data_1gab_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 1gab _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.8 p30 . . . . . 0 N--CA 1.493 1.686 0 CA-C-O 121.012 0.434 . . . . 0.0 109.87 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.464 ' O ' ' HB1' ' A' ' 14' ' ' ALA . . . -80.43 -15.37 56.95 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.1 -1.0 . . . . 0.0 109.501 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.548 ' O ' ' CG1' ' A' ' 15' ' ' ILE . 0.1 OUTLIER -63.44 -32.6 74.09 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.271 -0.893 . . . . 0.0 109.91 -179.44 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.454 ' HG2' ' CE ' ' A' ' 11' ' ' LYS . 3.8 mm-40 -92.36 -44.12 8.88 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.865 -1.147 . . . . 0.0 109.627 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -65.94 -18.71 65.52 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.132 -0.98 . . . . 0.0 109.696 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.477 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -99.0 -43.83 6.54 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.313 -0.867 . . . . 0.0 109.262 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.572 HG12 ' CD1' ' A' ' 29' ' ' PHE . 58.6 mt -62.83 -29.04 46.14 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.529 0 O-C-N 121.491 -0.756 . . . . 0.0 109.371 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.04 -15.55 63.65 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.499 -0.75 . . . . 0.0 110.342 -178.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.447 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 32.7 tt0 -116.98 -14.41 10.62 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.074 -1.016 . . . . 0.0 109.857 -179.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.522 ' CD2' ' HG2' ' A' ' 45' ' ' LYS . 5.7 mt -90.21 -33.0 16.35 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.111 -0.993 . . . . 0.0 109.459 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.1 ptmm? -56.84 -19.54 17.98 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.14 -0.975 . . . . 0.0 108.702 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -86.95 -31.22 20.76 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.466 -0.771 . . . . 0.0 108.973 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.65 -20.25 7.76 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.387 -0.821 . . . . 0.0 109.389 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 116.14 -39.16 2.8 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.42 -1.472 . . . . 0.0 109.42 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.524 HD12 ' CG2' ' A' ' 48' ' ' ILE . 13.0 mt -54.03 107.89 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.224 -1.162 . . . . 0.0 109.332 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -115.2 7.51 15.32 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.259 -0.901 . . . . 0.0 109.629 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.3 t -59.95 152.98 22.29 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.15 -0.969 . . . . 0.0 109.265 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.49 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 9.4 p-10 -100.46 -9.13 22.45 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.238 -0.914 . . . . 0.0 109.578 -179.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.538 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 15.1 t80 -74.83 -24.45 58.61 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.078 -1.014 . . . . 0.0 109.583 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.639 ' CG ' ' CG1' ' A' ' 48' ' ' ILE . 23.6 m-85 -94.95 -42.39 8.68 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.217 -0.927 . . . . 0.0 109.171 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.572 ' CD1' HG12 ' A' ' 15' ' ' ILE . 5.3 m-85 -62.81 -45.87 90.59 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 121.54 -0.725 . . . . 0.0 109.734 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.49 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 0.4 OUTLIER -65.78 -39.55 91.1 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.13 -0.981 . . . . 0.0 109.626 -179.844 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.6 -10.73 60.21 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.206 -0.934 . . . . 0.0 109.519 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.468 HD11 ' O ' ' A' ' 28' ' ' TYR . 0.3 OUTLIER -65.94 -24.36 33.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.399 -0.813 . . . . 0.0 109.071 -179.869 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.8 m-20 -80.51 -37.61 31.31 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.315 -0.865 . . . . 0.0 109.764 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -57.88 -20.44 36.8 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.259 -0.901 . . . . 0.0 109.438 -179.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.457 ' HB2' HG21 ' A' ' 41' ' ' VAL . . . -47.13 155.93 0.26 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.248 -0.908 . . . . 0.0 109.343 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.494 ' CD ' ' N ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -90.94 -55.3 3.61 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.323 -0.861 . . . . 0.0 109.382 -179.967 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 13.7 t -125.02 -175.79 3.39 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.244 -0.91 . . . . 0.0 109.466 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 95.9 t -63.21 -30.32 49.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.049 -1.032 . . . . 0.0 109.267 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.54 ' O ' ' CB ' ' A' ' 43' ' ' ALA . 1.9 tt0 -72.14 -21.7 61.42 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 179.456 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.429 ' HG3' ' HG2' ' A' ' 36' ' ' LYS . 37.6 mm-40 -86.48 -31.09 21.52 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.39 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.457 HG21 ' HB2' ' A' ' 35' ' ' ALA . 24.5 t -72.72 -56.68 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 179.108 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 65.8 m-20 -62.86 -27.93 69.68 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 178.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.54 ' CB ' ' O ' ' A' ' 39' ' ' GLU . . . -66.87 -46.74 74.01 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.485 -0.76 . . . . 0.0 109.448 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.518 ' O ' ' CD1' ' A' ' 48' ' ' ILE . 2.1 mt -59.2 -35.15 73.1 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.233 -0.917 . . . . 0.0 108.87 179.748 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.522 ' HG2' ' CD2' ' A' ' 18' ' ' LEU . 0.0 OUTLIER -62.0 -40.48 95.8 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.321 -0.862 . . . . 0.0 108.973 179.494 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.468 ' O ' ' HB2' ' A' ' 49' ' ' LEU . 75.1 m-20 -65.9 -20.69 66.31 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.315 -0.865 . . . . 0.0 109.04 179.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.07 -36.31 61.77 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.298 -0.876 . . . . 0.0 109.659 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.639 ' CG1' ' CG ' ' A' ' 28' ' ' TYR . 3.7 mp -58.47 -27.41 33.39 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 O-C-N 120.959 -1.088 . . . . 0.0 108.376 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.468 ' HB2' ' O ' ' A' ' 46' ' ' ASN . 2.5 mm? -56.07 -39.0 71.42 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.435 -0.79 . . . . 0.0 109.072 179.189 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.429 ' O ' ' C ' ' