline 0 N--CA 1.492 1.657 0 O-C-N 120.656 -1.496 . . . . 0.0 109.105 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.532 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 1.3 Cg_endo -64.6 -45.77 8.3 Favored 'Trans proline' 0 C--N 1.31 -1.487 0 C-N-CA 122.561 2.174 . . . . 0.0 111.911 -178.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.464 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 2.1 m -63.73 161.12 15.7 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 120.901 -1.124 . . . . 0.0 109.378 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.495 ' HA ' HD23 ' A' ' 56' ' ' LEU . 4.9 mt -144.0 -174.94 4.41 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.141 -0.975 . . . . 0.0 109.927 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.61 ' O ' ' CD2' ' A' ' 76' ' ' PHE . 5.4 m-80 41.52 63.98 1.15 Allowed 'General case' 0 C--N 1.3 -1.551 0 CA-C-O 121.886 0.85 . . . . 0.0 109.56 -179.263 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.456 ' HG3' ' C ' ' A' ' 57' ' ' ASN . 4.3 mt-30 47.44 35.98 4.62 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.333 -0.854 . . . . 0.0 109.075 178.13 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -79.57 142.44 24.75 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.636 -1.386 . . . . 0.0 109.636 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.494 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 10.9 m170 -79.57 137.93 37.3 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.32 -1.106 . . . . 0.0 108.562 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.464 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 27.6 t -107.96 122.11 46.15 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.152 -0.967 . . . . 0.0 110.302 -179.026 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.489 ' HB2' ' OG1' ' A' ' 69' ' ' THR . 32.2 mmtt -104.03 97.7 7.64 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 105.617 -1.994 . . . . 0.0 105.617 177.237 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' BHD . . . . . 0.536 ' OB ' ' CZ ' ' A' ' 15' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.519 ' O ' ' OE1' ' A' ' 49' ' ' GLN . . . 164.81 -166.1 37.89 Favored Glycine 0 N--CA 1.488 2.134 0 N-CA-C 106.457 -2.657 . . . . 0.0 106.457 -178.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.569 ' CG2' ' HG3' ' A' ' 43' ' ' LYS . 6.2 mm -98.6 -72.77 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 120.273 -1.722 . . . . 0.0 110.222 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.462 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . -42.54 -26.56 0.41 Allowed Glycine 0 N--CA 1.491 2.339 0 C-N-CA 119.553 -1.308 . . . . 0.0 110.263 -178.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.462 ' HB3' ' O ' ' A' ' 66' ' ' GLY . 2.3 p-10 179.93 -154.11 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.021 -1.282 . . . . 0.0 110.44 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.664 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 4.2 p90 -160.46 130.22 5.14 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 -178.328 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.489 ' OG1' ' HB2' ' A' ' 62' ' ' LYS . 43.5 p -98.79 117.15 32.61 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 120.71 -1.244 . . . . 0.0 109.333 -179.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 33.5 m -79.27 -169.24 1.79 Allowed 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.01 -1.056 . . . . 0.0 108.659 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.494 ' HB ' ' HB2' ' A' ' 60' ' ' HIS . 0.2 OUTLIER -160.48 149.82 17.34 Favored 'General case' 0 C--N 1.286 -2.159 0 N-CA-C 108.952 -0.759 . . . . 0.0 108.952 179.94 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.547 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 92.8 m -114.06 118.39 33.94 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.146 -0.971 . . . . 0.0 108.945 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.864 ' HB3' ' CD1' ' A' ' 76' ' ' PHE . . . -48.26 -176.57 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.023 -1.048 . . . . 0.0 110.812 -179.223 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.6 tt0 -80.29 101.85 9.17 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-O 123.278 1.513 . . . . 0.0 107.555 178.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . 0.531 ' HA2' ' HG3' ' A' ' 86' ' ' ARG . . . 118.3 20.44 4.36 Favored Glycine 0 C--N 1.268 -3.232 0 N-CA-C 108.91 -1.676 . . . . 0.0 108.91 -178.533 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.864 ' CD1' ' HB3' ' A' ' 73' ' ' ALA . 9.2 m-85 -119.55 156.04 31.06 Favored 'General case' 0 C--N 1.294 -1.827 0 O-C-N 121.621 -0.929 . . . . 0.0 109.462 -178.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.511 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 5.5 mm-40 -160.69 161.18 32.23 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.058 -1.026 . . . . 0.0 110.84 -179.33 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 109.97 169.7 19.96 Favored Glycine 0 N--CA 1.493 2.443 0 N-CA-C 109.47 -1.452 . . . . 0.0 109.47 179.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.87 -58.87 5.2 Favored 'General case' 0 C--N 1.306 -1.324 0 O-C-N 121.094 -1.239 . . . . 0.0 109.033 179.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.485 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 19.2 m-20 -104.98 29.44 6.32 Favored 'General case' 0 C--N 1.289 -2.043 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 178.582 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.511 ' HA ' ' O ' ' A' ' 77' ' ' GLU . 6.4 m 68.51 16.6 9.13 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.141 -0.975 . . . . 0.0 108.716 -179.306 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.443 ' C ' ' O ' ' A' ' 81' ' ' CYS . 83.2 tt0 -34.9 -32.92 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.328 0 O-C-N 121.739 -0.601 . . . . 0.0 111.763 -179.393 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.52 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.3 OUTLIER -104.35 -161.72 0.84 Allowed 'General case' 0 C--N 1.295 -1.786 0 CA-C-O 122.719 1.247 . . . . 0.0 109.379 -179.778 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.434 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 33.1 m -157.31 95.19 1.45 Allowed 'General case' 0 C--N 1.277 -2.583 0 CA-C-N 114.471 -1.241 . . . . 0.0 108.903 179.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.463 ' OG1' ' HA2' ' A' ' 75' ' ' GLY . 31.1 p -50.62 -35.7 31.67 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.321 -0.862 . . . . 0.0 110.234 -179.18 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.531 ' HG3' ' HA2' ' A' ' 75' ' ' GLY . 0.0 OUTLIER . . . . . 0 C--N 1.287 -2.144 0 CA-C-O 118.007 -0.996 . . . . 0.0 109.16 179.842 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.469 ' O ' ' CB ' ' A' ' 2' ' ' ASN . . . . . . . . 0 N--CA 1.489 1.497 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.504 ' CB ' OE12 ' A' ' 6' ' ' CGU . 4.6 m120 72.74 -164.68 0.11 Allowed 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.278 -0.889 . . . . 0.0 109.634 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.526 ' OG ' HD12 ' A' ' 5' ' ' LEU . 13.4 t -86.64 156.5 19.98 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.257 -0.902 . . . . 0.0 109.769 -179.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.552 ' C ' ' CD1' ' A' ' 4' ' ' PHE . 0.5 OUTLIER -69.21 -20.64 63.98 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.29 -0.881 . . . . 0.0 109.113 179.77 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.742 HD22 OE22 ' A' ' 26' ' ' CGU . 1.2 mt -65.64 -8.21 19.21 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.117 -0.989 . . . . 0.0 109.714 -179.591 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' CGU . . . . . 0.504 OE12 ' CB ' ' A' ' 2' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' CGU . . . . . 0.432 ' O ' ' C ' ' A' ' 8' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.895 HG22 ' H ' ' A' ' 10' ' ' GLN . 1.5 p -39.29 125.92 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.199 0 CA-C-O 123.461 1.601 . . . . 0.0 109.913 -178.732 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.452 ' O ' ' O ' ' A' ' 10' ' ' GLN . 0.9 OUTLIER -80.71 25.46 0.43 Allowed 'General case' 0 C--N 1.267 -2.998 0 CA-C-N 113.119 -1.855 . . . . 0.0 110.735 -179.754 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.895 ' H ' HG22 ' A' ' 8' ' ' VAL . 2.5 tm0? 61.11 144.33 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 O-C-N 120.751 -1.218 . . . . 0.0 109.702 179.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.446 ' O ' ' C ' ' A' ' 12' ' ' ASN . . . 134.26 -129.12 5.13 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.733 ' ND2' HG21 ' A' ' 30' ' ' VAL . 0.7 OUTLIER 40.35 41.46 1.03 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.145 -1.209 . . . . 0.0 110.085 179.875 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.537 ' O ' ' CD2' ' A' ' 14' ' ' CGU . 0.1 OUTLIER -129.76 -7.99 4.52 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.165 -0.959 . . . . 0.0 109.446 179.549 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' CGU . . . . . 0.537 ' CD2' ' O ' ' A' ' 13' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.75 ' O ' ' N ' ' A' ' 17' ' ' CYS . 20.7 mtm180 -84.65 95.96 9.06 Favored 'General case' 0 C--O 1.198 -1.625 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 177.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' CGU . . . . . 0.71 OE11 ' HB3' ' A' ' 27' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.75 ' N ' ' O ' ' A' ' 15' ' ' ARG . 84.7 m 32.1 35.71 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.059 0 CA-C-O 121.718 0.77 . . . . 0.0 109.546 179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.547 ' N ' ' O ' ' A' ' 16' ' ' CGU . 0.2 OUTLIER -47.85 -22.5 0.57 Allowed 'General case' 0 N--CA 1.495 1.796 0 CA-C-O 121.491 0.662 . . . . 0.0 111.154 -178.705 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' CGU . . . . . 0.409 ' O ' ' C ' ' A' ' 21' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.419 ' C ' ' SG ' ' A' ' 22' ' ' CYS . . . -44.66 -49.67 10.24 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 121.206 -0.934 . . . . 0.0 109.544 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.419 ' SG ' ' C ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -152.22 -170.7 3.72 Favored 'General case' 0 C--N 1.29 -2.011 0 CA-C-O 121.52 0.676 . . . . 0.0 109.683 -179.816 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.667 ' C ' HD22 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -102.34 24.55 10.12 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.913 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.672 HD22 ' N ' ' A' ' 24' ' ' LEU . 2.6 mm? 76.33 -11.88 1.1 Allowed 'General case' 0 N--CA 1.498 1.932 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.657 -179.699 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' CGU . . . . . 0.742 OE22 HD22 ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.71 ' HB3' OE11 ' A' ' 16' ' ' CGU . . . -80.83 41.26 0.56 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.842 -1.161 . . . . 0.0 110.605 -179.26 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 8.5 mtt180 -106.61 -58.41 1.93 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.735 -1.228 . . . . 0.0 109.589 179.592 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' CGU . . . . . 0.409 OE11 OE22 ' A' ' 29' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.733 HG21 ' ND2' ' A' ' 12' ' ' ASN . 2.8 p -79.52 -29.88 13.49 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.433 -0.792 . . . . 0.0 109.583 -179.62 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.522 ' CD1' HG12 ' A' ' 30' ' ' VAL . 42.9 m-85 -79.26 101.41 8.01 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.38 -0.825 . . . . 0.0 109.491 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' CGU . . . . . 0.508 ' C ' ' O ' ' A' ' 31' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.56 ' HB2' ' HB2' ' A' ' 36' ' ' GLN . 23.0 m-20 -61.4 83.56 0.01 OUTLIER 'General case' 0 C--O 1.191 -1.974 0 O-C-N 121.71 -0.618 . . . . 0.0 110.748 -179.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.495 ' HA ' ' OG1' ' A' ' 37' ' ' THR . . . -39.59 -27.38 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.95 0 O-C-N 120.886 -1.134 . . . . 0.0 110.185 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' CGU . . . . . 0.517 ' N ' ' O ' ' A' ' 33' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.744 ' O ' ' HB3' ' A' ' 40' ' ' PHE . 42.6 mt-30 -49.85 -46.42 51.36 Favored 'General case' 0 C--O 1.203 -1.359 0 N-CA-C 106.313 -1.736 . . . . 0.0 106.313 177.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.54 ' O ' ' HB3' ' A' ' 41' ' ' TRP . 1.4 m -35.94 -59.9 0.57 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.309 -0.869 . . . . 0.0 108.814 178.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.614 ' O ' ' C ' ' A' ' 39' ' ' CGU . 5.7 m-20 -81.96 -73.11 0.4 Allowed 'General case' 0 C--N 1.298 -1.664 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 177.206 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' CGU . . . . . 0.614 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.744 ' HB3' ' O ' ' A' ' 36' ' ' GLN . 7.7 t80 -40.1 -50.83 2.64 Favored 'General case' 0 C--N 1.292 -1.9 0 O-C-N 121.634 -0.666 . . . . 0.0 110.259 178.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.556 ' CZ2' ' HD3' ' A' ' 45' ' ' LYS . 26.4 t-105 -82.32 -72.59 0.43 Allowed 'General case' 0 C--N 1.294 -1.844 0 O-C-N 121.353 -0.842 . . . . 0.0 112.499 -176.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.497 ' O ' ' HG3' ' A' ' 45' ' ' LYS . 35.4 p -47.96 -63.53 1.04 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.64 -1.288 . . . . 0.0 110.632 -178.313 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.554 ' HB3' ' O ' ' A' ' 39' ' ' CGU . 3.7 tttm -52.32 -21.71 3.81 Favored 'General case' 0 C--N 1.291 -1.973 0 O-C-N 121.384 -0.822 . . . . 0.0 108.925 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.717 ' HB2' ' O ' ' A' ' 40' ' ' PHE . 25.2 t80 -80.19 -96.16 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 107.723 -1.214 . . . . 0.0 107.723 178.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.556 ' HD3' ' CZ2' ' A' ' 41' ' ' TRP . 4.4 mtmt 33.37 34.56 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.13 0 N-CA-C 107.995 -1.113 . . . . 0.0 107.995 -179.433 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.57 ' N ' ' O ' ' A' ' 44' ' ' TYR . 1.4 t70 -131.39 -21.71 2.54 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.804 -176.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.523 ' HA2' ' OH ' ' A' ' 44' ' ' TYR . . . 49.06 60.12 6.36 Favored Glycine 0 N--CA 1.492 2.418 0 N-CA-C 105.845 -2.902 . . . . 0.0 105.845 -177.03 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.429 ' C ' ' OE1' ' A' ' 49' ' ' GLN . 27.1 t0 -126.41 -129.87 0.24 Allowed 'General case' 0 C--N 1.307 -1.268 0 O-C-N 121.546 -0.973 . . . . 0.0 110.658 -176.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.599 ' CD ' ' N ' ' A' ' 49' ' ' GLN . 8.4 mp0 57.3 -86.12 0.02 OUTLIER 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.333 -0.854 . . . . 0.0 110.445 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.559 ' HA ' ' CG ' ' A' ' 54' ' ' PRO . 4.6 t -98.2 -1.58 41.75 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.03 -1.044 . . . . 0.0 111.188 -178.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.469 ' HG3' ' O ' ' A' ' 51' ' ' GLU . 0.6 OUTLIER -55.47 -26.01 39.95 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 120.961 -1.087 . . . . 0.0 111.527 -179.078 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.434 ' O ' ' C ' ' A' ' 53' ' ' HIS . . . -86.13 28.22 5.22 Favored Glycine 0 N--CA 1.494 2.506 0 O-C-N 120.545 -1.347 . . . . 0.0 110.921 -178.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.6 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 3.4 t-160 41.68 53.2 7.24 Favored Pre-proline 0 N--CA 1.493 1.715 0 O-C-N 121.108 -1.231 . . . . 0.0 109.775 179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.6 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 4.0 Cg_exo -56.77 -37.17 98.54 Favored 'Trans proline' 0 C--N 1.311 -1.405 0 C-N-CA 122.562 2.175 . . . . 0.0 111.299 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.535 ' SG ' ' CB ' ' A' ' 61' ' ' CYS . 0.6 OUTLIER -89.43 168.29 12.32 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.371 -0.831 . . . . 0.0 110.19 -178.218 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.521 ' HA ' HD23 ' A' ' 56' ' ' LEU . 5.8 mt -146.13 -173.66 4.23 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 122.08 0.943 . . . . 0.0 110.562 -179.397 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.615 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 51.0 m-80 40.29 64.56 0.9 Allowed 'General case' 0 C--N 1.304 -1.396 0 CA-C-O 122.038 0.923 . . . . 0.0 110.124 -179.684 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.437 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 2.2 mm-40 51.35 33.4 9.89 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-O 121.561 0.696 . . . . 0.0 109.835 177.393 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -81.41 127.3 7.84 Favored Glycine 0 N--CA 1.487 2.057 0 N-CA-C 109.174 -1.57 . . . . 0.0 109.174 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -78.97 168.01 20.3 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.115 -1.227 . . . . 0.0 107.951 179.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.535 ' CB ' ' SG ' ' A' ' 55' ' ' CYS . 0.5 OUTLIER -156.53 126.99 6.62 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 118.323 -1.351 . . . . 0.0 111.175 -178.878 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 7.8 mmtm -94.95 108.57 20.63 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 106.944 -1.502 . . . . 0.0 106.944 177.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' BHD . . . . . 0.554 ' CG ' ' HG2' ' A' ' 15' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.538 ' O ' ' O ' ' A' ' 67' ' ' ASP . . . 147.66 123.01 1.35 Allowed Glycine 0 N--CA 1.489 2.232 0 N-CA-C 108.221 -1.952 . . . . 0.0 108.221 -179.427 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.834 ' O ' HD12 ' A' ' 65' ' ' ILE . 2.2 pp -38.0 160.24 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.504 2.253 0 CA-C-N 118.935 1.367 . . . . 0.0 110.13 -178.209 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.537 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . 95.46 -47.55 1.92 Allowed Glycine 0 C--N 1.294 -1.759 0 N-CA-C 106.07 -2.812 . . . . 0.0 106.07 -177.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.538 ' O ' ' O ' ' A' ' 64' ' ' GLY . 14.7 p-10 169.69 -145.61 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 178.267 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.619 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 4.1 p90 -160.53 -167.16 1.81 Allowed 'General case' 0 C--N 1.298 -1.646 0 O-C-N 120.691 -1.256 . . . . 0.0 108.926 -179.427 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.476 ' O ' ' HA ' ' A' ' 61' ' ' CYS . 0.1 OUTLIER -147.99 152.08 36.86 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 107.621 -1.251 . . . . 0.0 107.621 178.675 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 61' ' ' CYS . 85.0 m -116.98 -170.16 1.78 Allowed 'General case' 0 C--N 1.302 -1.481 0 O-C-N 120.496 -1.378 . . . . 0.0 109.197 179.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 1.8 m -161.27 108.21 1.44 Allowed 'General case' 0 C--N 1.294 -1.829 0 N-CA-C 109.308 -0.627 . . . . 0.0 109.308 179.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.523 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 89.2 m -80.16 138.29 36.86 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 120.96 -1.087 . . . . 0.0 109.213 179.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.931 ' HB3' ' CE1' ' A' ' 76' ' ' PHE . . . -72.43 -174.4 1.34 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.074 -1.016 . . . . 0.0 111.25 -179.349 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -81.57 102.36 10.57 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-O 123.035 1.398 . . . . 0.0 108.185 178.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 120.37 18.0 4.24 Favored Glycine 0 C--N 1.267 -3.294 0 N-CA-C 109.213 -1.555 . . . . 0.0 109.213 -179.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.931 ' CE1' ' HB3' ' A' ' 73' ' ' ALA . 4.2 m-85 -115.82 163.99 15.05 Favored 'General case' 0 C--N 1.294 -1.838 0 O-C-N 121.476 -1.014 . . . . 0.0 109.622 -178.38 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.485 ' HB3' ' HB2' ' A' ' 83' ' ' PHE . 1.9 tt0 -157.38 167.15 31.11 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.146 -0.971 . . . . 0.0 110.051 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 96.4 162.86 32.95 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.636 -1.386 . . . . 0.0 109.636 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 7.4 tptt -60.19 -33.74 72.64 Favored 'General case' 0 C--N 1.306 -1.306 0 O-C-N 121.249 -1.147 . . . . 0.0 109.727 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.5 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.2 OUTLIER -113.97 22.12 14.21 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 179.877 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.532 ' O ' ' ND2' ' A' ' 57' ' ' ASN . 5.0 m 70.34 7.02 6.05 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.035 -1.041 . . . . 0.0 108.85 -179.236 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.564 ' HA ' ' ND2' ' A' ' 57' ' ' ASN . 56.3 tt0 -37.6 -47.19 0.92 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.573 -0.704 . . . . 0.0 111.305 -179.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.579 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.6 OUTLIER -82.96 83.63 7.74 Favored 'General case' 0 C--N 1.294 -1.811 0 O-C-N 121.136 -0.977 . . . . 0.0 110.55 -178.625 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.452 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 1.6 p -70.97 91.38 0.86 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.275 -0.891 . . . . 0.0 108.802 178.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 10.2 p -60.76 -14.97 24.72 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.311 -0.868 . . . . 0.0 110.014 -179.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.505 ' CD ' ' O ' ' A' ' 86' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.293 -1.852 0 CA-C-O 118.055 -0.974 . . . . 0.0 109.454 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.432 ' O ' ' O ' ' A' ' 2' ' ' ASN . . . . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 109.387 -0.597 . . . . 0.0 109.387 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.432 ' O ' ' O ' ' A' ' 1' ' ' ALA . 25.7 m120 59.38 156.32 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.242 -0.911 . . . . 0.0 109.253 -179.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.488 ' HB3' ' O ' ' A' ' 8' ' ' VAL . 0.3 OUTLIER 46.87 39.05 6.82 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.101 -1.0 . . . . 0.0 108.73 -179.632 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.523 ' C ' ' CD1' ' A' ' 4' ' ' PHE . 0.0 OUTLIER -79.87 6.82 10.1 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.528 -0.733 . . . . 0.0 110.517 -179.351 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.585 ' HB2' HG13 ' A' ' 8' ' ' VAL . 40.9 mt -63.41 91.4 0.05 Allowed 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' CGU . . . . . 0.596 ' C ' ' CD2' ' A' ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' CGU . . . . . 0.596 ' CD2' ' C ' ' A' ' 6' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.595 HG23 ' O ' ' A' ' 8' ' ' VAL . 4.6 m -55.2 97.57 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 118.061 -1.455 . . . . 0.0 107.978 179.462 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.508 ' C ' ' O ' ' A' ' 8' ' ' VAL . 2.3 tptp -39.37 -31.57 0.09 Allowed 'General case' 0 C--N 1.29 -2.016 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 179.108 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.482 ' CG ' ' C ' ' A' ' 9' ' ' LYS . 0.9 OUTLIER 165.62 84.49 0.0 OUTLIER 'General case' 0 C--N 1.309 -1.153 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 178.664 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.47 ' O ' ' CD2' ' A' ' 13' ' ' LEU . . . -120.27 -145.05 7.31 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.689 -1.364 . . . . 0.0 109.689 -179.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.805 ' C ' HD22 ' A' ' 13' ' ' LEU . 21.4 m-20 56.38 77.66 0.24 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.238 -1.154 . . . . 0.0 109.387 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.805 HD22 ' C ' ' A' ' 12' ' ' ASN . 3.4 mm? -134.04 7.52 3.71 Favored 'General case' 0 C--N 1.308 -1.229 0 O-C-N 121.168 -0.957 . . . . 0.0 109.901 -179.613 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' CGU . . . . . 0.534 ' C ' ' OB ' ' A' ' 63' ' ' BHD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.664 ' O ' ' N ' ' A' ' 17' ' ' CYS . 0.0 OUTLIER -84.22 96.2 8.91 Favored 'General case' 0 C--O 1.197 -1.68 0 N-CA-C 105.338 -2.097 . . . . 0.0 105.338 177.618 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' CGU . . . . . 0.657 ' CD2' ' CZ ' ' A' ' 40' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.664 ' N ' ' O ' ' A' ' 15' ' ' ARG . 7.6 p 13.16 60.0 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.278 0 CA-C-O 122.106 0.955 . . . . 0.0 111.108 -178.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.643 HD21 ' HH ' ' A' ' 44' ' ' TYR . 0.2 OUTLIER -80.3 0.81 31.28 Favored 'General case' 0 C--N 1.289 -2.05 0 CA-C-O 121.346 0.593 . . . . 0.0 109.552 -179.38 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' CGU . . . . . 0.421 ' C ' ' N ' ' A' ' 22' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.444 ' O ' HD13 ' A' ' 5' ' ' LEU . . . -53.24 -19.82 3.52 Favored 'General case' 0 C--N 1.296 -1.73 0 O-C-N 121.63 -0.669 . . . . 0.0 110.014 -179.582 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.567 ' HB2' HD11 ' A' ' 5' ' ' LEU . 0.0 OUTLIER 172.11 -29.4 0.0 OUTLIER 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.402 -0.811 . . . . 0.0 109.442 179.884 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.505 ' CB ' ' O ' ' A' ' 22' ' ' CYS . 1.7 m 77.11 -76.26 0.05 Allowed 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 -178.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.484 ' O ' ' CD1' ' A' ' 24' ' ' LEU . 0.1 OUTLIER -162.47 24.56 0.1 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.216 -0.927 . . . . 0.0 108.829 179.189 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' CGU . . . . . 0.417 ' O ' ' HB2' ' A' ' 28' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' CGU . . . . . 0.853 OE11 HG23 ' A' ' 30' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.48 ' C ' ' O ' ' A' ' 26' ' ' CGU . . . -39.76 -27.89 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.13 -0.981 . . . . 0.0 109.565 -179.607 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.523 ' N ' ' C ' ' A' ' 26' ' ' CGU . 0.0 OUTLIER -50.25 -70.81 0.08 Allowed 'General case' 0 C--N 1.303 -1.442 0 CA-C-O 121.968 0.889 . . . . 0.0 110.831 179.812 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.853 HG23 OE11 ' A' ' 26' ' ' CGU . 0.4 OUTLIER -79.17 -20.03 12.73 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 120.908 -1.12 . . . . 0.0 109.543 -179.662 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.691 ' CZ ' ' CZ ' ' A' ' 40' ' ' PHE . 88.6 m-85 -100.74 94.42 6.07 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.227 -0.921 . . . . 0.0 110.243 179.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' CGU . . . . . 0.462 OE12 ' HA ' ' A' ' 32' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.578 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 0.4 OUTLIER -39.7 136.55 1.01 Allowed 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 121.334 0.588 . . . . 0.0 111.078 -179.293 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.543 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -80.74 -35.88 32.78 Favored 'General case' 0 N--CA 1.491 1.605 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 179.062 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' CGU . . . . . 0.475 ' O ' ' HB3' ' A' ' 39' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.63 ' O ' ' HB2' ' A' ' 40' ' ' PHE . 55.2 mt-30 -55.07 -37.4 66.72 Favored 'General case' 0 C--O 1.204 -1.323 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 178.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.704 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -42.19 -60.61 1.4 Allowed 'General case' 0 N--CA 1.497 1.902 0 C-N-CA 117.759 -1.577 . . . . 0.0 107.172 178.499 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.678 ' O ' ' C ' ' A' ' 39' ' ' CGU . 0.3 OUTLIER -81.62 -72.05 0.45 Allowed 'General case' 0 C--N 1.296 -1.753 0 O-C-N 120.844 -1.16 . . . . 0.0 109.693 177.357 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' CGU . . . . . 0.678 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.691 ' CZ ' ' CZ ' ' A' ' 31' ' ' PHE . 7.3 t80 -47.55 -56.99 5.96 Favored 'General case' 0 C--N 1.295 -1.761 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 178.228 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.704 ' CD1' ' O ' ' A' ' 37' ' ' THR . 9.1 m95 -77.36 -63.73 1.31 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.309 -0.869 . . . . 0.0 112.185 -179.504 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.523 ' OG ' ' N ' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -42.43 -70.06 0.12 Allowed 'General case' 0 N--CA 1.499 2.008 0 O-C-N 120.843 -1.161 . . . . 0.0 112.517 -177.556 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.541 ' CG ' ' O ' ' A' ' 39' ' ' CGU . 0.1 OUTLIER -79.15 32.36 0.22 Allowed 'General case' 0 C--N 1.288 -2.081 0 O-C-N 121.482 -0.761 . . . . 0.0 110.543 -178.55 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.643 ' HH ' HD21 ' A' ' 18' ' ' LEU . 1.0 OUTLIER -80.91 33.9 0.34 Allowed 'General case' 0 C--N 1.303 -1.437 0 O-C-N 121.126 -0.984 . . . . 0.0 110.414 179.7 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -96.14 37.99 1.21 Allowed 'General case' 0 C--N 1.302 -1.459 0 O-C-N 120.557 -1.339 . . . . 0.0 107.702 178.569 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -126.58 -1.1 6.81 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.724 -0.61 . . . . 0.0 109.912 -178.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.543 ' O ' ' CB ' ' A' ' 48' ' ' ASP . . . 71.64 6.71 63.36 Favored Glycine 0 N--CA 1.495 2.579 0 N-CA-C 109.179 -1.569 . . . . 0.0 109.179 -179.195 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.642 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER 85.62 5.32 0.48 Allowed 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.743 -0.857 . . . . 0.0 109.907 179.746 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.715 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 36.3 mm-40 82.37 -47.52 0.18 Allowed 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.819 -0.55 . . . . 0.0 111.723 178.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 11.2 t -83.04 -0.44 48.96 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.946 -1.096 . . . . 0.0 109.757 -179.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.493 ' OE1' ' CA ' ' A' ' 47' ' ' GLY . 47.3 tt0 -74.81 148.2 40.53 Favored 'General case' 0 N--CA 1.484 1.257 0 O-C-N 121.09 -1.007 . . . . 0.0 108.425 179.339 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 91.65 0.07 73.07 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.38 -1.488 . . . . 0.0 109.38 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.452 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 0.8 OUTLIER 54.41 63.3 7.5 Favored Pre-proline 0 C--N 1.307 -1.263 0 O-C-N 121.225 -1.162 . . . . 0.0 109.762 179.39 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.452 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 4.6 Cg_exo -56.88 -38.48 95.8 Favored 'Trans proline' 0 C--N 1.309 -1.506 0 C-N-CA 122.448 2.099 . . . . 0.0 110.325 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.474 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 0.3 OUTLIER -86.37 169.59 12.78 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.365 -0.835 . . . . 0.0 109.59 -179.714 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.507 ' O ' ' HB2' ' A' ' 81' ' ' CYS . 4.8 mt -147.13 -174.52 4.53 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.31 -0.869 . . . . 0.0 109.594 179.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.598 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 1.4 m-80 41.56 63.2 1.33 Allowed 'General case' 0 C--N 1.301 -1.531 0 CA-C-O 121.778 0.799 . . . . 0.0 109.824 -179.633 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.452 ' HG3' ' C ' ' A' ' 57' ' ' ASN . 1.8 mt-30 45.84 35.92 2.56 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.372 -0.83 . . . . 0.0 109.374 177.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -80.38 151.78 33.3 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.64 -1.384 . . . . 0.0 109.64 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -79.36 166.03 22.5 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.276 -1.132 . . . . 0.0 108.895 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.474 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 37.7 t -139.36 128.03 23.22 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.06 -1.025 . . . . 0.0 110.212 -179.515 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.512 ' HB2' ' OG1' ' A' ' 69' ' ' THR . 9.1 mmmt -102.61 -175.29 2.78 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 106.332 -1.729 . . . . 0.0 106.332 177.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' BHD . . . . . 0.534 ' OB ' ' C ' ' A' ' 14' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.512 ' O ' ' O ' ' A' ' 67' ' ' ASP . . . 152.0 137.63 2.63 Favored Glycine 0 N--CA 1.488 2.119 0 N-CA-C 107.688 -2.165 . . . . 0.0 107.688 -179.184 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.498 HG22 ' N ' ' A' ' 66' ' ' GLY . 0.5 OUTLIER -46.15 -59.43 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.555 0 O-C-N 120.578 -1.542 . . . . 0.0 109.164 -179.128 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.498 ' N ' HG22 ' A' ' 65' ' ' ILE . . . -44.64 -38.2 5.4 Favored Glycine 0 N--CA 1.493 2.448 0 N-CA-C 110.552 -1.019 . . . . 0.0 110.552 -178.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.512 ' O ' ' O ' ' A' ' 64' ' ' GLY . 9.0 p-10 177.59 -147.7 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.105 0 O-C-N 121.172 -1.193 . . . . 0.0 110.555 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.715 ' CD1' ' HB3' ' A' ' 49' ' ' GLN . 1.7 p90 -156.86 -170.89 3.45 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.924 -1.11 . . . . 0.0 109.741 -179.424 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.512 ' OG1' ' HB2' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -160.62 112.9 1.96 Allowed 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.296 -0.877 . . . . 0.0 109.815 -179.739 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 35.6 m -80.42 -171.09 2.86 Favored 'General case' 0 C--N 1.296 -1.758 0 O-C-N 120.976 -1.077 . . . . 0.0 110.107 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.444 ' O ' ' SG ' ' A' ' 81' ' ' CYS . 0.2 OUTLIER -160.67 166.97 27.91 Favored 'General case' 0 C--N 1.288 -2.086 0 CA-C-N 115.362 -0.836 . . . . 0.0 108.779 179.927 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.534 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 90.4 m -128.96 125.59 37.78 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.025 -1.047 . . . . 0.0 109.269 179.589 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.9 ' HB3' ' CD1' ' A' ' 76' ' ' PHE . . . -51.0 179.95 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.017 -1.052 . . . . 0.0 110.552 -179.416 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -80.95 102.27 10.02 Favored 'General case' 0 C--N 1.308 -1.227 0 CA-C-O 123.119 1.437 . . . . 0.0 107.735 178.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . 0.485 ' CA ' ' OG1' ' A' ' 85' ' ' THR . . . 118.68 23.04 3.49 Favored Glycine 0 C--N 1.268 -3.218 0 N-CA-C 108.756 -1.738 . . . . 0.0 108.756 -178.516 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.9 ' CD1' ' HB3' ' A' ' 73' ' ' ALA . 8.7 m-85 -119.14 159.35 24.14 Favored 'General case' 0 C--N 1.294 -1.817 0 O-C-N 121.67 -0.9 . . . . 0.0 109.451 -178.167 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.477 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 0.2 OUTLIER -156.16 165.7 35.63 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 120.879 -1.138 . . . . 0.0 110.59 -179.06 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 101.77 165.52 27.12 Favored Glycine 0 N--CA 1.493 2.47 0 N-CA-C 109.502 -1.439 . . . . 0.0 109.502 179.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.1 tptt -58.01 -39.51 78.48 Favored 'General case' 0 C--N 1.307 -1.263 0 O-C-N 121.13 -1.218 . . . . 0.0 109.404 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.489 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 3.8 m-20 -113.56 24.42 12.2 Favored 'General case' 0 C--N 1.291 -1.946 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 179.577 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.509 ' HB2' ' HB2' ' A' ' 57' ' ' ASN . 4.6 m 71.14 6.1 5.71 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 120.985 -1.072 . . . . 0.0 109.305 -179.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.462 ' C ' ' O ' ' A' ' 81' ' ' CYS . 15.0 tt0 -33.15 -46.81 0.17 Allowed 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.341 0.591 . . . . 0.0 111.579 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.613 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.2 OUTLIER -88.16 89.63 8.07 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.472 -0.767 . . . . 0.0 110.576 -178.517 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.486 ' N ' ' OD1' ' A' ' 57' ' ' ASN . 3.8 p -70.58 92.64 0.86 Allowed 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 178.588 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.485 ' OG1' ' CA ' ' A' ' 75' ' ' GLY . 16.6 p -42.87 -28.87 0.28 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.246 -0.909 . . . . 0.0 110.242 -178.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.593 ' CZ ' ' CB ' ' A' ' 86' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.289 -2.025 0 CA-C-O 118.029 -0.986 . . . . 0.0 109.526 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 109.388 -0.597 . . . . 0.0 109.388 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.512 ' O ' ' N ' ' A' ' 4' ' ' PHE . 36.8 m-20 59.02 -168.06 0.15 Allowed 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.355 -0.841 . . . . 0.0 109.646 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.2 m -47.58 92.95 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.303 -0.873 . . . . 0.0 109.683 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.512 ' N ' ' O ' ' A' ' 2' ' ' ASN . 2.0 t80 -63.66 -44.76 92.85 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.222 -0.924 . . . . 0.0 109.124 179.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.71 HD22 ' CB ' ' A' ' 26' ' ' CGU . 0.1 OUTLIER -62.69 -148.48 0.0 OUTLIER 'General case' 0 C--N 1.303 -1.419 0 C-N-CA 118.624 -1.23 . . . . 0.0 108.403 179.595 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' CGU . . . . . 0.538 ' C ' ' O ' ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' CGU . . . . . 0.46 ' HG ' ' O ' ' A' ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.706 HG13 ' N ' ' A' ' 9' ' ' LYS . 2.9 p -81.16 -150.59 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 N-CA-C 108.277 -1.008 . . . . 0.0 108.277 -179.532 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.706 ' N ' HG13 ' A' ' 8' ' ' VAL . 0.1 OUTLIER -82.21 24.79 0.64 Allowed 'General case' 0 C--N 1.293 -1.879 0 O-C-N 121.114 -0.991 . . . . 0.0 110.416 179.63 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.523 ' CB ' ' O ' ' A' ' 9' ' ' LYS . 0.0 OUTLIER 80.03 -11.73 1.13 Allowed 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.071 -1.018 . . . . 0.0 109.705 -179.446 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -179.15 127.9 1.19 Allowed Glycine 0 N--CA 1.49 2.298 0 N-CA-C 108.994 -1.642 . . . . 0.0 108.994 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.648 ' HB3' ' CZ ' ' A' ' 31' ' ' PHE . 0.9 OUTLIER -110.45 159.47 17.46 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.112 -1.229 . . . . 0.0 109.619 -179.598 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 1.088 HD13 ' N ' ' A' ' 14' ' ' CGU . 2.6 tm? 178.89 146.08 0.16 Allowed 'General case' 0 C--N 1.313 -1.015 0 O-C-N 120.91 -1.118 . . . . 0.0 108.788 -179.669 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' CGU . . . . . 1.088 ' N ' HD13 ' A' ' 13' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.46 ' HB3' HD23 ' A' ' 18' ' ' LEU . 7.9 mtm-85 -85.19 99.64 11.23 Favored 'General case' 0 C--N 1.3 -1.58 0 N-CA-C 104.23 -2.508 . . . . 0.0 104.23 175.121 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' CGU . . . . . 0.672 ' HG ' ' CD2' ' A' ' 31' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.553 ' CB ' ' O ' ' A' ' 16' ' ' CGU . 5.7 m 84.83 -59.46 0.09 Allowed 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.534 -0.729 . . . . 0.0 109.822 179.633 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.645 HD12 ' CB ' ' A' ' 48' ' ' ASP . 2.5 mm? 65.29 -86.84 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.508 0 CA-C-O 121.873 0.844 . . . . 0.0 110.254 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' CGU . . . . . 0.486 ' C ' ' N ' ' A' ' 22' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.434 ' O ' ' CB ' ' A' ' 22' ' ' CYS . . . -49.48 -21.22 0.88 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.074 -1.017 . . . . 0.0 109.351 179.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.486 ' N ' ' C ' ' A' ' 20' ' ' CGU . 0.0 OUTLIER 172.63 -22.76 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.705 0 O-C-N 121.612 -0.68 . . . . 0.0 109.465 179.703 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.501 ' O ' ' HB2' ' A' ' 27' ' ' ALA . 5.9 p 53.81 -147.04 0.51 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.004 -1.06 . . . . 0.0 110.23 179.052 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.628 ' HG ' ' CZ2' ' A' ' 41' ' ' TRP . 0.3 OUTLIER -79.03 7.84 6.67 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.389 -0.82 . . . . 0.0 110.063 -179.669 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' CGU . . . . . 0.423 ' HB3' ' O ' ' A' ' 22' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' CGU . . . . . 0.71 ' CB ' HD22 ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.58 ' O ' ' CD1' ' A' ' 31' ' ' PHE . . . -66.17 -77.16 0.07 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 120.522 -1.361 . . . . 0.0 109.331 179.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -64.92 -14.71 60.7 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 120.672 -1.268 . . . . 0.0 111.008 -179.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' CGU . . . . . 0.461 ' HB3' ' HA ' ' A' ' 26' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.61 HG12 ' CD1' ' A' ' 31' ' ' PHE . 1.2 t -94.23 0.32 10.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.044 -1.035 . . . . 0.0 109.678 -179.18 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.712 ' CE2' ' HA ' ' A' ' 13' ' ' LEU . 7.4 m-85 -110.13 132.11 54.46 Favored 'General case' 0 C--N 1.295 -1.771 0 O-C-N 121.1 -1.0 . . . . 0.0 113.32 -177.239 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' CGU . . . . . 0.484 OE21 ' HA ' ' A' ' 32' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.835 ' OD1' HD21 ' A' ' 13' ' ' LEU . 69.7 m-20 -39.54 98.79 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.215 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.325 -178.682 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.513 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -77.37 -29.68 53.4 Favored 'General case' 0 C--N 1.305 -1.357 0 N-CA-C 106.869 -1.53 . . . . 0.0 106.869 177.556 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' CGU . . . . . 0.435 ' O ' ' C ' ' A' ' 36' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.672 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 22.4 mm-40 -48.21 -30.51 4.76 Favored 'General case' 0 C--O 1.202 -1.427 0 C-N-CA 118.245 -1.382 . . . . 0.0 108.753 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.66 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -47.14 -60.23 2.61 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 119.506 -1.996 . . . . 0.0 107.082 177.76 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.537 ' O ' ' C ' ' A' ' 39' ' ' CGU . 0.5 OUTLIER -82.18 -64.74 1.12 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.331 -0.856 . . . . 0.0 109.655 177.336 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' CGU . . . . . 0.537 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.672 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 19.8 t80 -43.7 -52.71 6.32 Favored 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 107.259 -1.386 . . . . 0.0 107.259 178.663 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.66 ' CD1' ' O ' ' A' ' 37' ' ' THR . 7.9 m95 -80.73 178.61 8.26 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 177.419 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.523 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 23.2 t 63.63 105.31 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.821 -1.175 . . . . 0.0 110.757 179.092 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.65 ' HD2' HG22 ' A' ' 65' ' ' ILE . 0.0 OUTLIER 79.21 14.17 1.1 Allowed 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.667 0.746 . . . . 0.0 108.988 179.514 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.529 ' CD1' ' O ' ' A' ' 44' ' ' TYR . 1.1 t80 -81.38 34.14 0.37 Allowed 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.417 -0.802 . . . . 0.0 110.208 179.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 2.1 mmmt -92.72 32.81 1.19 Allowed 'General case' 0 N--CA 1.489 1.506 0 O-C-N 120.932 -1.105 . . . . 0.0 109.217 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -116.33 3.39 13.34 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.329 -0.857 . . . . 0.0 109.539 -179.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.575 ' O ' ' CB ' ' A' ' 48' ' ' ASP . . . 88.4 -40.04 3.09 Favored Glycine 0 N--CA 1.494 2.547 0 N-CA-C 108.937 -1.665 . . . . 0.0 108.937 -179.418 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.645 ' CB ' HD12 ' A' ' 18' ' ' LEU . 5.5 p30 152.04 15.83 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.036 0 O-C-N 122.11 -0.641 . . . . 0.0 110.027 179.184 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.571 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 68.2 mm-40 69.72 -11.39 0.53 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.229 -0.919 . . . . 0.0 111.1 -179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.472 ' SG ' ' HD2' ' A' ' 54' ' ' PRO . 49.3 t -135.26 10.69 3.52 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 120.749 -1.22 . . . . 0.0 109.729 179.123 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.492 ' HB2' ' OD1' ' A' ' 48' ' ' ASP . 3.2 tt0 -58.58 -53.14 61.69 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.834 -1.166 . . . . 0.0 110.199 -179.86 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.478 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . -68.37 -3.81 34.09 Favored Glycine 0 N--CA 1.492 2.426 0 C-N-CA 120.257 -0.973 . . . . 0.0 110.776 -179.043 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.478 ' HB3' ' O ' ' A' ' 52' ' ' GLY . 5.2 t-160 68.32 70.18 0.43 Allowed Pre-proline 0 N--CA 1.492 1.657 0 O-C-N 120.942 -1.328 . . . . 0.0 109.363 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.495 ' CB ' ' CE2' ' A' ' 68' ' ' TYR . 5.8 Cg_exo -60.29 -38.25 76.74 Favored 'Trans proline' 0 C--N 1.308 -1.568 0 C-N-CA 122.599 2.199 . . . . 0.0 111.35 -179.701 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.482 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 1.8 m -78.07 172.52 13.39 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.217 -0.927 . . . . 0.0 109.891 -178.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.514 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.5 mt -149.47 -173.41 4.39 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.061 -1.024 . . . . 0.0 110.373 -179.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.597 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 2.1 m-80 41.79 63.55 1.28 Allowed 'General case' 0 C--N 1.303 -1.452 0 CA-C-O 121.855 0.836 . . . . 0.0 110.132 -179.619 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 47.98 33.53 3.49 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.376 -0.828 . . . . 0.0 109.856 177.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -78.74 143.67 26.95 Favored Glycine 0 N--CA 1.488 2.105 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.479 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 68.6 m80 -78.84 123.33 27.11 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 107.452 -1.314 . . . . 0.0 107.452 179.037 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.482 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 41.2 t -101.12 113.46 26.51 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.187 -0.946 . . . . 0.0 111.507 -177.635 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.507 ' HB3' ' OG1' ' A' ' 69' ' ' THR . 0.1 OUTLIER -79.55 -169.05 1.76 Allowed 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 105.955 -1.869 . . . . 0.0 105.955 176.762 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' BHD . . . . . 0.414 ' HA ' ' CB ' ' A' ' 68' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.528 ' O ' ' CG ' ' A' ' 49' ' ' GLN . . . 140.93 174.68 14.2 Favored Glycine 0 N--CA 1.488 2.103 0 N-CA-C 107.479 -2.249 . . . . 0.0 107.479 -178.456 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.65 HG22 ' HD2' ' A' ' 43' ' ' LYS . 19.3 mm -93.63 -61.6 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 120.609 -1.524 . . . . 0.0 109.8 -179.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.492 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . -47.63 -25.0 3.08 Favored Glycine 0 N--CA 1.488 2.111 0 N-CA-C 108.645 -1.782 . . . . 0.0 108.645 179.446 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.492 ' HB3' ' O ' ' A' ' 66' ' ' GLY . 3.3 p-10 176.78 -149.36 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.645 -0.915 . . . . 0.0 109.69 179.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.641 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 4.3 p90 -160.31 -167.09 1.82 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.37 -0.831 . . . . 0.0 109.248 -179.065 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.507 ' OG1' ' HB3' ' A' ' 62' ' ' LYS . 0.1 OUTLIER -144.96 171.63 14.18 Favored 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 107.829 -1.174 . . . . 0.0 107.829 178.651 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 20.6 m -136.27 -174.5 3.7 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 120.843 -1.161 . . . . 0.0 108.313 179.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.479 ' HB ' ' HB2' ' A' ' 60' ' ' HIS . 0.2 OUTLIER -160.54 150.85 18.1 Favored 'General case' 0 C--N 1.292 -1.909 0 O-C-N 121.518 -0.739 . . . . 0.0 109.249 179.478 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.53 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 88.3 m -120.95 124.86 45.94 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.114 -0.991 . . . . 0.0 109.133 179.712 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.868 ' HB3' ' CE1' ' A' ' 76' ' ' PHE . . . -57.13 -179.81 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.019 -1.051 . . . . 0.0 111.103 -179.27 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -77.26 100.97 6.04 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 123.425 1.583 . . . . 0.0 108.702 178.633 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . 0.487 ' HA2' ' OG1' ' A' ' 85' ' ' THR . . . 119.5 20.42 3.91 Favored Glycine 0 C--N 1.266 -3.309 0 CA-C-N 113.21 -1.814 . . . . 0.0 108.834 -178.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.868 ' CE1' ' HB3' ' A' ' 73' ' ' ALA . 6.5 m-85 -117.51 158.03 25.26 Favored 'General case' 0 C--N 1.296 -1.749 0 O-C-N 121.61 -0.935 . . . . 0.0 109.89 -178.036 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.607 ' HG2' HG23 ' A' ' 85' ' ' THR . 0.9 OUTLIER -160.08 163.33 33.97 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.18 -0.95 . . . . 0.0 110.487 -179.505 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 108.23 166.33 21.24 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 179.573 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.14 -39.42 72.24 Favored 'General case' 0 C--N 1.308 -1.216 0 O-C-N 121.167 -1.196 . . . . 0.0 109.17 179.716 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.514 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 70.8 m-20 -119.03 29.5 7.66 Favored 'General case' 0 C--N 1.292 -1.933 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 179.315 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.521 ' HB2' ' HB2' ' A' ' 57' ' ' ASN . 6.8 m 68.41 10.73 8.03 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.035 -1.041 . . . . 0.0 108.575 -179.13 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.461 ' C ' ' O ' ' A' ' 81' ' ' CYS . 22.1 tt0 -29.47 -45.45 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 CA-C-O 121.186 0.517 . . . . 0.0 112.232 -179.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.468 ' HB2' ' HG3' ' A' ' 77' ' ' GLU . 0.4 OUTLIER -101.41 -161.06 0.83 Allowed 'General case' 0 C--N 1.294 -1.832 0 CA-C-O 122.84 1.305 . . . . 0.0 109.834 -178.895 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.416 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 1.5 p -147.94 115.04 6.16 Favored 'General case' 0 C--N 1.278 -2.518 0 CA-C-N 114.23 -1.35 . . . . 0.0 108.877 179.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.607 HG23 ' HG2' ' A' ' 77' ' ' GLU . 18.2 p -63.44 -18.24 63.54 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.128 -0.983 . . . . 0.0 109.729 -179.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.1 ptt180 . . . . . 0 C--N 1.293 -1.87 0 CA-C-O 118.01 -0.995 . . . . 0.0 109.504 -179.987 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.457 ' O ' ' HB2' ' A' ' 2' ' ' ASN . . . . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 109.315 -0.624 . . . . 0.0 109.315 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.457 ' HB2' ' O ' ' A' ' 1' ' ' ALA . 0.5 OUTLIER 71.04 22.21 4.61 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.264 -0.897 . . . . 0.0 109.42 -179.891 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 88.1 p -146.49 74.17 1.35 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.243 -0.91 . . . . 0.0 109.467 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.506 ' C ' ' CD1' ' A' ' 4' ' ' PHE . 0.1 OUTLIER -80.6 24.49 0.47 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.261 -0.9 . . . . 0.0 110.749 -179.701 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.498 ' O ' HG13 ' A' ' 8' ' ' VAL . 0.1 OUTLIER -64.66 -36.31 83.86 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 120.72 -1.237 . . . . 0.0 109.362 -179.91 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' CGU . . . . . 0.469 OE12 ' HB3' ' A' ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' CGU . . . . . 0.469 ' HB3' OE12 ' A' ' 6' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.771 HG23 ' O ' ' A' ' 8' ' ' VAL . 4.2 m -39.72 99.95 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.184 0 CA-C-O 122.644 1.212 . . . . 0.0 109.424 -179.405 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.465 ' O ' ' HB3' ' A' ' 10' ' ' GLN . 3.5 tmtt? -39.89 -27.44 0.04 OUTLIER 'General case' 0 C--N 1.287 -2.147 0 CA-C-N 115.177 -0.92 . . . . 0.0 109.768 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.472 ' N ' ' O ' ' A' ' 8' ' ' VAL . 27.1 tt0 61.73 119.25 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.088 -1.007 . . . . 0.0 109.219 179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 178.41 -75.29 0.07 OUTLIER Glycine 0 N--CA 1.492 2.39 0 N-CA-C 110.003 -1.239 . . . . 0.0 110.003 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.458 ' OD1' ' HD2' ' A' ' 15' ' ' ARG . 1.0 OUTLIER -102.93 163.85 11.96 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.201 -1.176 . . . . 0.0 109.401 -179.781 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.792 HD23 ' CD1' ' A' ' 31' ' ' PHE . 4.3 mp -80.33 -125.85 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.23 0 O-C-N 121.099 -1.0 . . . . 0.0 109.747 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' CGU . . . . . 0.753 OE21 HD23 ' A' ' 18' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.55 ' NE ' ' HB3' ' A' ' 62' ' ' LYS . 82.5 mtt180 -46.32 -33.64 3.94 Favored 'General case' 0 N--CA 1.487 1.408 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 179.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.561 ' HA ' ' HB3' ' A' ' 22' ' ' CYS . 1.7 m -93.73 33.28 1.31 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.088 -1.008 . . . . 0.0 110.194 -179.662 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 1.043 HD13 ' O ' ' A' ' 18' ' ' LEU . 2.8 tm? -80.51 -16.29 54.63 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-O 121.943 0.878 . . . . 0.0 108.709 178.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -79.41 -0.69 33.93 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.161 -0.962 . . . . 0.0 109.918 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.561 ' HB3' ' HA ' ' A' ' 17' ' ' CYS . 7.0 t 179.33 158.87 0.64 Allowed 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.116 -0.99 . . . . 0.0 109.259 -179.762 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.538 ' O ' ' CB ' ' A' ' 17' ' ' CYS . 3.1 m -99.62 -161.5 0.88 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.964 -1.085 . . . . 0.0 110.721 -178.461 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.915 HD12 ' CZ3' ' A' ' 41' ' ' TRP . 3.9 mm? -94.27 -41.77 9.28 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.541 -0.724 . . . . 0.0 109.5 -179.702 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' CGU . . . . . 0.523 ' CD2' ' C ' ' A' ' 26' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.652 ' O ' ' CE1' ' A' ' 31' ' ' PHE . . . -57.03 -43.21 81.66 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.005 -1.059 . . . . 0.0 109.408 -179.678 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.449 ' CG ' HH11 ' A' ' 28' ' ' ARG . 0.0 OUTLIER -65.77 -22.5 66.59 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.658 -1.277 . . . . 0.0 109.752 -179.908 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 53.3 t -80.77 -41.2 19.62 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 O-C-N 121.542 -0.724 . . . . 0.0 109.964 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.792 ' CD1' HD23 ' A' ' 13' ' ' LEU . 0.1 OUTLIER -114.35 118.94 35.3 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 120.848 -1.158 . . . . 0.0 110.38 179.947 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' CGU . . . . . 0.46 ' O ' ' C ' ' A' ' 33' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.566 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 0.8 OUTLIER -39.46 126.02 1.77 Allowed 'General case' 0 C--N 1.304 -1.395 0 O-C-N 121.636 -0.665 . . . . 0.0 110.442 -178.609 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.522 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -80.32 -34.77 36.45 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 179.858 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.683 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 3.4 mm100 -53.18 -38.25 62.65 Favored 'General case' 0 C--O 1.203 -1.37 0 C-N-CA 118.369 -1.332 . . . . 0.0 107.834 178.36 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.688 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -40.28 -59.82 1.21 Allowed 'General case' 0 N--CA 1.502 2.133 0 O-C-N 120.203 -1.561 . . . . 0.0 107.787 178.812 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.634 ' O ' ' C ' ' A' ' 39' ' ' CGU . 0.5 OUTLIER -80.82 -67.71 0.75 Allowed 'General case' 0 C--N 1.297 -1.714 0 O-C-N 120.969 -1.082 . . . . 0.0 109.46 177.847 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' CGU . . . . . 0.634 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.683 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 14.9 t80 -39.9 -51.28 2.47 Favored 'General case' 0 C--N 1.297 -1.711 0 N-CA-C 109.356 -0.609 . . . . 0.0 109.356 178.278 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.915 ' CZ3' HD12 ' A' ' 24' ' ' LEU . 10.2 m95 -81.22 -68.78 0.66 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.933 -1.104 . . . . 0.0 112.427 -179.156 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.527 ' O ' ' CG ' ' A' ' 45' ' ' LYS . 0.3 OUTLIER -49.16 -53.25 21.94 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 120.65 -1.281 . . . . 0.0 111.476 -177.377 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.545 ' HG2' ' HB ' ' A' ' 65' ' ' ILE . 0.4 OUTLIER -62.74 -27.35 69.21 Favored 'General case' 0 C--N 1.283 -2.3 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 179.793 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.612 ' CA ' HG21 ' A' ' 65' ' ' ILE . 25.4 t80 -81.35 -95.63 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.381 0 O-C-N 121.425 -0.797 . . . . 0.0 108.857 179.368 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.556 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.0 OUTLIER 29.32 38.2 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.365 0 N-CA-C 107.826 -1.175 . . . . 0.0 107.826 -178.782 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.601 ' N ' ' O ' ' A' ' 44' ' ' TYR . 19.7 t0 -127.91 -18.89 4.13 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.672 -176.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.472 ' HA2' ' OH ' ' A' ' 44' ' ' TYR . . . 49.73 49.36 34.52 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 105.897 -2.881 . . . . 0.0 105.897 -177.338 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.502 ' O ' ' C ' ' A' ' 49' ' ' GLN . 15.1 t0 -117.31 -138.18 0.36 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 122.089 -0.653 . . . . 0.0 110.625 -177.245 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.64 ' O ' ' CB ' ' A' ' 50' ' ' CYS . 7.3 mt-30 24.0 80.15 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.893 0 CA-C-O 121.617 0.722 . . . . 0.0 111.487 -179.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.64 ' CB ' ' O ' ' A' ' 49' ' ' GLN . 50.5 t 112.8 -30.59 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 115.279 -0.873 . . . . 0.0 108.863 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.457 ' CB ' ' O ' ' A' ' 47' ' ' GLY . 1.4 tm-20 -61.47 -53.17 59.95 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.359 -0.838 . . . . 0.0 109.985 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.56 ' O ' ' CB ' ' A' ' 53' ' ' HIS . . . -61.28 -9.61 17.25 Favored Glycine 0 N--CA 1.493 2.474 0 N-CA-C 110.035 -1.226 . . . . 0.0 110.035 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.703 ' CE1' HD23 ' A' ' 56' ' ' LEU . 1.0 OUTLIER 80.74 53.73 0.1 Allowed Pre-proline 0 N--CA 1.486 1.355 0 O-C-N 121.372 -1.076 . . . . 0.0 110.193 179.563 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.548 ' CD ' ' N ' ' A' ' 53' ' ' HIS . 3.4 Cg_exo -57.91 -38.16 93.41 Favored 'Trans proline' 0 C--N 1.312 -1.377 0 C-N-CA 122.457 2.105 . . . . 0.0 109.731 178.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.45 ' O ' ' ND1' ' A' ' 53' ' ' HIS . 1.6 m -96.1 174.29 6.99 Favored 'General case' 0 C--N 1.298 -1.657 0 CA-C-O 121.157 0.503 . . . . 0.0 109.844 -178.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.703 HD23 ' CE1' ' A' ' 53' ' ' HIS . 5.1 mt -149.6 -174.78 4.78 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.114 -0.991 . . . . 0.0 110.309 -179.568 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.624 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 1.0 OUTLIER 45.54 62.18 2.29 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-O 121.769 0.795 . . . . 0.0 109.929 -179.578 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.45 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 1.8 mm100 49.94 28.04 2.68 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.55 -0.719 . . . . 0.0 110.653 177.193 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -65.57 132.77 35.2 Favored Glycine 0 N--CA 1.489 2.201 0 N-CA-C 109.012 -1.635 . . . . 0.0 109.012 179.555 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 57.7 t60 -79.07 136.28 37.12 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.106 -1.232 . . . . 0.0 108.288 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 70' ' ' CYS . 1.1 p -120.52 150.85 40.19 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 120.969 -1.082 . . . . 0.0 111.344 -178.373 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.55 ' HB3' ' NE ' ' A' ' 15' ' ' ARG . 8.3 mttp -124.11 97.16 5.22 Favored 'General case' 0 C--N 1.299 -1.614 0 N-CA-C 105.364 -2.087 . . . . 0.0 105.364 177.037 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' BHD . . . . . 0.525 ' N ' ' HG2' ' A' ' 15' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.521 ' O ' ' O ' ' A' ' 65' ' ' ILE . . . 162.14 114.54 0.33 Allowed Glycine 0 N--CA 1.483 1.797 0 N-CA-C 107.031 -2.428 . . . . 0.0 107.031 -179.583 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.824 ' O ' HD12 ' A' ' 65' ' ' ILE . 2.4 pp -35.63 154.14 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.96 0 CA-C-N 118.322 1.061 . . . . 0.0 110.016 -177.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.499 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . 103.47 -44.42 1.49 Allowed Glycine 0 N--CA 1.483 1.812 0 N-CA-C 104.432 -3.467 . . . . 0.0 104.432 -176.104 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.499 ' HB3' ' O ' ' A' ' 66' ' ' GLY . 5.2 p-10 171.81 -152.35 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 176.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.61 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 6.4 p90 -158.43 115.05 2.79 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 -179.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.502 ' OG1' ' HB2' ' A' ' 62' ' ' LYS . 76.8 p -79.67 115.11 19.1 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 120.659 -1.275 . . . . 0.0 109.438 -178.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 0.508 ' HA ' ' HA ' ' A' ' 61' ' ' CYS . 0.0 OUTLIER -103.12 -172.54 2.13 Favored 'General case' 0 C--N 1.304 -1.384 0 O-C-N 121.195 -0.94 . . . . 0.0 109.303 179.814 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 7.8 m -162.03 131.4 4.49 Favored 'General case' 0 C--N 1.291 -1.976 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 179.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.537 ' HB3' ' CB ' ' A' ' 76' ' ' PHE . 94.1 m -82.05 116.49 21.67 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.832 -1.167 . . . . 0.0 108.569 179.152 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.887 ' HB3' ' CD1' ' A' ' 76' ' ' PHE . . . -43.67 172.56 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.014 -1.054 . . . . 0.0 111.319 -179.075 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -74.02 100.41 3.57 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-O 123.583 1.659 . . . . 0.0 108.586 178.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . 0.552 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 118.96 28.96 1.92 Allowed Glycine 0 C--N 1.264 -3.47 0 N-CA-C 108.066 -2.013 . . . . 0.0 108.066 -178.284 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.887 ' CD1' ' HB3' ' A' ' 73' ' ' ALA . 17.7 m-85 -128.0 148.78 50.54 Favored 'General case' 0 C--N 1.296 -1.759 0 O-C-N 121.833 -0.804 . . . . 0.0 110.367 -178.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.757 ' HB2' HG23 ' A' ' 85' ' ' THR . 0.7 OUTLIER -152.58 166.55 31.69 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.252 -0.905 . . . . 0.0 110.514 -179.73 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 109.24 163.97 20.15 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.476 -1.45 . . . . 0.0 109.476 179.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.6 tptt -57.84 -33.61 68.83 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 121.113 -1.228 . . . . 0.0 109.106 179.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.506 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.4 OUTLIER -121.9 27.76 7.93 Favored 'General case' 0 C--N 1.291 -1.963 0 N-CA-C 108.639 -0.874 . . . . 0.0 108.639 179.644 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.515 ' O ' ' HB2' ' A' ' 57' ' ' ASN . 4.7 m 62.53 14.24 6.87 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 108.137 -1.06 . . . . 0.0 108.137 -178.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.448 ' C ' ' O ' ' A' ' 81' ' ' CYS . 45.9 tt0 -33.54 -36.94 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.323 0 O-C-N 121.666 -0.646 . . . . 0.0 111.923 -179.101 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.475 ' O ' ' OD1' ' A' ' 57' ' ' ASN . 1.3 m-85 -106.19 -166.49 1.2 Allowed 'General case' 0 C--N 1.294 -1.808 0 CA-C-O 122.809 1.29 . . . . 0.0 109.492 -179.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.498 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 0.7 OUTLIER -138.82 107.27 5.83 Favored 'General case' 0 C--N 1.275 -2.659 0 CA-C-N 114.415 -1.266 . . . . 0.0 109.113 -179.871 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.757 HG23 ' HB2' ' A' ' 77' ' ' GLU . 2.4 p -62.36 96.49 0.08 Allowed 'General case' 0 C--N 1.302 -1.464 0 O-C-N 120.913 -1.117 . . . . 0.0 110.032 -179.633 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.527 ' HG2' ' NH1' ' A' ' 86' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.294 -1.829 0 CA-C-O 118.052 -0.975 . . . . 0.0 110.099 179.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.424 ' O ' ' C ' ' A' ' 2' ' ' ASN . . . . . . . . 0 N--CA 1.49 1.57 0 N-CA-C 109.539 -0.541 . . . . 0.0 109.539 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.424 ' C ' ' O ' ' A' ' 1' ' ' ALA . 0.9 OUTLIER 44.07 54.13 6.1 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.242 -0.911 . . . . 0.0 109.461 -179.996 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.481 ' O ' ' CD2' ' A' ' 6' ' ' CGU . 0.6 OUTLIER -86.42 125.23 33.54 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.308 -0.87 . . . . 0.0 109.699 -179.896 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.537 ' CZ ' OE21 ' A' ' 26' ' ' CGU . 0.0 OUTLIER -72.63 -20.13 61.33 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.304 -0.873 . . . . 0.0 108.901 179.693 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.859 ' O ' HG13 ' A' ' 8' ' ' VAL . 0.1 OUTLIER -75.5 -10.77 59.74 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.238 -0.914 . . . . 0.0 109.442 179.924 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' CGU . . . . . 0.519 ' CD1' ' C ' ' A' ' 6' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' CGU . . . . . 0.484 ' O ' ' N ' ' A' ' 9' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.859 HG13 ' O ' ' A' ' 5' ' ' LEU . 5.5 m -42.79 98.83 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.306 -1.299 0 CA-C-O 122.528 1.156 . . . . 0.0 109.488 -179.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.492 ' O ' ' HB3' ' A' ' 10' ' ' GLN . 0.8 OUTLIER -41.53 -27.29 0.09 Allowed 'General case' 0 C--N 1.286 -2.192 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.251 179.935 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.492 ' HB3' ' O ' ' A' ' 9' ' ' LYS . 15.9 tt0 67.54 77.41 0.26 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.515 -0.741 . . . . 0.0 110.006 179.531 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.427 ' O ' ' CG ' ' A' ' 12' ' ' ASN . . . 128.71 94.34 0.78 Allowed Glycine 0 N--CA 1.49 2.286 0 N-CA-C 110.003 -1.239 . . . . 0.0 110.003 179.602 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.72 ' O ' HG21 ' A' ' 30' ' ' VAL . 6.0 m-20 174.84 142.17 0.05 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.253 -1.145 . . . . 0.0 109.169 179.47 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.51 HD12 ' N ' ' A' ' 13' ' ' LEU . 4.8 mp -109.07 -146.69 0.41 Allowed 'General case' 0 N--CA 1.478 0.93 0 O-C-N 120.576 -1.327 . . . . 0.0 110.725 -179.134 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' CGU . . . . . 0.502 OE12 ' O ' ' A' ' 48' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.3 mtp180 -66.79 -43.23 84.46 Favored 'General case' 0 C--N 1.297 -1.694 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 179.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' CGU . . . . . 0.583 ' CB ' ' HB3' ' A' ' 12' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.831 ' O ' ' HB3' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -53.02 -50.95 63.19 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.535 -0.728 . . . . 0.0 109.29 -179.559 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.619 ' C ' HD12 ' A' ' 18' ' ' LEU . 0.3 OUTLIER 57.68 -88.79 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.394 -0.816 . . . . 0.0 109.998 179.864 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' CGU . . . . . 0.504 ' O ' ' SG ' ' A' ' 22' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.831 ' HB3' ' O ' ' A' ' 17' ' ' CYS . . . -63.8 -16.13 60.48 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.36 -0.837 . . . . 0.0 109.172 179.79 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.517 ' HB3' ' HB2' ' A' ' 17' ' ' CYS . 1.0 OUTLIER -113.37 173.98 6.14 Favored 'General case' 0 N--CA 1.496 1.827 0 C-N-CA 119.656 -0.818 . . . . 0.0 109.412 179.281 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.614 ' O ' ' HB2' ' A' ' 24' ' ' LEU . 29.7 t -121.84 14.33 10.8 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.227 -0.92 . . . . 0.0 109.461 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.702 HD22 ' N ' ' A' ' 24' ' ' LEU . 3.5 mm? 78.43 -37.97 0.23 Allowed 'General case' 0 N--CA 1.503 2.195 0 O-C-N 122.162 -0.336 . . . . 0.0 110.61 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' CGU . . . . . 0.537 OE21 ' CZ ' ' A' ' 4' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.664 ' O ' HG12 ' A' ' 30' ' ' VAL . . . -62.75 -43.28 99.21 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.189 -0.944 . . . . 0.0 109.626 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.44 ' CG ' HH11 ' A' ' 28' ' ' ARG . 0.0 OUTLIER -57.19 -53.0 63.02 Favored 'General case' 0 N--CA 1.49 1.557 0 CA-C-O 122.309 1.052 . . . . 0.0 110.105 -179.568 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.72 HG21 ' O ' ' A' ' 12' ' ' ASN . 0.3 OUTLIER -87.72 -41.0 14.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 120.935 -1.103 . . . . 0.0 110.763 -178.896 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.648 ' CE2' ' CE2' ' A' ' 40' ' ' PHE . 0.1 OUTLIER -135.8 124.16 23.34 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.474 -1.391 . . . . 0.0 111.626 -179.784 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.574 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 6.8 m-20 -39.35 127.49 1.81 Allowed 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.662 -0.649 . . . . 0.0 111.417 -177.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.507 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -80.71 -30.02 36.37 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 178.582 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' CGU . . . . . 0.401 ' O ' ' C ' ' A' ' 36' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.662 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 11.1 mm100 -50.01 -41.37 47.03 Favored 'General case' 0 C--O 1.203 -1.37 0 C-N-CA 118.802 -1.159 . . . . 0.0 108.01 178.347 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.64 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.1 OUTLIER -40.88 -59.1 1.51 Allowed 'General case' 0 N--CA 1.498 1.943 0 C-N-CA 118.23 -1.388 . . . . 0.0 108.631 179.31 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.595 ' O ' ' C ' ' A' ' 39' ' ' CGU . 0.8 OUTLIER -80.95 -65.91 0.95 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.043 -1.036 . . . . 0.0 110.196 178.796 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' CGU . . . . . 0.595 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.662 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 10.0 t80 -39.9 -50.01 2.45 Favored 'General case' 0 C--N 1.296 -1.758 0 O-C-N 121.956 -0.465 . . . . 0.0 109.928 178.363 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.64 ' CD1' ' O ' ' A' ' 37' ' ' THR . 9.4 m95 -81.3 -69.32 0.62 Allowed 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.522 -0.736 . . . . 0.0 112.802 -178.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.489 ' OG ' ' N ' ' A' ' 43' ' ' LYS . 0.1 OUTLIER -42.89 -73.74 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.026 0 O-C-N 120.831 -1.168 . . . . 0.0 112.646 -176.906 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.55 ' HD2' ' CG2' ' A' ' 65' ' ' ILE . 1.4 ptpt -78.2 31.88 0.18 Allowed 'General case' 0 C--N 1.287 -2.113 0 O-C-N 121.649 -0.657 . . . . 0.0 110.57 -178.509 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.59 ' HB2' ' O ' ' A' ' 40' ' ' PHE . 0.8 OUTLIER -80.26 23.37 0.49 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.014 -1.054 . . . . 0.0 110.693 179.747 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -90.21 31.92 0.97 Allowed 'General case' 0 N--CA 1.488 1.46 0 O-C-N 120.776 -1.202 . . . . 0.0 108.619 179.059 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.52 ' OD2' ' NE2' ' A' ' 49' ' ' GLN . 1.6 t0 -111.12 4.12 19.09 Favored 'General case' 0 N--CA 1.487 1.381 0 O-C-N 121.464 -0.773 . . . . 0.0 109.827 -179.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.546 ' O ' ' CB ' ' A' ' 48' ' ' ASP . . . 69.42 16.13 71.17 Favored Glycine 0 N--CA 1.492 2.395 0 N-CA-C 108.577 -1.809 . . . . 0.0 108.577 -179.086 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.584 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER 83.58 7.96 0.64 Allowed 'General case' 0 N--CA 1.501 2.106 0 O-C-N 121.779 -0.836 . . . . 0.0 109.527 -179.815 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.631 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 33.7 mm-40 72.33 -21.91 0.22 Allowed 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.462 -0.774 . . . . 0.0 111.838 179.273 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.497 ' O ' ' HD3' ' A' ' 54' ' ' PRO . 25.1 t -105.97 -20.05 13.55 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 120.426 -1.421 . . . . 0.0 109.436 179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.486 ' HB2' ' O ' ' A' ' 47' ' ' GLY . 72.5 tt0 -49.83 136.45 17.97 Favored 'General case' 0 N--CA 1.485 1.281 0 O-C-N 121.088 -1.007 . . . . 0.0 109.073 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 100.0 -11.9 60.59 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 110.094 -1.203 . . . . 0.0 110.094 179.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.452 ' CD2' ' O ' ' A' ' 55' ' ' CYS . 3.8 t-160 60.82 65.74 1.96 Allowed Pre-proline 0 N--CA 1.491 1.582 0 O-C-N 121.088 -1.242 . . . . 0.0 109.436 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.497 ' HD3' ' O ' ' A' ' 50' ' ' CYS . 5.7 Cg_exo -58.86 -38.57 87.78 Favored 'Trans proline' 0 C--N 1.308 -1.558 0 C-N-CA 122.415 2.077 . . . . 0.0 110.751 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.466 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 1.8 m -72.4 172.45 10.39 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.353 -0.842 . . . . 0.0 109.233 -179.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.487 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 4.7 mt -144.88 -174.99 4.5 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.238 -0.914 . . . . 0.0 109.934 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.614 ' O ' ' CD2' ' A' ' 76' ' ' PHE . 1.0 OUTLIER 44.76 61.9 2.29 Favored 'General case' 0 C--N 1.302 -1.49 0 CA-C-O 121.666 0.746 . . . . 0.0 109.538 -179.857 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.455 ' HG3' ' C ' ' A' ' 57' ' ' ASN . 1.4 mt-30 45.18 33.84 1.24 Allowed 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.232 -0.917 . . . . 0.0 109.387 177.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -80.27 152.28 34.12 Favored Glycine 0 N--CA 1.489 2.182 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 -179.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.467 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 0.0 OUTLIER -79.85 169.31 18.1 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.337 -1.096 . . . . 0.0 108.631 179.502 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.466 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 19.2 t -140.72 125.87 18.51 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.024 -1.047 . . . . 0.0 110.125 -179.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.529 ' O ' ' HB2' ' A' ' 68' ' ' TYR . 0.1 OUTLIER -109.12 -175.95 2.9 Favored 'General case' 0 N--CA 1.486 1.375 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 178.148 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' BHD . . . . . 0.453 ' OD1' OE12 ' A' ' 14' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.557 ' O ' ' N ' ' A' ' 66' ' ' GLY . . . 144.5 41.97 0.05 OUTLIER Glycine 0 N--CA 1.49 2.262 0 N-CA-C 110.026 -1.23 . . . . 0.0 110.026 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.698 HG22 ' N ' ' A' ' 66' ' ' GLY . 2.2 mm 47.67 -86.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 121.432 -1.04 . . . . 0.0 110.081 -179.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.698 ' N ' HG22 ' A' ' 65' ' ' ILE . . . -31.26 -38.24 0.03 OUTLIER Glycine 0 N--CA 1.5 2.938 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.517 ' N ' ' O ' ' A' ' 65' ' ' ILE . 5.0 p-10 -175.29 -150.42 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.393 -1.063 . . . . 0.0 109.549 178.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.644 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 1.8 p90 -160.38 139.16 10.43 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.198 -0.939 . . . . 0.0 109.606 -178.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.494 ' O ' ' HD3' ' A' ' 62' ' ' LYS . 50.1 p -104.64 120.14 40.63 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.11 -0.994 . . . . 0.0 109.341 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 6.9 m -79.33 -166.64 0.99 Allowed 'General case' 0 C--N 1.303 -1.419 0 O-C-N 120.663 -1.273 . . . . 0.0 108.82 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.467 ' HB ' ' HB2' ' A' ' 60' ' ' HIS . 4.7 m -160.37 159.3 30.97 Favored 'General case' 0 C--N 1.288 -2.084 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.55 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 87.2 m -125.65 123.04 38.1 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.026 -1.046 . . . . 0.0 109.484 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.835 ' HB3' ' CD1' ' A' ' 76' ' ' PHE . . . -50.34 -176.15 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.073 -1.017 . . . . 0.0 110.757 -179.52 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -81.03 102.11 9.98 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-O 123.067 1.413 . . . . 0.0 107.869 178.344 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . 0.495 ' HA2' ' OG1' ' A' ' 85' ' ' THR . . . 117.37 21.21 4.47 Favored Glycine 0 C--N 1.267 -3.283 0 N-CA-C 108.583 -1.807 . . . . 0.0 108.583 -178.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.835 ' CD1' ' HB3' ' A' ' 73' ' ' ALA . 8.3 m-85 -119.8 157.32 28.88 Favored 'General case' 0 C--N 1.297 -1.692 0 O-C-N 121.632 -0.922 . . . . 0.0 110.156 -177.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.553 ' HG2' ' N ' ' A' ' 85' ' ' THR . 0.6 OUTLIER -160.17 163.03 33.98 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.048 -1.032 . . . . 0.0 110.955 -179.25 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 109.84 166.03 19.83 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.352 -1.499 . . . . 0.0 109.352 179.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.64 -34.82 69.74 Favored 'General case' 0 C--N 1.306 -1.313 0 O-C-N 121.155 -1.203 . . . . 0.0 109.12 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.487 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.7 OUTLIER -121.84 27.07 8.32 Favored 'General case' 0 C--N 1.291 -1.962 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 179.363 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.513 ' HA ' ' O ' ' A' ' 77' ' ' GLU . 7.1 m 65.99 10.63 7.13 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.23 -0.919 . . . . 0.0 109.198 -179.539 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.542 ' HB3' ' CE1' ' A' ' 83' ' ' PHE . 28.5 tt0 -32.78 -43.03 0.09 Allowed 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.868 -0.52 . . . . 0.0 111.821 -179.499 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.562 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -99.6 -160.3 0.79 Allowed 'General case' 0 C--N 1.296 -1.742 0 CA-C-O 122.864 1.316 . . . . 0.0 109.738 -179.043 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.522 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 1.0 OUTLIER -148.43 123.02 9.8 Favored 'General case' 0 C--N 1.278 -2.53 0 CA-C-N 114.314 -1.312 . . . . 0.0 109.051 179.603 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.553 ' N ' ' HG2' ' A' ' 77' ' ' GLU . 14.2 p -69.38 -16.23 63.47 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.205 -0.934 . . . . 0.0 109.656 -179.56 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.406 ' OXT' ' O ' ' A' ' 85' ' ' THR . 1.5 mtt180 . . . . . 0 C--N 1.295 -1.798 0 CA-C-O 118.03 -0.986 . . . . 0.0 109.588 179.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.546 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.402 ' O ' ' CB ' ' A' ' 3' ' ' SER . 4.5 p30 -148.2 124.76 11.05 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.25 -0.906 . . . . 0.0 109.677 179.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.402 ' CB ' ' O ' ' A' ' 2' ' ' ASN . 0.4 OUTLIER 171.15 45.12 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.284 -0.885 . . . . 0.0 109.304 179.96 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.569 ' CE1' ' O ' ' A' ' 21' ' ' ALA . 1.5 p90 -80.2 7.89 8.43 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.249 -0.907 . . . . 0.0 109.577 179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.741 HD11 ' CB ' ' A' ' 23' ' ' SER . 1.0 OUTLIER -71.33 -24.01 62.03 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 120.999 -1.063 . . . . 0.0 108.963 -179.826 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' CGU . . . . . 0.487 ' C ' ' O ' ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' CGU . . . . . 0.428 ' O ' ' C ' ' A' ' 8' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.756 HG23 ' O ' ' A' ' 8' ' ' VAL . 2.7 m -39.68 102.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 CA-C-O 122.706 1.241 . . . . 0.0 109.489 -178.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.551 ' O ' ' CG ' ' A' ' 10' ' ' GLN . 27.5 mttp -45.1 -20.28 0.04 OUTLIER 'General case' 0 C--N 1.284 -2.245 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.531 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.551 ' CG ' ' O ' ' A' ' 9' ' ' LYS . 19.3 pt20 42.3 53.09 4.55 Favored 'General case' 0 N--CA 1.483 1.223 0 O-C-N 121.079 -1.013 . . . . 0.0 109.825 179.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -131.5 144.91 16.57 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 109.927 -1.269 . . . . 0.0 109.927 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.623 ' O ' HG11 ' A' ' 30' ' ' VAL . 5.5 m120 60.92 152.89 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.521 -0.988 . . . . 0.0 110.111 179.734 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.78 HD23 ' HB3' ' A' ' 31' ' ' PHE . 3.2 mp -75.42 -97.19 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.164 0 O-C-N 121.084 -1.01 . . . . 0.0 110.582 -179.447 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' CGU . . . . . 0.514 OE11 ' N ' ' A' ' 15' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.514 ' N ' OE11 ' A' ' 14' ' ' CGU . 4.0 mtt180 -62.92 -22.46 66.77 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 120.512 -1.368 . . . . 0.0 109.927 -179.39 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' CGU . . . . . 0.903 ' O ' ' HB3' ' A' ' 21' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.548 ' HA ' ' HB3' ' A' ' 22' ' ' CYS . 1.6 t -100.9 1.07 39.55 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.998 -1.064 . . . . 0.0 109.52 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.74 HD21 ' HB2' ' A' ' 48' ' ' ASP . 0.4 OUTLIER -64.43 -15.57 60.85 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 120.526 -1.359 . . . . 0.0 110.197 179.56 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' CGU . . . . . 0.417 ' C ' ' H ' ' A' ' 21' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.903 ' HB3' ' O ' ' A' ' 16' ' ' CGU . . . -76.2 6.53 5.3 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.387 -0.821 . . . . 0.0 110.804 -179.171 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.548 ' HB3' ' HA ' ' A' ' 17' ' ' CYS . 11.9 p -139.68 -150.62 0.33 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.704 -1.247 . . . . 0.0 110.803 -179.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.913 ' O ' HD22 ' A' ' 24' ' ' LEU . 47.1 t -166.52 -70.5 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 179.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.913 HD22 ' O ' ' A' ' 23' ' ' SER . 0.2 OUTLIER -152.48 -82.06 0.09 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.276 -0.89 . . . . 0.0 109.726 179.824 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' CGU . . . . . 0.654 ' HG ' ' HN2' ' A' ' 26' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' CGU . . . . . 0.654 ' HN2' ' HG ' ' A' ' 25' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.595 ' O ' ' CE1' ' A' ' 31' ' ' PHE . . . -76.92 -46.31 24.73 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 120.874 -1.142 . . . . 0.0 110.242 -179.589 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.683 HH22 HD12 ' A' ' 24' ' ' LEU . 0.0 OUTLIER -73.57 3.68 5.92 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 120.59 -1.318 . . . . 0.0 110.396 179.569 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' CGU . . . . . 0.433 OE12 OE11 ' A' ' 25' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.623 HG11 ' O ' ' A' ' 12' ' ' ASN . 58.8 t -106.15 -50.01 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 120.714 -1.241 . . . . 0.0 110.833 -179.719 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.78 ' HB3' HD23 ' A' ' 13' ' ' LEU . 0.0 OUTLIER -107.89 146.91 31.68 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 120.713 -1.242 . . . . 0.0 112.233 -178.993 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' CGU . . . . . 0.418 ' O ' ' C ' ' A' ' 33' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.828 ' O ' HG23 ' A' ' 37' ' ' THR . 51.3 p-10 -38.73 101.25 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.544 0 CA-C-O 121.759 0.79 . . . . 0.0 111.795 -177.293 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.563 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -80.28 -25.4 39.45 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 107.722 -1.214 . . . . 0.0 107.722 178.143 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.647 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 81.1 mt-30 -51.61 -38.59 55.29 Favored 'General case' 0 C--O 1.203 -1.393 0 O-C-N 120.947 -1.095 . . . . 0.0 108.299 178.481 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.828 HG23 ' O ' ' A' ' 33' ' ' ASP . 1.0 OUTLIER -42.26 -57.46 2.54 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 120.292 -1.505 . . . . 0.0 107.774 179.061 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.63 ' O ' ' C ' ' A' ' 39' ' ' CGU . 1.9 t70 -80.85 -69.19 0.62 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 120.875 -1.141 . . . . 0.0 108.666 176.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' CGU . . . . . 0.63 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.647 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 14.2 t80 -39.56 -52.44 2.18 Favored 'General case' 0 C--N 1.295 -1.765 0 O-C-N 121.923 -0.485 . . . . 0.0 110.008 178.474 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.676 ' CD1' ' O ' ' A' ' 37' ' ' THR . 7.7 m95 -77.64 -66.0 0.89 Allowed 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.563 -0.71 . . . . 0.0 112.648 -178.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.496 ' OG ' ' N ' ' A' ' 43' ' ' LYS . 0.1 OUTLIER -42.55 -73.4 0.05 OUTLIER 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.738 -1.226 . . . . 0.0 112.223 -177.344 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.602 ' HD2' HG23 ' A' ' 65' ' ' ILE . 0.0 OUTLIER -81.32 35.9 0.4 Allowed 'General case' 0 C--N 1.286 -2.162 0 O-C-N 121.544 -0.723 . . . . 0.0 109.814 -178.874 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.578 ' CE1' ' OD1' ' A' ' 48' ' ' ASP . 0.6 OUTLIER -80.03 12.9 2.5 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.135 -0.978 . . . . 0.0 110.695 -179.709 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 4.6 mttm -86.77 55.01 3.37 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 120.964 -1.085 . . . . 0.0 108.377 179.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.2 t0 -131.64 4.5 4.25 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.501 -0.749 . . . . 0.0 110.128 -178.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.558 ' O ' ' CB ' ' A' ' 51' ' ' GLU . . . 72.49 29.23 66.21 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 108.606 -1.798 . . . . 0.0 108.606 -179.308 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.74 ' HB2' HD21 ' A' ' 18' ' ' LEU . 0.0 OUTLIER 46.58 21.57 0.14 Allowed 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.482 -1.01 . . . . 0.0 110.329 -179.868 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.639 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 33.2 mm-40 59.06 -92.29 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.453 0 O-C-N 120.973 -1.079 . . . . 0.0 111.157 178.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.511 ' CB ' ' OB ' ' A' ' 63' ' ' BHD . 36.5 t -45.87 -25.64 0.56 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.183 -0.948 . . . . 0.0 110.862 -178.768 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.558 ' CB ' ' O ' ' A' ' 47' ' ' GLY . 20.1 tt0 -49.43 148.55 2.67 Favored 'General case' 0 N--CA 1.485 1.312 0 O-C-N 120.577 -1.327 . . . . 0.0 108.708 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.465 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . 90.8 -15.92 59.47 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 110.078 -1.209 . . . . 0.0 110.078 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.472 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 30.7 t60 65.03 64.26 1.06 Allowed Pre-proline 0 N--CA 1.493 1.72 0 O-C-N 121.144 -1.209 . . . . 0.0 109.599 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.499 ' HD3' ' O ' ' A' ' 50' ' ' CYS . 4.9 Cg_exo -61.19 -39.5 58.08 Favored 'Trans proline' 0 C--N 1.31 -1.5 0 C-N-CA 122.604 2.203 . . . . 0.0 110.604 179.843 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.464 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 1.8 m -71.51 173.05 8.48 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.381 -0.824 . . . . 0.0 109.304 -179.576 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.565 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.6 mt -146.6 -176.84 5.34 Favored 'General case' 0 N--CA 1.492 1.635 0 CA-C-O 122.231 1.015 . . . . 0.0 109.906 179.466 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.615 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 1.6 m120 45.84 61.33 2.7 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 115.461 -0.79 . . . . 0.0 109.513 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.411 ' HG3' ' C ' ' A' ' 57' ' ' ASN . 3.4 mt-30 46.54 33.36 1.96 Allowed 'General case' 0 C--N 1.299 -1.591 0 C-N-CA 119.468 -0.893 . . . . 0.0 109.384 177.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -73.93 145.71 35.53 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.669 -1.373 . . . . 0.0 109.669 -179.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.468 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 1.3 t60 -79.91 115.8 19.7 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.208 -1.172 . . . . 0.0 109.021 179.701 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.464 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 44.5 t -91.92 134.37 34.85 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.102 -0.999 . . . . 0.0 110.092 -179.438 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.508 ' HB2' ' O ' ' A' ' 69' ' ' THR . 2.1 tttp -117.74 115.08 24.31 Favored 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 106.919 -1.511 . . . . 0.0 106.919 178.237 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' BHD . . . . . 0.74 ' OD1' HD13 ' A' ' 18' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.513 ' O ' ' O ' ' A' ' 67' ' ' ASP . . . 147.69 138.32 3.06 Favored Glycine 0 N--CA 1.488 2.161 0 N-CA-C 107.71 -2.156 . . . . 0.0 107.71 -179.243 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.602 HG23 ' HD2' ' A' ' 43' ' ' LYS . 0.4 OUTLIER -53.31 -61.98 0.75 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.587 0 O-C-N 120.461 -1.611 . . . . 0.0 109.216 -179.088 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.58 ' N ' HG22 ' A' ' 65' ' ' ILE . . . -43.68 -38.46 4.26 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 110.029 -1.228 . . . . 0.0 110.029 -179.469 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.523 ' OD1' ' N ' ' A' ' 68' ' ' TYR . 1.6 p30 179.29 -157.16 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.255 -1.144 . . . . 0.0 110.094 179.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.647 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 3.1 p90 -150.66 124.84 9.39 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.121 -0.987 . . . . 0.0 108.919 -178.82 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.508 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 70.3 p -95.34 119.33 33.67 Favored 'General case' 0 C--N 1.304 -1.383 0 O-C-N 120.898 -1.126 . . . . 0.0 109.201 -179.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 9.5 m -79.11 -171.46 2.67 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.664 -1.273 . . . . 0.0 108.382 179.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.468 ' HB ' ' HB3' ' A' ' 60' ' ' HIS . 5.1 m -161.19 145.1 13.21 Favored 'General case' 0 C--N 1.285 -2.198 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 179.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.5 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 73.8 m -109.06 118.34 36.53 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.176 -0.953 . . . . 0.0 108.974 179.579 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.908 ' HB3' ' CD1' ' A' ' 76' ' ' PHE . . . -47.89 -178.02 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.066 -1.021 . . . . 0.0 110.42 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 4.6 tt0 -80.51 100.67 8.67 Favored 'General case' 0 C--N 1.306 -1.286 0 CA-C-O 123.2 1.476 . . . . 0.0 108.065 178.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . 0.46 ' O ' ' OG1' ' A' ' 85' ' ' THR . . . 119.17 18.5 4.58 Favored Glycine 0 C--N 1.269 -3.148 0 CA-C-N 113.575 -1.648 . . . . 0.0 108.994 -179.208 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.908 ' CD1' ' HB3' ' A' ' 73' ' ' ALA . 4.8 m-85 -115.58 160.07 20.46 Favored 'General case' 0 C--N 1.294 -1.813 0 O-C-N 121.372 -1.076 . . . . 0.0 109.726 -178.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.647 ' OE2' HG22 ' A' ' 85' ' ' THR . 19.3 pt-20 -160.72 167.26 27.26 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.158 -0.964 . . . . 0.0 110.304 -179.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 108.28 166.68 21.22 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 110.105 -1.198 . . . . 0.0 110.105 178.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -54.39 -47.49 72.66 Favored 'General case' 0 C--N 1.307 -1.251 0 O-C-N 121.371 -1.076 . . . . 0.0 109.638 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.565 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 2.9 m-20 -111.79 32.57 5.36 Favored 'General case' 0 C--N 1.287 -2.129 0 N-CA-C 107.767 -1.197 . . . . 0.0 107.767 179.272 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.492 ' O ' ' HB2' ' A' ' 57' ' ' ASN . 3.3 m 52.27 67.82 0.92 Allowed 'General case' 0 C--N 1.302 -1.488 0 N-CA-C 105.67 -1.974 . . . . 0.0 105.67 -177.215 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.433 ' C ' ' OD1' ' A' ' 57' ' ' ASN . 37.9 tt0 -103.52 -25.2 13.31 Favored 'General case' 0 C--N 1.306 -1.29 0 O-C-N 121.589 -0.694 . . . . 0.0 111.067 -176.558 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.632 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -99.53 74.84 1.91 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 120.898 -1.126 . . . . 0.0 109.212 -179.827 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.444 ' C ' ' O ' ' A' ' 83' ' ' PHE . 0.3 OUTLIER -43.66 94.97 0.01 OUTLIER 'General case' 0 C--N 1.293 -1.862 0 C-N-CA 119.697 -0.801 . . . . 0.0 109.521 -179.82 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.647 HG22 ' OE2' ' A' ' 77' ' ' GLU . 5.8 p -68.38 -11.69 59.98 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.339 -0.851 . . . . 0.0 109.822 -179.639 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.439 ' OXT' ' O ' ' A' ' 85' ' ' THR . 3.5 mtp180 . . . . . 0 C--N 1.299 -1.605 0 CA-C-O 118.034 -0.984 . . . . 0.0 109.936 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.497 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -143.85 86.54 1.87 Allowed 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.242 -0.911 . . . . 0.0 109.648 -179.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 19.6 t -80.9 155.33 26.57 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.275 -0.891 . . . . 0.0 109.145 179.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.558 ' CE2' ' HA ' ' A' ' 22' ' ' CYS . 6.3 p90 -77.06 -2.75 35.68 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.167 -0.958 . . . . 0.0 109.408 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.511 ' O ' ' C ' ' A' ' 6' ' ' CGU . 0.4 OUTLIER -66.04 -36.35 83.0 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.236 -0.915 . . . . 0.0 109.532 -179.907 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' CGU . . . . . 0.587 ' HN2' ' CD2' ' A' ' 6' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' CGU . . . . . 0.485 ' O ' ' N ' ' A' ' 9' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.784 HG23 ' O ' ' A' ' 8' ' ' VAL . 11.4 m -39.54 97.71 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.307 -1.256 0 CA-C-O 122.402 1.096 . . . . 0.0 110.037 -178.872 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.51 ' O ' ' N ' ' A' ' 11' ' ' GLY . 8.1 tptt -47.5 92.68 0.01 OUTLIER 'General case' 0 C--N 1.285 -2.239 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 179.505 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.531 ' N ' ' O ' ' A' ' 8' ' ' VAL . 0.9 OUTLIER -39.04 94.56 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.54 -0.725 . . . . 0.0 110.005 -179.037 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.51 ' N ' ' O ' ' A' ' 9' ' ' LYS . . . 81.73 131.83 1.38 Allowed Glycine 0 N--CA 1.493 2.445 0 N-CA-C 109.727 -1.349 . . . . 0.0 109.727 -179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.634 ' C ' HD22 ' A' ' 13' ' ' LEU . 0.5 OUTLIER -169.9 158.62 7.38 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.228 -1.16 . . . . 0.0 109.668 -179.936 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.708 HD22 ' N ' ' A' ' 13' ' ' LEU . 3.4 mm? -110.91 -173.73 2.31 Favored 'General case' 0 N--CA 1.48 1.054 0 O-C-N 121.069 -1.02 . . . . 0.0 109.05 179.696 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' CGU . . . . . 0.637 ' CD2' ' C ' ' A' ' 14' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.602 ' CB ' ' CZ ' ' A' ' 15' ' ' ARG . 0.4 OUTLIER -76.79 -48.78 17.56 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.273 -0.892 . . . . 0.0 109.243 179.443 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' CGU . . . . . 0.558 ' HB2' ' CB ' ' A' ' 12' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.515 ' O ' ' HB2' ' A' ' 22' ' ' CYS . 0.6 OUTLIER -167.34 43.76 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.091 -1.078 . . . . 0.0 108.091 -179.235 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.546 ' CA ' ' O ' ' A' ' 14' ' ' CGU . 0.3 OUTLIER -56.66 -117.41 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.873 -0.517 . . . . 0.0 110.011 -179.713 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.414 ' O ' ' HA ' ' A' ' 17' ' ' CYS . . . -93.28 12.76 23.49 Favored 'General case' 0 C--N 1.297 -1.681 0 O-C-N 121.454 -0.779 . . . . 0.0 109.062 179.597 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.826 ' SG ' ' HB2' ' A' ' 27' ' ' ALA . 1.7 t -130.67 173.24 11.1 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 121.397 -0.814 . . . . 0.0 109.379 179.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.525 ' O ' ' CB ' ' A' ' 24' ' ' LEU . 30.4 t -135.91 -0.74 2.52 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.217 -0.927 . . . . 0.0 109.934 179.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.525 ' CB ' ' O ' ' A' ' 23' ' ' SER . 0.1 OUTLIER 80.93 -35.04 0.12 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.212 -0.93 . . . . 0.0 110.465 179.966 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' CGU . . . . . 0.415 ' O ' OE12 ' A' ' 29' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' CGU . . . . . 0.658 OE11 HG23 ' A' ' 30' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.826 ' HB2' ' SG ' ' A' ' 22' ' ' CYS . . . -60.17 -13.91 14.63 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.975 -1.078 . . . . 0.0 109.555 -179.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -80.27 -54.6 5.58 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 122.19 0.995 . . . . 0.0 110.394 -179.651 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' CGU . . . . . 0.415 OE12 ' O ' ' A' ' 25' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.658 HG23 OE11 ' A' ' 26' ' ' CGU . 5.3 t -88.57 -28.71 5.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.173 -0.954 . . . . 0.0 109.801 -179.711 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.584 ' CE2' ' CE2' ' A' ' 40' ' ' PHE . 1.9 m-85 -103.54 92.37 4.43 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 120.885 -1.134 . . . . 0.0 109.831 -179.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' CGU . . . . . 0.439 ' O ' ' C ' ' A' ' 33' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.596 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 22.6 m-20 -39.95 125.72 1.96 Allowed 'General case' 0 C--N 1.303 -1.45 0 CA-C-O 121.255 0.55 . . . . 0.0 110.69 -179.416 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.52 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -79.85 -31.43 40.48 Favored 'General case' 0 N--CA 1.487 1.375 0 N-CA-C 107.433 -1.321 . . . . 0.0 107.433 178.611 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' CGU . . . . . 0.456 ' O ' ' HB3' ' A' ' 39' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.661 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 5.8 mm100 -52.98 -37.15 61.0 Favored 'General case' 0 C--O 1.203 -1.376 0 O-C-N 120.55 -1.344 . . . . 0.0 108.216 178.535 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.614 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -41.55 -60.09 1.42 Allowed 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.164 -1.585 . . . . 0.0 107.926 179.056 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.601 ' O ' ' C ' ' A' ' 39' ' ' CGU . 1.8 t70 -81.44 -65.87 0.96 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.337 -0.852 . . . . 0.0 109.263 177.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' CGU . . . . . 0.601 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.661 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 20.6 t80 -39.49 -49.34 2.09 Favored 'General case' 0 C--N 1.301 -1.527 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 178.655 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.614 ' CD1' ' O ' ' A' ' 37' ' ' THR . 9.5 m95 -80.94 -71.85 0.45 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.778 -0.576 . . . . 0.0 112.101 -179.176 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.52 ' OG ' ' N ' ' A' ' 43' ' ' LYS . 1.1 p -53.77 -60.34 3.45 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.435 -1.416 . . . . 0.0 110.711 -178.113 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.531 ' CD ' OE11 ' A' ' 39' ' ' CGU . 0.3 OUTLIER -62.38 -13.71 32.21 Favored 'General case' 0 C--N 1.284 -2.246 0 N-CA-C 108.833 -0.803 . . . . 0.0 108.833 -179.738 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.707 ' O ' ' N ' ' A' ' 46' ' ' ASP . 0.9 OUTLIER -43.23 -65.72 0.46 Allowed 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.31 -0.869 . . . . 0.0 109.0 -179.769 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.543 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.2 OUTLIER -15.58 73.34 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.719 0 CA-C-O 121.203 0.525 . . . . 0.0 111.272 -179.938 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.707 ' N ' ' O ' ' A' ' 44' ' ' TYR . 2.6 t0 -161.71 -30.26 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.215 -0.928 . . . . 0.0 110.414 -178.602 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.491 ' O ' ' OD2' ' A' ' 48' ' ' ASP . . . 105.34 16.15 17.19 Favored Glycine 0 N--CA 1.486 1.999 0 N-CA-C 108.15 -1.98 . . . . 0.0 108.15 -178.199 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.658 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 0.0 OUTLIER 72.21 9.23 5.93 Favored 'General case' 0 N--CA 1.504 2.244 0 O-C-N 121.777 -0.837 . . . . 0.0 109.988 -179.704 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.658 ' HB2' ' O ' ' A' ' 48' ' ' ASP . 32.5 mm-40 79.42 -25.13 0.19 Allowed 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.77 -0.581 . . . . 0.0 111.807 178.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 19.2 t -111.8 -14.49 13.55 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.676 -1.265 . . . . 0.0 110.349 -179.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.487 ' CB ' ' O ' ' A' ' 47' ' ' GLY . 13.9 tt0 -54.98 -20.39 9.0 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 120.943 -1.098 . . . . 0.0 111.514 -179.34 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.415 ' O ' ' C ' ' A' ' 53' ' ' HIS . . . -95.94 21.74 43.31 Favored Glycine 0 N--CA 1.497 2.708 0 O-C-N 120.701 -1.25 . . . . 0.0 111.244 -178.518 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.582 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 13.2 t60 42.94 54.66 10.27 Favored Pre-proline 0 N--CA 1.493 1.717 0 O-C-N 120.956 -1.32 . . . . 0.0 109.721 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.582 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 6.3 Cg_exo -57.89 -39.43 86.71 Favored 'Trans proline' 0 C--N 1.309 -1.542 0 C-N-CA 122.537 2.158 . . . . 0.0 111.846 -179.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.464 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 1.0 OUTLIER -83.84 158.84 21.52 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.083 -1.011 . . . . 0.0 110.348 -178.405 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.531 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.4 mt -144.69 -172.84 3.9 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.434 -0.791 . . . . 0.0 109.516 -179.83 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.646 ' HB3' ' CD2' ' A' ' 76' ' ' PHE . 8.1 m-80 46.78 58.81 4.38 Favored 'General case' 0 C--N 1.303 -1.445 0 CA-C-O 121.827 0.822 . . . . 0.0 110.363 178.662 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.566 ' OE1' ' CZ ' ' A' ' 76' ' ' PHE . 8.4 mt-30 52.64 30.16 8.31 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-O 121.489 0.662 . . . . 0.0 109.54 177.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.438 ' HA2' ' O ' ' A' ' 71' ' ' THR . . . -82.31 141.32 21.29 Favored Glycine 0 N--CA 1.489 2.217 0 N-CA-C 109.728 -1.349 . . . . 0.0 109.728 -179.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -79.39 149.71 31.57 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.193 -1.18 . . . . 0.0 108.036 179.137 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.464 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 41.0 t -119.55 113.79 21.26 Favored 'General case' 0 C--N 1.302 -1.471 0 C-N-CA 119.027 -1.069 . . . . 0.0 111.254 -178.529 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.429 ' HB3' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER -97.29 -178.14 4.07 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 105.454 -2.054 . . . . 0.0 105.454 176.595 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' BHD . . . . . 0.553 ' OD2' ' CD1' ' A' ' 14' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.503 ' O ' ' O ' ' A' ' 67' ' ' ASP . . . 135.19 132.93 3.21 Favored Glycine 0 N--CA 1.488 2.142 0 N-CA-C 107.438 -2.265 . . . . 0.0 107.438 -178.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.595 HG22 ' N ' ' A' ' 66' ' ' GLY . 0.0 OUTLIER -45.53 -56.21 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 120.662 -1.493 . . . . 0.0 109.132 -178.826 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.595 ' N ' HG22 ' A' ' 65' ' ' ILE . . . -44.04 -43.58 7.09 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 109.562 -1.415 . . . . 0.0 109.562 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.503 ' O ' ' O ' ' A' ' 64' ' ' GLY . 2.1 p-10 178.44 -154.87 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.408 -1.054 . . . . 0.0 109.686 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.648 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 1.9 p90 -144.82 157.73 44.06 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 120.859 -1.151 . . . . 0.0 109.962 -179.211 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.429 ' OG1' ' HB3' ' A' ' 62' ' ' LYS . 73.7 p -122.52 115.15 21.69 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.429 -0.795 . . . . 0.0 109.181 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 65.8 m -84.63 -167.61 1.87 Allowed 'General case' 0 C--N 1.298 -1.643 0 O-C-N 120.889 -1.132 . . . . 0.0 108.937 179.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.438 ' O ' ' HA2' ' A' ' 59' ' ' GLY . 1.3 m -160.85 120.93 2.74 Favored 'General case' 0 C--N 1.29 -2.011 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.442 ' O ' ' O ' ' A' ' 73' ' ' ALA . 91.4 m -89.56 115.88 27.29 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.126 -0.983 . . . . 0.0 109.437 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.442 ' O ' ' O ' ' A' ' 72' ' ' CYS . . . -49.51 -179.42 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.481 0 O-C-N 120.915 -1.116 . . . . 0.0 110.162 -179.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -81.03 101.3 9.47 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-O 122.97 1.367 . . . . 0.0 107.799 178.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . 0.583 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 130.99 5.11 3.97 Favored Glycine 0 C--N 1.269 -3.149 0 CA-C-N 114.003 -1.453 . . . . 0.0 110.003 -179.315 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.646 ' CD2' ' HB3' ' A' ' 57' ' ' ASN . 45.4 m-85 -133.45 154.16 51.02 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.111 -1.229 . . . . 0.0 110.606 -177.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.467 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 0.0 OUTLIER -155.92 168.22 27.91 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.247 -0.908 . . . . 0.0 110.206 -179.233 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 116.79 171.99 16.11 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 109.452 -1.459 . . . . 0.0 109.452 179.882 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.469 ' C ' ' HD3' ' A' ' 79' ' ' LYS . 0.4 OUTLIER -50.98 -56.26 13.32 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.152 -1.205 . . . . 0.0 108.65 179.687 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.531 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 1.3 m-20 -108.39 26.87 9.95 Favored 'General case' 0 C--N 1.287 -2.122 0 N-CA-C 108.376 -0.972 . . . . 0.0 108.376 178.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.538 ' O ' ' ND2' ' A' ' 57' ' ' ASN . 4.1 m 63.87 14.63 8.49 Favored 'General case' 0 C--N 1.305 -1.342 0 O-C-N 121.083 -1.01 . . . . 0.0 108.372 -178.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 36.8 tt0 -38.24 -25.5 0.01 OUTLIER 'General case' 0 C--N 1.309 -1.179 0 O-C-N 121.861 -0.525 . . . . 0.0 111.71 -179.53 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.551 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.4 OUTLIER -97.43 -161.44 0.87 Allowed 'General case' 0 C--N 1.299 -1.599 0 CA-C-O 122.836 1.303 . . . . 0.0 109.597 -179.743 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.469 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 54.7 m -161.44 93.1 0.92 Allowed 'General case' 0 C--N 1.277 -2.555 0 CA-C-N 114.302 -1.317 . . . . 0.0 109.098 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.439 ' C ' ' HG3' ' A' ' 86' ' ' ARG . 82.7 p -51.92 -58.81 5.4 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.191 -0.943 . . . . 0.0 109.885 -179.519 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.444 ' O ' ' HA3' ' A' ' 75' ' ' GLY . 2.5 ppt_? . . . . . 0 C--N 1.285 -2.225 0 CA-C-O 117.997 -1.002 . . . . 0.0 109.445 179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 109.464 -0.569 . . . . 0.0 109.464 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 16.7 t-20 49.08 74.5 0.18 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.288 -0.883 . . . . 0.0 109.671 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.455 ' HB2' ' HB3' ' A' ' 6' ' ' CGU . 62.5 p -66.02 90.21 0.13 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.326 -0.859 . . . . 0.0 109.257 179.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.579 ' CZ ' ' O ' ' A' ' 21' ' ' ALA . 17.6 t80 -73.93 -30.49 62.59 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.3 -0.875 . . . . 0.0 109.709 -179.73 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.636 ' C ' ' H ' ' A' ' 7' ' ' CGU . 0.4 OUTLIER -77.33 -29.24 53.43 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.099 -1.001 . . . . 0.0 110.013 -179.432 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' CGU . . . . . 0.455 ' HB3' ' HB2' ' A' ' 3' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' CGU . . . . . 0.636 ' H ' ' C ' ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.747 HG23 ' O ' ' A' ' 8' ' ' VAL . 5.0 m -40.09 101.86 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.309 -1.175 0 CA-C-O 122.335 1.064 . . . . 0.0 109.255 -179.751 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.459 ' C ' ' O ' ' A' ' 8' ' ' VAL . 0.0 OUTLIER -39.25 -29.26 0.04 OUTLIER 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 115.536 -0.756 . . . . 0.0 108.979 -179.796 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.486 ' N ' ' O ' ' A' ' 8' ' ' VAL . 0.7 OUTLIER -168.14 178.46 5.02 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.449 -0.782 . . . . 0.0 109.273 179.01 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -88.4 34.24 3.88 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.697 -1.361 . . . . 0.0 109.697 -179.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.967 ' C ' HD13 ' A' ' 13' ' ' LEU . 1.4 t-20 -110.04 154.12 23.67 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.159 -1.2 . . . . 0.0 109.486 179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 1.023 HD11 HG11 ' A' ' 30' ' ' VAL . 0.0 OUTLIER -153.49 -32.16 0.12 Allowed 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.075 -1.016 . . . . 0.0 109.836 178.665 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' CGU . . . . . 0.612 ' N ' HD22 ' A' ' 13' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.533 ' NH1' ' O ' ' A' ' 61' ' ' CYS . 26.5 mtm180 -75.91 -34.13 59.91 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.706 -0.621 . . . . 0.0 110.221 179.092 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' CGU . . . . . 0.504 ' HB2' ' HA ' ' A' ' 13' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.71 ' HA ' ' HB3' ' A' ' 22' ' ' CYS . 44.6 t -110.28 25.42 11.8 Favored 'General case' 0 N--CA 1.49 1.567 0 CA-C-O 122.227 1.013 . . . . 0.0 109.287 179.786 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.854 HD11 ' O ' ' A' ' 48' ' ' ASP . 0.1 OUTLIER -79.48 -14.32 58.97 Favored 'General case' 0 C--N 1.298 -1.636 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.146 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.579 ' O ' ' CZ ' ' A' ' 4' ' ' PHE . . . -83.22 17.92 1.9 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.108 -0.995 . . . . 0.0 110.801 -178.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.71 ' HB3' ' HA ' ' A' ' 17' ' ' CYS . 18.1 p -134.5 -163.59 1.39 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.842 -1.161 . . . . 0.0 110.491 -179.898 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.531 ' O ' ' N ' ' A' ' 25' ' ' CGU . 84.4 p -170.62 137.8 1.38 Allowed 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.117 -1.068 . . . . 0.0 108.117 179.317 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 1.137 HD13 ' N ' ' A' ' 25' ' ' CGU . 0.0 OUTLIER -41.24 -21.03 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.227 -0.92 . . . . 0.0 111.042 -179.278 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' CGU . . . . . 1.137 ' N ' HD13 ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' CGU . . . . . 0.55 ' CA ' HD11 ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.702 ' HB3' ' CZ2' ' A' ' 41' ' ' TRP . . . -81.36 66.3 6.85 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 179.759 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.548 ' HG3' ' O ' ' A' ' 24' ' ' LEU . 4.1 mtp180 -121.35 -85.3 0.66 Allowed 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.252 -0.905 . . . . 0.0 110.801 -179.345 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 1.023 HG11 HD11 ' A' ' 13' ' ' LEU . 1.9 t -79.26 -34.22 16.2 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 120.813 -1.179 . . . . 0.0 109.569 -179.614 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.653 ' HZ ' ' HB1' ' A' ' 27' ' ' ALA . 0.0 OUTLIER -122.55 123.52 41.42 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 119.138 -1.025 . . . . 0.0 110.014 178.265 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' CGU . . . . . 0.416 ' O ' ' C ' ' A' ' 33' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.595 ' HB2' ' CG ' ' A' ' 36' ' ' GLN . 4.8 m-20 -39.25 108.87 0.09 Allowed 'General case' 0 C--N 1.304 -1.402 0 CA-C-O 121.561 0.696 . . . . 0.0 111.44 -179.21 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.526 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -78.09 -25.94 47.83 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 106.12 -1.808 . . . . 0.0 106.12 177.078 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' CGU . . . . . 0.421 ' O ' ' N ' ' A' ' 39' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.691 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 0.0 OUTLIER -51.24 -35.87 39.09 Favored 'General case' 0 C--O 1.202 -1.417 0 C-N-CA 117.796 -1.562 . . . . 0.0 107.432 179.344 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.604 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -41.89 -61.89 1.03 Allowed 'General case' 0 N--CA 1.5 2.044 0 C-N-CA 117.548 -1.661 . . . . 0.0 106.969 178.698 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.637 ' O ' ' C ' ' A' ' 39' ' ' CGU . 0.4 OUTLIER -83.69 -68.49 0.71 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.358 -0.839 . . . . 0.0 109.544 176.397 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' CGU . . . . . 0.637 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.763 ' O ' ' HB2' ' A' ' 44' ' ' TYR . 21.0 t80 -47.13 -52.95 14.09 Favored 'General case' 0 C--O 1.189 -2.103 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 178.081 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.702 ' CZ2' ' HB3' ' A' ' 27' ' ' ALA . 16.2 m95 -80.94 -66.06 0.93 Allowed 'General case' 0 C--N 1.294 -1.817 0 O-C-N 120.656 -1.278 . . . . 0.0 112.019 179.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.55 ' O ' ' CB ' ' A' ' 43' ' ' LYS . 0.6 OUTLIER -71.85 79.62 0.88 Allowed 'General case' 0 N--CA 1.488 1.427 0 CA-C-O 122.334 1.064 . . . . 0.0 109.565 -178.81 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.55 ' CB ' ' O ' ' A' ' 42' ' ' SER . 0.0 OUTLIER 153.68 -26.69 0.0 OUTLIER 'General case' 0 C--N 1.283 -2.324 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 -179.46 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.976 ' HA ' HD11 ' A' ' 65' ' ' ILE . 22.1 t80 -80.38 -97.55 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.476 0 N-CA-C 107.761 -1.2 . . . . 0.0 107.761 179.034 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.551 ' C ' ' O ' ' A' ' 44' ' ' TYR . 0.1 OUTLIER 35.84 33.41 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 107.255 -1.387 . . . . 0.0 107.255 -179.057 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.563 ' HB2' ' O ' ' A' ' 44' ' ' TYR . 7.4 t0 -134.21 -17.59 2.08 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.712 -176.308 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.524 ' HA2' ' CE1' ' A' ' 44' ' ' TYR . . . 45.06 60.88 3.75 Favored Glycine 0 N--CA 1.496 2.685 0 N-CA-C 106.328 -2.709 . . . . 0.0 106.328 -177.31 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.854 ' O ' HD11 ' A' ' 18' ' ' LEU . 13.0 t70 -129.18 -129.22 0.21 Allowed 'General case' 0 C--N 1.308 -1.228 0 O-C-N 121.445 -1.032 . . . . 0.0 111.434 -176.166 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.542 ' HG3' ' N ' ' A' ' 67' ' ' ASP . 0.1 OUTLIER 52.04 -86.0 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.376 0 O-C-N 121.425 -0.797 . . . . 0.0 111.343 -179.385 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.502 ' HA ' ' CG ' ' A' ' 54' ' ' PRO . 46.1 t -101.33 12.63 37.1 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.948 -1.095 . . . . 0.0 111.221 -178.542 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 42.7 tt0 -70.19 146.05 51.02 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 120.714 -1.241 . . . . 0.0 109.008 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 90.94 -1.85 78.62 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 110.107 -1.197 . . . . 0.0 110.107 179.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.43 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 10.2 t60 62.59 66.52 1.3 Allowed Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.114 -1.227 . . . . 0.0 109.411 -179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.502 ' CG ' ' HA ' ' A' ' 50' ' ' CYS . 3.0 Cg_exo -61.97 -52.93 2.4 Favored 'Trans proline' 0 C--N 1.309 -1.502 0 C-N-CA 122.42 2.08 . . . . 0.0 111.259 -179.666 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.491 ' SG ' ' CB ' ' A' ' 61' ' ' CYS . 1.8 m -65.76 160.72 22.35 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.093 -1.005 . . . . 0.0 109.178 -179.349 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.502 ' HA ' HD23 ' A' ' 56' ' ' LEU . 5.3 mt -145.21 -173.83 4.21 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.195 -0.941 . . . . 0.0 110.026 -179.573 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.658 ' HB3' ' CD2' ' A' ' 76' ' ' PHE . 8.2 m-80 45.68 59.7 3.51 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-O 121.995 0.902 . . . . 0.0 110.281 178.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.443 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 2.2 mm-40 53.66 30.18 10.58 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-O 121.521 0.677 . . . . 0.0 109.709 177.678 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.498 ' HA2' ' O ' ' A' ' 71' ' ' THR . . . -81.58 131.13 10.17 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.435 -1.466 . . . . 0.0 109.435 179.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -79.63 123.48 27.67 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.116 -1.226 . . . . 0.0 109.019 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.533 ' O ' ' NH1' ' A' ' 15' ' ' ARG . 39.0 t -91.96 148.98 21.79 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 121.383 -0.823 . . . . 0.0 110.397 -179.046 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 69' ' ' THR . 0.9 OUTLIER -136.56 102.36 4.91 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 178.446 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' BHD . . . . . 0.528 ' OB ' ' CG ' ' A' ' 15' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.556 ' O ' ' O ' ' A' ' 65' ' ' ILE . . . 153.27 33.25 0.03 OUTLIER Glycine 0 N--CA 1.488 2.106 0 C-N-CA 119.527 -1.321 . . . . 0.0 110.95 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.976 HD11 ' HA ' ' A' ' 44' ' ' TYR . 0.1 OUTLIER 54.97 143.34 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.258 -1.142 . . . . 0.0 109.975 179.776 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 85.07 -43.47 3.26 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 108.223 -1.951 . . . . 0.0 108.223 -178.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.542 ' N ' ' HG3' ' A' ' 49' ' ' GLN . 1.8 p-10 -176.15 -157.46 0.05 Allowed 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.488 -1.007 . . . . 0.0 109.162 178.51 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.704 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 4.0 p90 -160.71 125.46 3.69 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.303 -0.873 . . . . 0.0 108.759 -177.724 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.473 ' O ' ' HB2' ' A' ' 62' ' ' LYS . 73.3 p -85.48 128.21 34.66 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 120.492 -1.38 . . . . 0.0 109.66 179.691 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 31.0 m -92.89 -170.91 2.56 Favored 'General case' 0 C--N 1.306 -1.287 0 O-C-N 120.972 -1.08 . . . . 0.0 108.422 179.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.498 ' O ' ' HA2' ' A' ' 59' ' ' GLY . 9.0 m -161.34 112.65 1.76 Allowed 'General case' 0 C--N 1.289 -2.06 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 179.571 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 99.6 m -79.74 121.19 25.03 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 120.96 -1.088 . . . . 0.0 108.766 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -52.05 175.34 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.403 0 O-C-N 120.937 -1.102 . . . . 0.0 109.732 -179.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -80.75 101.33 9.25 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-O 123.022 1.391 . . . . 0.0 107.788 178.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . 0.553 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 131.45 5.99 3.53 Favored Glycine 0 C--N 1.27 -3.126 0 CA-C-N 113.905 -1.498 . . . . 0.0 110.184 -179.374 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.658 ' CD2' ' HB3' ' A' ' 57' ' ' ASN . 27.1 m-85 -130.64 160.78 33.22 Favored 'General case' 0 C--N 1.299 -1.626 0 O-C-N 121.041 -1.27 . . . . 0.0 110.6 -178.238 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.482 ' C ' ' HA ' ' A' ' 81' ' ' CYS . 0.8 OUTLIER -159.44 169.23 24.37 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.119 -0.988 . . . . 0.0 110.494 -179.387 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 115.83 173.49 17.35 Favored Glycine 0 N--CA 1.492 2.397 0 N-CA-C 109.322 -1.511 . . . . 0.0 109.322 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.55 -57.47 7.02 Favored 'General case' 0 C--N 1.306 -1.301 0 O-C-N 121.088 -1.242 . . . . 0.0 109.018 179.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.488 ' O ' ' CB ' ' A' ' 81' ' ' CYS . 2.7 m-20 -108.51 23.94 13.78 Favored 'General case' 0 C--N 1.29 -2.013 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 178.762 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.589 ' HB2' ' HB2' ' A' ' 57' ' ' ASN . 3.3 m 72.05 15.47 5.55 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.078 -1.014 . . . . 0.0 108.566 -179.451 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 34.8 tt0 -39.42 -25.13 0.02 OUTLIER 'General case' 0 C--N 1.308 -1.239 0 O-C-N 121.772 -0.58 . . . . 0.0 112.348 -179.266 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.52 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.4 OUTLIER -101.96 -161.84 0.88 Allowed 'General case' 0 C--N 1.299 -1.608 0 CA-C-O 122.91 1.338 . . . . 0.0 110.092 -179.079 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.505 ' HA ' ' HA ' ' A' ' 76' ' ' PHE . 8.0 m -156.36 99.07 1.89 Allowed 'General case' 0 C--N 1.278 -2.515 0 CA-C-N 114.13 -1.396 . . . . 0.0 109.069 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . . . . . . . . . 77.9 p -58.29 -55.48 34.46 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.085 -1.009 . . . . 0.0 109.764 -179.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.517 ' HG2' ' HA2' ' A' ' 75' ' ' GLY . 0.0 OUTLIER . . . . . 0 C--N 1.285 -2.208 0 CA-C-O 117.984 -1.008 . . . . 0.0 109.411 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.529 ' ND2' ' HB3' ' A' ' 5' ' ' LEU . 17.7 t-20 -79.27 -98.19 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.301 -0.874 . . . . 0.0 109.346 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.513 ' N ' ' OD1' ' A' ' 2' ' ' ASN . 16.2 t 54.38 -89.95 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.0 -1.062 . . . . 0.0 109.923 179.645 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.57 ' CE1' HD12 ' A' ' 5' ' ' LEU . 38.3 p90 -62.3 -11.91 17.86 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.201 -0.937 . . . . 0.0 109.818 -179.467 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.57 HD12 ' CE1' ' A' ' 4' ' ' PHE . 0.2 OUTLIER -63.77 -32.37 73.85 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.084 -1.01 . . . . 0.0 109.435 179.979 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' CGU . . . . . 0.478 ' C ' ' O ' ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' CGU . . . . . 0.463 ' O ' ' N ' ' A' ' 9' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.788 HG23 ' O ' ' A' ' 8' ' ' VAL . 4.7 m -40.15 99.29 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.308 -1.203 0 CA-C-O 122.391 1.091 . . . . 0.0 109.761 -179.364 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.463 ' N ' ' O ' ' A' ' 7' ' ' CGU . 8.2 mtmt -51.43 89.08 0.0 OUTLIER 'General case' 0 C--N 1.283 -2.31 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.54 ' N ' ' O ' ' A' ' 8' ' ' VAL . 0.4 OUTLIER -47.24 127.58 10.83 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.101 -1.0 . . . . 0.0 109.284 -179.257 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -121.93 -52.26 0.23 Allowed Glycine 0 N--CA 1.49 2.283 0 C-N-CA 119.723 -1.227 . . . . 0.0 110.293 -179.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.731 ' C ' HD22 ' A' ' 13' ' ' LEU . 5.1 t-20 -170.12 -167.09 0.6 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.121 -1.223 . . . . 0.0 109.553 -179.493 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.731 HD22 ' C ' ' A' ' 12' ' ' ASN . 3.4 mm? -110.37 124.77 52.31 Favored 'General case' 0 C--N 1.309 -1.185 0 O-C-N 120.775 -1.203 . . . . 0.0 108.999 -179.72 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' CGU . . . . . 0.604 ' HA ' ' CE2' ' A' ' 40' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.583 ' CB ' ' CZ ' ' A' ' 15' ' ' ARG . 2.3 mtm-85 -83.31 18.73 1.68 Allowed 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.281 -0.887 . . . . 0.0 109.333 178.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' CGU . . . . . 0.537 ' C ' ' SG ' ' A' ' 17' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.775 ' HB3' ' C ' ' A' ' 21' ' ' ALA . 3.6 m -164.12 61.28 0.15 Allowed 'General case' 0 C--N 1.307 -1.247 0 CA-C-O 123.024 1.392 . . . . 0.0 107.891 178.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.902 HD21 ' CG ' ' A' ' 48' ' ' ASP . 0.4 OUTLIER -105.35 -35.06 7.65 Favored 'General case' 0 C--N 1.286 -2.176 0 CA-C-N 114.43 -1.259 . . . . 0.0 107.62 177.488 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' CGU . . . . . 0.477 ' C ' ' N ' ' A' ' 22' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.775 ' C ' ' HB3' ' A' ' 17' ' ' CYS . . . 43.34 33.11 0.56 Allowed 'General case' 0 C--N 1.306 -1.299 0 CA-C-O 122.746 1.26 . . . . 0.0 108.698 -179.476 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.506 ' SG ' ' HB2' ' A' ' 26' ' ' CGU . 17.0 p 20.14 -142.2 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 CA-C-N 113.342 -1.754 . . . . 0.0 112.397 177.599 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.536 ' HB3' HD11 ' A' ' 5' ' ' LEU . 32.2 t -127.21 58.47 1.45 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.849 -1.157 . . . . 0.0 111.168 -178.4 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.596 ' HA ' ' CH2' ' A' ' 41' ' ' TRP . 0.2 OUTLIER 50.55 -90.12 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.234 -0.916 . . . . 0.0 111.229 178.372 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' CGU . . . . . 0.48 ' C ' ' O ' ' A' ' 24' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' CGU . . . . . 0.528 ' HG ' ' CG1' ' A' ' 8' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.61 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . . . -70.56 -22.8 62.55 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 120.932 -1.105 . . . . 0.0 110.427 -179.349 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.456 ' HG2' ' O ' ' A' ' 25' ' ' CGU . 1.3 ptm180 -65.64 -15.13 62.47 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.929 -1.107 . . . . 0.0 110.077 -179.305 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.668 HG13 HD13 ' A' ' 13' ' ' LEU . 1.7 p -87.2 -42.69 15.46 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 120.912 -1.117 . . . . 0.0 109.954 -179.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.595 ' CE1' ' O ' ' A' ' 27' ' ' ALA . 0.1 OUTLIER -116.67 136.63 52.81 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.922 -1.111 . . . . 0.0 111.025 -179.854 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' CGU . . . . . 0.445 OE11 ' O ' ' A' ' 32' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.592 ' CB ' ' HB2' ' A' ' 36' ' ' GLN . 0.8 OUTLIER -39.97 115.87 0.58 Allowed 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.648 -0.657 . . . . 0.0 111.583 -178.386 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.468 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -77.41 -27.57 52.4 Favored 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 106.477 -1.675 . . . . 0.0 106.477 177.432 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' CGU . . . . . 0.612 ' CD2' ' N ' ' A' ' 35' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.632 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 23.1 mt-30 -49.06 -35.71 16.51 Favored 'General case' 0 C--O 1.205 -1.289 0 C-N-CA 118.424 -1.311 . . . . 0.0 108.445 179.131 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.67 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -43.11 -59.35 2.08 Favored 'General case' 0 N--CA 1.498 1.962 0 C-N-CA 117.709 -1.596 . . . . 0.0 107.317 178.502 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.584 ' O ' ' C ' ' A' ' 39' ' ' CGU . 1.0 OUTLIER -81.92 -68.45 0.7 Allowed 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.277 -0.89 . . . . 0.0 109.405 177.195 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' CGU . . . . . 0.584 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.632 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 10.9 t80 -43.2 -56.29 3.52 Favored 'General case' 0 N--CA 1.486 1.364 0 N-CA-C 107.498 -1.297 . . . . 0.0 107.498 178.468 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.67 ' CD1' ' O ' ' A' ' 37' ' ' THR . 9.9 m95 -77.07 177.35 7.88 Favored 'General case' 0 C--N 1.306 -1.304 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 176.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . 0.567 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 0.1 OUTLIER 62.65 110.97 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.345 0 O-C-N 120.506 -1.371 . . . . 0.0 108.625 -179.992 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.567 ' CG ' ' O ' ' A' ' 42' ' ' SER . 0.0 OUTLIER 84.59 -25.48 0.13 Allowed 'General case' 0 N--CA 1.498 1.934 0 N-CA-C 108.316 -0.994 . . . . 0.0 108.316 -178.617 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.714 ' O ' ' N ' ' A' ' 46' ' ' ASP . 1.0 OUTLIER -40.6 -63.72 0.61 Allowed 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.545 -179.948 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.513 ' C ' ' O ' ' A' ' 44' ' ' TYR . 5.6 ptmt -20.84 74.35 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.557 0 CA-C-O 121.238 0.542 . . . . 0.0 111.185 -179.469 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.714 ' N ' ' O ' ' A' ' 44' ' ' TYR . 3.8 t70 -161.82 18.46 0.1 Allowed 'General case' 0 N--CA 1.486 1.341 0 O-C-N 121.238 -0.914 . . . . 0.0 109.709 -178.382 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.552 ' O ' HD11 ' A' ' 18' ' ' LEU . . . 67.35 11.44 59.31 Favored Glycine 0 N--CA 1.492 2.403 0 N-CA-C 107.906 -2.078 . . . . 0.0 107.906 -177.685 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.902 ' CG ' HD21 ' A' ' 18' ' ' LEU . 0.3 OUTLIER 71.61 5.89 5.53 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.612 -0.934 . . . . 0.0 109.785 -179.644 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.595 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 2.9 mm100 78.09 -18.38 0.51 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.312 -0.867 . . . . 0.0 111.255 178.254 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.484 ' O ' ' HD3' ' A' ' 54' ' ' PRO . 0.1 OUTLIER -108.38 -18.27 13.79 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 120.756 -1.215 . . . . 0.0 110.157 -179.683 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.44 ' HG3' ' O ' ' A' ' 51' ' ' GLU . 1.9 tt0 -50.62 -20.07 1.1 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.173 -0.954 . . . . 0.0 111.238 -179.247 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.416 ' O ' ' C ' ' A' ' 53' ' ' HIS . . . -85.63 19.94 21.58 Favored Glycine 0 N--CA 1.495 2.585 0 O-C-N 120.813 -1.179 . . . . 0.0 110.867 -178.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.56 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 20.3 t-160 45.03 59.55 14.02 Favored Pre-proline 0 N--CA 1.492 1.647 0 O-C-N 120.892 -1.358 . . . . 0.0 109.086 -179.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.56 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 5.5 Cg_exo -57.74 -53.11 4.88 Favored 'Trans proline' 0 C--N 1.309 -1.541 0 C-N-CA 122.658 2.239 . . . . 0.0 111.869 -179.568 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.559 ' SG ' ' CB ' ' A' ' 61' ' ' CYS . 3.6 m -60.32 175.41 0.43 Allowed 'General case' 0 N--CA 1.496 1.874 0 O-C-N 120.836 -1.165 . . . . 0.0 110.046 -178.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.509 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 4.9 mt -148.87 -174.98 4.77 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-O 121.647 0.737 . . . . 0.0 109.121 179.198 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.634 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 54.5 m-80 39.14 64.01 0.87 Allowed 'General case' 0 C--N 1.299 -1.591 0 CA-C-O 121.886 0.851 . . . . 0.0 109.662 -179.664 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.449 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 0.2 OUTLIER 51.75 35.74 16.02 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 121.667 0.746 . . . . 0.0 109.328 178.148 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -86.99 131.12 10.38 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.775 -1.33 . . . . 0.0 109.775 -179.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.484 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 88.9 m-70 -79.43 142.26 36.07 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.309 -1.112 . . . . 0.0 108.561 179.499 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.576 ' HA ' ' HA ' ' A' ' 70' ' ' CYS . 0.1 OUTLIER -116.13 127.23 54.66 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.075 -1.016 . . . . 0.0 110.137 -179.039 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.548 ' HB3' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER -79.05 -154.22 0.08 Allowed 'General case' 0 N--CA 1.486 1.36 0 N-CA-C 106.595 -1.632 . . . . 0.0 106.595 177.569 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' BHD . . . . . 0.545 ' CG ' ' N ' ' A' ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.545 ' N ' ' CG ' ' A' ' 63' ' ' BHD . . . 179.26 175.67 46.37 Favored Glycine 0 N--CA 1.494 2.523 0 N-CA-C 108.389 -1.884 . . . . 0.0 108.389 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.692 HG23 ' HA ' ' A' ' 44' ' ' TYR . 35.9 mm -86.68 -66.59 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.813 0 O-C-N 120.744 -1.444 . . . . 0.0 110.341 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.425 ' O ' ' HB3' ' A' ' 67' ' ' ASP . . . -61.19 -12.57 31.55 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.626 -1.39 . . . . 0.0 109.626 -179.544 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.496 ' HA ' HE21 ' A' ' 49' ' ' GLN . 1.5 p-10 -178.1 -157.3 0.04 OUTLIER 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.201 -1.176 . . . . 0.0 110.357 179.378 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.697 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 2.0 p90 -156.15 -160.37 1.0 Allowed 'General case' 0 C--N 1.298 -1.655 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 -178.632 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.548 ' OG1' ' HB3' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -151.04 177.67 9.94 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 177.955 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . 0.576 ' HA ' ' HA ' ' A' ' 61' ' ' CYS . 1.3 m -137.09 -174.47 3.75 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 120.674 -1.266 . . . . 0.0 109.4 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.484 ' HB ' ' HB2' ' A' ' 60' ' ' HIS . 0.7 OUTLIER -161.09 123.63 3.14 Favored 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 109.056 -0.72 . . . . 0.0 109.056 179.362 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.513 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 84.7 m -97.84 140.34 32.36 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.93 -1.106 . . . . 0.0 109.571 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.851 ' HB3' ' CE1' ' A' ' 76' ' ' PHE . . . -73.76 -176.39 2.39 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.073 -1.017 . . . . 0.0 110.659 -179.621 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 7.1 tt0 -81.45 102.31 10.45 Favored 'General case' 0 C--N 1.305 -1.368 0 CA-C-O 123.119 1.438 . . . . 0.0 108.265 178.362 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . 0.464 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 123.31 17.57 3.24 Favored Glycine 0 C--N 1.268 -3.238 0 CA-C-N 113.765 -1.561 . . . . 0.0 109.459 -179.332 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.851 ' CE1' ' HB3' ' A' ' 73' ' ' ALA . 4.8 m-85 -119.92 167.79 11.79 Favored 'General case' 0 C--N 1.294 -1.805 0 O-C-N 121.44 -1.035 . . . . 0.0 109.578 -178.316 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.51 ' CB ' ' HB2' ' A' ' 83' ' ' PHE . 3.7 mt-10 -160.41 171.01 19.83 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.038 -1.039 . . . . 0.0 110.355 -179.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 92.33 169.01 40.41 Favored Glycine 0 N--CA 1.49 2.237 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 179.573 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.441 ' C ' ' HD3' ' A' ' 79' ' ' LYS . 1.0 OUTLIER -57.89 -55.81 30.1 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.303 -1.116 . . . . 0.0 109.318 179.897 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.509 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 0.2 OUTLIER -95.56 25.46 4.5 Favored 'General case' 0 C--N 1.287 -2.119 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.585 179.999 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.507 ' O ' ' ND2' ' A' ' 57' ' ' ASN . 6.6 m 69.7 11.6 7.9 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.84 -1.163 . . . . 0.0 109.021 -179.619 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.518 ' HA ' ' ND2' ' A' ' 57' ' ' ASN . 26.7 tt0 -42.06 -47.4 4.49 Favored 'General case' 0 N--CA 1.489 1.517 0 CA-C-O 121.446 0.641 . . . . 0.0 111.39 -179.71 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.619 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.6 OUTLIER -79.77 84.63 5.54 Favored 'General case' 0 C--N 1.295 -1.794 0 O-C-N 121.223 -0.923 . . . . 0.0 110.66 -178.328 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.451 ' HB3' ' OD1' ' A' ' 57' ' ' ASN . 3.9 p -67.42 94.5 0.4 Allowed 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.583 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.457 ' H ' HG23 ' A' ' 85' ' ' THR . 18.5 p -54.92 -21.38 11.44 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.172 -0.955 . . . . 0.0 109.924 -179.041 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.417 ' HD2' ' HA3' ' A' ' 75' ' ' GLY . 14.4 ptm180 . . . . . 0 C--N 1.289 -2.044 0 CA-C-O 118.033 -0.985 . . . . 0.0 109.556 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.42 ' O ' ' HB2' ' A' ' 2' ' ' ASN . . . . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 121.256 0.55 . . . . 0.0 109.536 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.441 ' O ' ' CB ' ' A' ' 3' ' ' SER . 6.8 m-20 61.18 76.88 0.35 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.238 -0.914 . . . . 0.0 109.395 -179.903 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.441 ' CB ' ' O ' ' A' ' 2' ' ' ASN . 0.2 OUTLIER 168.85 -169.75 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.251 -0.906 . . . . 0.0 109.402 179.955 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -63.29 -22.85 67.13 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.106 -0.996 . . . . 0.0 109.261 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.627 ' C ' ' H ' ' A' ' 7' ' ' CGU . 4.1 mp -68.81 -25.55 64.73 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.174 -0.953 . . . . 0.0 109.462 -179.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' CGU . . . . . 0.423 OE21 ' HA ' ' A' ' 6' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' CGU . . . . . 0.627 ' H ' ' C ' ' A' ' 5' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.715 HG23 ' O ' ' A' ' 8' ' ' VAL . 1.3 m -39.77 103.82 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.308 -1.217 0 CA-C-O 122.343 1.068 . . . . 0.0 109.86 -178.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.478 ' O ' ' O ' ' A' ' 10' ' ' GLN . 3.1 mtmt -63.57 84.93 0.03 OUTLIER 'General case' 0 C--N 1.283 -2.287 0 N-CA-C 106.868 -1.53 . . . . 0.0 106.868 178.359 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.478 ' O ' ' O ' ' A' ' 9' ' ' LYS . 3.5 tt0 56.01 158.67 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.335 0 O-C-N 121.536 -0.727 . . . . 0.0 109.442 -178.207 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.435 ' O ' ' HB2' ' A' ' 12' ' ' ASN . . . -104.1 -171.16 25.15 Favored Glycine 0 N--CA 1.491 2.301 0 C-N-CA 119.841 -1.171 . . . . 0.0 110.428 -179.005 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.563 ' HB3' ' CB ' ' A' ' 16' ' ' CGU . 0.6 OUTLIER 170.26 -179.93 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.639 0 N-CA-C 108.245 -1.02 . . . . 0.0 108.245 -179.416 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.829 HD22 ' HB3' ' A' ' 31' ' ' PHE . 0.5 OUTLIER -84.75 -173.58 4.8 Favored 'General case' 0 C--N 1.312 -1.023 0 O-C-N 120.171 -1.58 . . . . 0.0 109.104 -179.772 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' CGU . . . . . 0.693 ' CD2' ' C ' ' A' ' 14' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.516 ' N ' OE12 ' A' ' 14' ' ' CGU . 4.2 mtp180 -76.37 -40.71 50.35 Favored 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 119.294 -0.962 . . . . 0.0 110.172 -178.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' CGU . . . . . 0.899 OE11 ' HB2' ' A' ' 21' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.81 ' HA ' ' HB3' ' A' ' 21' ' ' ALA . 28.2 m -61.79 -28.45 69.47 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.924 -1.11 . . . . 0.0 111.199 -178.124 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.423 ' C ' ' O ' ' A' ' 17' ' ' CYS . 0.1 OUTLIER -48.37 -24.56 1.27 Allowed 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 118.641 -1.224 . . . . 0.0 108.061 179.252 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' CGU . . . . . 0.444 ' N ' ' C ' ' A' ' 17' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.899 ' HB2' OE11 ' A' ' 16' ' ' CGU . . . -74.43 -41.78 60.26 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 120.526 -1.358 . . . . 0.0 110.07 -179.56 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.504 ' HB2' ' HB3' ' A' ' 17' ' ' CYS . 1.4 m -149.57 168.59 23.11 Favored 'General case' 0 C--N 1.292 -1.909 0 O-C-N 121.549 -0.719 . . . . 0.0 109.178 178.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.548 ' O ' ' CB ' ' A' ' 24' ' ' LEU . 0.7 OUTLIER -85.29 31.62 0.57 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.158 -0.964 . . . . 0.0 110.502 -178.986 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.548 ' CB ' ' O ' ' A' ' 23' ' ' SER . 0.1 OUTLIER 81.26 -40.24 0.14 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.409 -0.807 . . . . 0.0 110.31 179.665 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' CGU . . . . . 0.491 ' CD2' HG21 ' A' ' 30' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -81.68 62.18 5.4 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.105 -0.997 . . . . 0.0 110.213 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.517 ' O ' ' CB ' ' A' ' 29' ' ' CGU . 26.3 ptt180 -159.4 110.75 2.05 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.278 -1.008 . . . . 0.0 108.278 178.416 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' CGU . . . . . 0.517 ' CB ' ' O ' ' A' ' 28' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.491 HG21 ' CD2' ' A' ' 26' ' ' CGU . 2.1 t -80.25 -14.79 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.292 0 O-C-N 120.87 -1.144 . . . . 0.0 108.38 179.306 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.829 ' HB3' HD22 ' A' ' 13' ' ' LEU . 0.0 OUTLIER -127.09 139.21 53.15 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 121.381 -0.825 . . . . 0.0 109.772 -179.695 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' CGU . . . . . 0.55 ' O ' ' N ' ' A' ' 34' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.64 ' HB2' ' CD2' ' A' ' 31' ' ' PHE . 0.9 OUTLIER -38.63 90.88 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 121.379 0.609 . . . . 0.0 110.57 -179.787 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.55 ' N ' ' O ' ' A' ' 32' ' ' CGU . . . -80.38 -28.03 38.05 Favored 'General case' 0 N--CA 1.486 1.361 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 179.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.68 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 65.8 mt-30 -52.86 -34.81 56.06 Favored 'General case' 0 C--O 1.202 -1.41 0 C-N-CA 117.99 -1.484 . . . . 0.0 108.261 179.256 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.647 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.0 OUTLIER -42.54 -59.3 1.94 Allowed 'General case' 0 N--CA 1.499 2.014 0 O-C-N 119.797 -1.814 . . . . 0.0 107.571 178.4 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.611 ' O ' ' C ' ' A' ' 39' ' ' CGU . 2.0 t70 -82.13 -68.09 0.73 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.43 -0.794 . . . . 0.0 109.305 177.354 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' CGU . . . . . 0.611 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.68 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 18.5 t80 -40.23 -55.72 2.1 Favored 'General case' 0 N--CA 1.493 1.685 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 178.128 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.647 ' CD1' ' O ' ' A' ' 37' ' ' THR . 9.1 m95 -80.99 172.02 14.26 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.878 -0.514 . . . . 0.0 109.857 178.505 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 76.47 -59.8 0.49 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.532 -0.73 . . . . 0.0 112.254 177.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.565 ' HD2' ' CD1' ' A' ' 39' ' ' CGU . 0.0 OUTLIER -101.74 11.05 39.43 Favored 'General case' 0 C--N 1.28 -2.432 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 178.489 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.607 ' O ' ' N ' ' A' ' 46' ' ' ASP . 0.8 OUTLIER -56.9 -76.22 0.04 OUTLIER 'General case' 0 C--N 1.307 -1.248 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 179.589 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.549 ' C ' ' O ' ' A' ' 44' ' ' TYR . 7.1 mttt 9.85 55.55 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.419 0 CA-C-O 121.172 0.511 . . . . 0.0 112.144 179.095 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.607 ' N ' ' O ' ' A' ' 44' ' ' TYR . 0.9 OUTLIER -156.35 8.55 0.22 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.131 -0.981 . . . . 0.0 110.056 -179.667 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.571 ' O ' ' CB ' ' A' ' 48' ' ' ASP . . . 86.03 -48.46 3.95 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 108.636 -1.785 . . . . 0.0 108.636 -179.147 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.571 ' CB ' ' O ' ' A' ' 47' ' ' GLY . 16.1 p-10 140.42 -10.04 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.247 0 N-CA-C 108.15 -1.056 . . . . 0.0 108.15 179.561 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.594 ' NE2' ' O ' ' A' ' 65' ' ' ILE . 0.0 OUTLIER 77.78 -15.99 0.7 Allowed 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.754 -0.591 . . . . 0.0 110.858 -179.547 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . 0.518 ' HB2' ' OD1' ' A' ' 63' ' ' BHD . 20.2 t -99.23 -21.09 16.26 Favored 'General case' 0 N--CA 1.487 1.403 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 176.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.489 ' HB2' ' OD1' ' A' ' 48' ' ' ASP . 21.9 tt0 -58.93 148.89 28.74 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 121.319 -0.863 . . . . 0.0 108.899 179.248 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.462 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . 102.2 -22.25 38.57 Favored Glycine 0 N--CA 1.492 2.391 0 N-CA-C 109.357 -1.497 . . . . 0.0 109.357 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.546 ' N ' ' HD3' ' A' ' 54' ' ' PRO . 0.6 OUTLIER 68.8 58.24 0.64 Allowed Pre-proline 0 N--CA 1.49 1.56 0 O-C-N 121.456 -1.026 . . . . 0.0 109.847 -179.954 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.546 ' HD3' ' N ' ' A' ' 53' ' ' HIS . 3.2 Cg_exo -57.05 -35.09 98.8 Favored 'Trans proline' 0 C--N 1.31 -1.494 0 C-N-CA 122.36 2.04 . . . . 0.0 110.317 179.327 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.538 ' O ' ' CE1' ' A' ' 53' ' ' HIS . 0.2 OUTLIER -75.28 164.2 26.69 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.576 -0.703 . . . . 0.0 109.197 -179.617 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.505 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.8 mt -145.0 -175.34 4.65 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.241 -0.912 . . . . 0.0 110.037 179.724 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.602 ' O ' ' CE2' ' A' ' 76' ' ' PHE . 0.9 OUTLIER 42.59 63.63 1.38 Allowed 'General case' 0 C--N 1.299 -1.605 0 CA-C-O 121.931 0.872 . . . . 0.0 109.143 -179.965 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.433 ' HG2' ' C ' ' A' ' 57' ' ' ASN . 0.2 OUTLIER 51.61 32.66 9.45 Favored 'General case' 0 C--N 1.301 -1.532 0 C-N-CA 119.934 -0.706 . . . . 0.0 109.771 177.938 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -82.2 139.35 19.66 Favored Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.367 -1.493 . . . . 0.0 109.367 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -79.76 149.69 31.03 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.264 -1.139 . . . . 0.0 109.095 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.446 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 44.3 t -116.12 124.78 51.21 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.106 -0.996 . . . . 0.0 110.144 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.546 ' HB2' ' OG1' ' A' ' 69' ' ' THR . 80.5 mttt -102.3 -169.12 1.63 Allowed 'General case' 0 C--N 1.302 -1.482 0 N-CA-C 106.208 -1.775 . . . . 0.0 106.208 177.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' BHD . . . . . 0.559 ' HA ' ' HA ' ' A' ' 68' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.651 ' O ' ' N ' ' A' ' 66' ' ' GLY . . . 119.75 63.2 0.27 Allowed Glycine 0 N--CA 1.492 2.385 0 N-CA-C 109.121 -1.592 . . . . 0.0 109.121 -178.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.892 HD12 ' H ' ' A' ' 66' ' ' GLY . 0.6 OUTLIER 19.74 -71.01 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.511 2.611 0 N-CA-C 113.503 0.927 . . . . 0.0 113.503 -178.726 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.892 ' H ' HD12 ' A' ' 65' ' ' ILE . . . -32.7 -36.33 0.04 OUTLIER Glycine 0 N--CA 1.502 3.05 0 N-CA-C 109.222 -1.551 . . . . 0.0 109.222 -179.295 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.556 ' HA ' ' OE1' ' A' ' 49' ' ' GLN . 3.1 p-10 175.84 -162.87 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 177.584 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.644 ' CD1' ' N ' ' A' ' 68' ' ' TYR . 1.0 OUTLIER -131.18 -176.48 4.03 Favored 'General case' 0 C--N 1.291 -1.971 0 O-C-N 121.01 -1.056 . . . . 0.0 108.341 179.934 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.546 ' OG1' ' HB2' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -148.5 109.83 4.39 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 120.821 -1.174 . . . . 0.0 109.537 179.342 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 66.8 m -84.47 -174.15 5.12 Favored 'General case' 0 C--N 1.292 -1.904 0 CA-C-O 122.149 0.976 . . . . 0.0 109.608 -179.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 10.3 m -161.35 144.21 12.41 Favored 'General case' 0 C--N 1.286 -2.195 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.31 179.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . 0.542 ' HB3' ' HB2' ' A' ' 76' ' ' PHE . 99.1 m -106.81 134.31 50.15 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.144 -0.973 . . . . 0.0 108.991 179.522 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.916 ' HB3' ' CE1' ' A' ' 76' ' ' PHE . . . -64.92 -175.12 0.17 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.943 -1.098 . . . . 0.0 111.076 -179.092 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -81.5 101.56 10.0 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-O 123.114 1.435 . . . . 0.0 108.307 178.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . 0.437 ' O ' ' OG1' ' A' ' 85' ' ' THR . . . 120.3 16.54 4.71 Favored Glycine 0 C--N 1.269 -3.192 0 N-CA-C 109.146 -1.581 . . . . 0.0 109.146 -179.23 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.916 ' CE1' ' HB3' ' A' ' 73' ' ' ALA . 4.2 m-85 -113.31 164.38 13.64 Favored 'General case' 0 C--N 1.293 -1.856 0 O-C-N 121.443 -1.034 . . . . 0.0 109.23 -178.434 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.487 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 0.0 OUTLIER -160.52 170.11 21.59 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.004 -1.06 . . . . 0.0 110.335 -179.372 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 97.2 173.36 34.19 Favored Glycine 0 N--CA 1.488 2.14 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 179.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.3 tmtt? -60.2 -57.8 11.24 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.343 -1.092 . . . . 0.0 109.234 179.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.505 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 1.0 OUTLIER -98.59 27.47 4.81 Favored 'General case' 0 C--N 1.287 -2.113 0 N-CA-C 108.86 -0.793 . . . . 0.0 108.86 179.428 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.503 ' HB2' ' HB2' ' A' ' 57' ' ' ASN . 4.6 m 71.71 7.83 6.0 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 120.99 -1.069 . . . . 0.0 109.422 -179.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.424 ' C ' ' O ' ' A' ' 81' ' ' CYS . 41.1 tt0 -36.34 -44.62 0.43 Allowed 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.542 -0.724 . . . . 0.0 111.489 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.607 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.9 OUTLIER -80.47 86.82 5.73 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.269 -0.894 . . . . 0.0 110.424 -178.607 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.544 ' CB ' ' OD1' ' A' ' 57' ' ' ASN . 0.2 OUTLIER -74.66 92.2 2.42 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.416 -0.802 . . . . 0.0 109.164 179.345 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.437 ' OG1' ' O ' ' A' ' 75' ' ' GLY . 10.5 p -72.61 -14.4 61.6 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.22 -0.925 . . . . 0.0 109.694 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.466 ' HD3' ' CZ ' ' A' ' 76' ' ' PHE . 0.0 OUTLIER . . . . . 0 C--N 1.295 -1.78 0 CA-C-O 117.995 -1.002 . . . . 0.0 109.633 -179.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 1.1 m120 54.96 86.67 0.05 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.229 -0.92 . . . . 0.0 109.326 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 5.5 t -131.12 -171.1 2.5 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.268 -0.895 . . . . 0.0 109.714 -179.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.573 ' CZ ' ' O ' ' A' ' 21' ' ' ALA . 2.3 p90 -80.7 14.58 2.06 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.323 -0.861 . . . . 0.0 110.194 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.72 HD11 ' HB3' ' A' ' 23' ' ' SER . 0.2 OUTLIER -63.95 -30.78 71.83 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 120.926 -1.109 . . . . 0.0 109.831 -179.632 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' CGU . . . . . 0.453 OE12 ' HB3' ' A' ' 7' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' CGU . . . . . 0.473 ' O ' ' N ' ' A' ' 9' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.781 HG23 ' O ' ' A' ' 8' ' ' VAL . 3.6 m -39.66 98.46 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.307 -1.25 0 CA-C-O 122.83 1.3 . . . . 0.0 110.18 -178.617 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.549 ' O ' ' CB ' ' A' ' 10' ' ' GLN . 2.6 mmpt? -55.82 -17.31 5.93 Favored 'General case' 0 C--N 1.283 -2.301 0 N-CA-C 108.454 -0.943 . . . . 0.0 108.454 178.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.714 ' HA ' HG21 ' A' ' 30' ' ' VAL . 1.2 tt0 85.44 109.72 0.05 Allowed 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 121.217 0.532 . . . . 0.0 109.735 179.586 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.478 ' O ' ' O ' ' A' ' 10' ' ' GLN . . . -61.02 -135.19 0.01 OUTLIER Glycine 0 N--CA 1.492 2.405 0 N-CA-C 109.043 -1.623 . . . . 0.0 109.043 179.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.535 ' HB2' ' CB ' ' A' ' 16' ' ' CGU . 0.9 OUTLIER -169.58 -46.61 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.398 0 O-C-N 120.763 -1.433 . . . . 0.0 110.798 179.787 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.551 ' O ' ' CG ' ' A' ' 14' ' ' CGU . 0.0 OUTLIER -167.12 -22.4 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.227 0 O-C-N 120.398 -1.439 . . . . 0.0 111.223 -179.959 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' CGU . . . . . 0.551 ' CG ' ' O ' ' A' ' 13' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.512 ' NH1' ' HG3' ' A' ' 15' ' ' ARG . 9.1 mtm-85 -80.08 -21.39 43.4 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.543 -0.723 . . . . 0.0 111.322 -179.08 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' CGU . . . . . 0.535 ' CB ' ' HB2' ' A' ' 12' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.751 ' SG ' ' HB2' ' A' ' 27' ' ' ALA . 0.1 OUTLIER -166.52 42.27 0.06 Allowed 'General case' 0 N--CA 1.491 1.576 0 CA-C-O 124.013 1.863 . . . . 0.0 107.991 -178.918 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.789 HD11 ' HB3' ' A' ' 48' ' ' ASP . 0.2 OUTLIER -115.32 -2.05 12.74 Favored 'General case' 0 C--N 1.29 -1.987 0 O-C-N 120.857 -1.152 . . . . 0.0 109.319 178.868 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.573 ' O ' ' CZ ' ' A' ' 4' ' ' PHE . . . -89.28 32.43 0.84 Allowed 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.282 -0.886 . . . . 0.0 109.766 -179.718 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.598 ' HB2' ' HA ' ' A' ' 17' ' ' CYS . 11.5 t -150.82 -47.67 0.12 Allowed 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.334 -0.854 . . . . 0.0 110.341 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.72 ' HB3' HD11 ' A' ' 5' ' ' LEU . 7.8 t 84.26 -2.46 1.03 Allowed 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 -178.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.558 ' CB ' ' O ' ' A' ' 23' ' ' SER . 0.4 OUTLIER 83.66 -54.69 0.15 Allowed 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.614 -0.679 . . . . 0.0 110.436 179.667 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' CGU . . . . . 0.463 ' O ' OE11 ' A' ' 29' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' CGU . . . . . 0.456 OE11 ' HA ' ' A' ' 26' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.751 ' HB2' ' SG ' ' A' ' 17' ' ' CYS . . . -68.81 -26.37 65.15 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.099 -1.001 . . . . 0.0 109.814 -179.684 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.455 ' HG2' ' O ' ' A' ' 25' ' ' CGU . 8.1 ptm180 -91.82 -17.87 24.68 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 120.934 -1.104 . . . . 0.0 110.654 -179.27 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' CGU . . . . . 0.463 OE11 ' O ' ' A' ' 25' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.714 HG21 ' HA ' ' A' ' 10' ' ' GLN . 0.9 OUTLIER -93.08 -6.34 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 120.901 -1.124 . . . . 0.0 110.125 -179.104 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.59 ' CD1' ' O ' ' A' ' 27' ' ' ALA . 25.7 m-85 -100.0 96.1 7.31 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 120.893 -1.129 . . . . 0.0 111.055 -178.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' CGU . . . . . 0.432 ' O ' ' C ' ' A' ' 33' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.562 ' O ' HG23 ' A' ' 37' ' ' THR . 3.9 m-20 -39.88 111.74 0.22 Allowed 'General case' 0 C--N 1.305 -1.333 0 O-C-N 121.894 -0.504 . . . . 0.0 110.325 -179.323 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.521 ' O ' ' OG1' ' A' ' 37' ' ' THR . . . -78.37 -31.03 48.28 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 178.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' CGU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.639 ' O ' ' CB ' ' A' ' 40' ' ' PHE . 2.3 mm100 -53.95 -34.65 60.27 Favored 'General case' 0 C--O 1.205 -1.278 0 C-N-CA 118.846 -1.142 . . . . 0.0 108.676 179.013 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.671 ' O ' ' CD1' ' A' ' 41' ' ' TRP . 0.2 OUTLIER -46.12 -59.0 3.14 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.259 -1.526 . . . . 0.0 107.797 178.952 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . 0.6 ' O ' ' C ' ' A' ' 39' ' ' CGU . 3.0 t70 -80.68 -66.5 0.88 Allowed 'General case' 0 C--N 1.298 -1.665 0 O-C-N 121.17 -0.956 . . . . 0.0 109.91 178.733 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' CGU . . . . . 0.6 ' C ' ' O ' ' A' ' 38' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.639 ' CB ' ' O ' ' A' ' 36' ' ' GLN . 6.4 t80 -46.96 -46.94 21.86 Favored 'General case' 0 C--N 1.299 -1.618 0 O-C-N 121.62 -0.675 . . . . 0.0 110.36 179.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.671 ' CD1' ' O ' ' A' ' 37' ' ' THR . 6.8 m95 -80.35 -67.5 0.76 Allowed 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.452 -0.78 . . . . 0.0 112.304 -178.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -57.34 -50.08 74.08 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.516 -1.365 . . . . 0.0 110.356 -177.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.789 ' HD3' HG23 ' A' ' 65' ' ' ILE . 0.7 OUTLIER -81.87 2.14 31.75 Favored 'General case' 0 C--N 1.287 -2.136 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 179.624 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.687 ' O ' ' N ' ' A' ' 46' ' ' ASP . 1.0 OUTLIER -46.43 -70.39 0.1 Allowed 'General case' 0 C--N 1.305 -1.366 0 O-C-N 121.379 -0.826 . . . . 0.0 109.182 -179.913 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.542 ' C ' ' O ' ' A' ' 44' ' ' TYR . 3.1 ptmt -9.75 69.05 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.647 0 CA-C-O 121.366 0.603 . . . . 0.0 111.797 -179.481 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.687 ' N ' ' O ' ' A' ' 44' ' ' TYR . 2.4 t0 -162.13 -30.44 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.4 -0.813 . . . . 0.0 110.077 -179.109 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.48 ' O ' ' OD2' ' A' ' 48' ' ' ASP . . . 98.61 13.97 39.23 Favored Glycine 0 N--CA 1.486 2.003 0 N-CA-C 107.83 -2.108 . . . . 0.0 107.83 -177.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.789 ' HB3' HD11 ' A' ' 18' ' ' LEU . 0.0 OUTLIER 74.6 11.35 3.94 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.784 -0.833 . . . . 0.0 109.358 -179.628 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.66 ' HB3' ' CD1' ' A' ' 68' ' ' TYR . 34.5 mm-40 73.85 -10.79 1.04 Allowed 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.807 -0.558 . . . . 0.0 111.125 179.682 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 15.0 t -114.83 -11.45 12.24 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.665 -1.272 . . . . 0.0 110.088 179.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.471 ' HB3' ' HA3' ' A' ' 47' ' ' GLY . 53.5 tt0 -74.12 152.73 39.81 Favored 'General case' 0 N--CA 1.483 1.223 0 O-C-N 120.888 -1.132 . . . . 0.0 109.135 179.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.463 ' O ' ' HB3' ' A' ' 53' ' ' HIS . . . 94.27 -14.07 66.05 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . 0.463 ' HB3' ' O ' ' A' ' 52' ' ' GLY . 1.2 t60 68.42 69.6 0.44 Allowed Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.336 -1.096 . . . . 0.0 109.343 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' PRO . . . . . 0.45 ' HG2' ' SG ' ' A' ' 61' ' ' CYS . 5.7 Cg_exo -59.67 -39.83 70.35 Favored 'Trans proline' 0 C--N 1.31 -1.479 0 C-N-CA 122.45 2.1 . . . . 0.0 110.61 -179.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.494 ' SG ' ' HB2' ' A' ' 61' ' ' CYS . 0.6 OUTLIER -84.77 177.89 7.85 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.338 -0.851 . . . . 0.0 109.302 -179.863 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.518 ' HB2' ' O ' ' A' ' 80' ' ' ASN . 5.5 mt -140.08 -175.37 4.22 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 179.199 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ASN . . . . . 0.586 ' HB3' ' CD2' ' A' ' 76' ' ' PHE . 4.9 m-80 48.49 56.43 7.53 Favored 'General case' 0 C--N 1.296 -1.729 0 CA-C-O 121.718 0.771 . . . . 0.0 110.943 178.013 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 47.06 30.15 1.25 Allowed 'General case' 0 C--N 1.301 -1.507 0 CA-C-O 121.439 0.638 . . . . 0.0 109.873 177.455 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -79.08 150.92 34.49 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.198 -1.561 . . . . 0.0 109.198 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.518 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 3.1 t60 -79.64 156.47 27.6 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.98 -1.306 . . . . 0.0 108.772 179.585 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' CYS . . . . . 0.494 ' HB2' ' SG ' ' A' ' 55' ' ' CYS . 0.6 OUTLIER -124.56 116.98 23.32 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.18 -0.95 . . . . 0.0 109.948 -179.082 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.503 ' HB3' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER -79.12 -173.05 3.41 Favored 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 106.91 -1.515 . . . . 0.0 106.91 177.755 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' BHD . . . . . 0.503 ' CG ' ' N ' ' A' ' 64' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . 0.574 ' O ' ' O ' ' A' ' 67' ' ' ASP . . . 137.03 134.46 3.28 Favored Glycine 0 N--CA 1.493 2.479 0 N-CA-C 108.079 -2.008 . . . . 0.0 108.079 -179.26 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ILE . . . . . 0.789 HG23 ' HD3' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -51.76 -61.94 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 119.881 -1.952 . . . . 0.0 109.316 -179.136 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.69 ' N ' HG22 ' A' ' 65' ' ' ILE . . . -43.19 -50.1 6.47 Favored Glycine 0 N--CA 1.493 2.482 0 N-CA-C 109.964 -1.254 . . . . 0.0 109.964 -179.34 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.574 ' O ' ' O ' ' A' ' 64' ' ' GLY . 6.4 p-10 -164.89 -147.8 0.1 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.41 -1.053 . . . . 0.0 109.278 179.71 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.66 ' CD1' ' HB3' ' A' ' 49' ' ' GLN . 2.5 p90 -159.8 -165.15 1.45 Allowed 'General case' 0 C--N 1.296 -1.751 0 O-C-N 120.501 -1.374 . . . . 0.0 109.352 -179.45 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.503 ' OG1' ' HB3' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -149.43 -177.48 5.88 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 107.324 -1.362 . . . . 0.0 107.324 178.989 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 1.7 m -139.61 -173.29 3.58 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 120.601 -1.312 . . . . 0.0 108.563 179.158 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.518 ' HB ' ' HB3' ' A' ' 60' ' ' HIS . 1.5 m -161.08 139.92 10.08 Favored 'General case' 0 C--N 1.292 -1.931 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 179.334 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' CYS . . . . . . . . . . . . . 95.0 m -104.15 141.99 35.28 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.952 -1.093 . . . . 0.0 109.365 179.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.557 ' HB3' ' CD1' ' A' ' 76' ' ' PHE . . . -77.16 177.66 7.67 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.222 -0.924 . . . . 0.0 109.8 -179.756 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLU . . . . . . . . . . . . . 16.1 tt0 -80.56 102.34 9.71 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-O 123.399 1.571 . . . . 0.0 107.839 178.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . 0.632 ' C ' ' CD1' ' A' ' 76' ' ' PHE . . . 127.27 25.58 1.17 Allowed Glycine 0 C--N 1.267 -3.302 0 CA-C-N 113.299 -1.773 . . . . 0.0 109.896 -179.556 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.632 ' CD1' ' C ' ' A' ' 75' ' ' GLY . 58.2 m-85 -141.37 159.88 41.28 Favored 'General case' 0 C--N 1.287 -2.115 0 O-C-N 121.174 -1.192 . . . . 0.0 110.05 -177.815 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . 0.503 ' O ' ' HA ' ' A' ' 81' ' ' CYS . 2.5 mt-10 -150.36 175.21 12.04 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.172 -0.955 . . . . 0.0 110.239 -178.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 95.47 168.02 35.48 Favored Glycine 0 N--CA 1.491 2.327 0 N-CA-C 110.191 -1.164 . . . . 0.0 110.191 179.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.469 ' C ' ' HD3' ' A' ' 79' ' ' LYS . 4.6 tmtt? -55.86 -57.77 10.65 Favored 'General case' 0 N--CA 1.487 1.392 0 O-C-N 121.466 -1.02 . . . . 0.0 109.158 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ASN . . . . . 0.518 ' O ' ' HB2' ' A' ' 56' ' ' LEU . 1.1 m-20 -94.43 25.86 3.69 Favored 'General case' 0 C--N 1.287 -2.113 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 179.418 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.579 ' HB2' ' HB2' ' A' ' 57' ' ' ASN . 4.1 m 66.36 14.85 9.89 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 120.818 -1.176 . . . . 0.0 108.41 -179.211 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -46.53 -42.44 15.77 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.769 -0.582 . . . . 0.0 112.122 -179.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.607 ' CD1' ' N ' ' A' ' 83' ' ' PHE . 0.8 OUTLIER -79.32 85.09 5.18 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.169 -0.957 . . . . 0.0 111.135 -178.035 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' SER . . . . . 0.546 ' CB ' ' OD1' ' A' ' 57' ' ' ASN . 0.4 OUTLIER -68.64 109.27 3.7 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 108.409 -0.96 . . . . 0.0 108.409 178.232 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.46 ' O ' ' C ' ' A' ' 86' ' ' ARG . 33.3 p -92.02 -32.91 15.03 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.997 -1.064 . . . . 0.0 109.807 -179.334 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ARG . . . . . 0.46 ' C ' ' O ' ' A' ' 85' ' ' THR . 0.1 OUTLIER . . . . . 0 C--N 1.289 -2.05 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.202 179.871 . . . . . . . . 2 2 . 1 stop_ save_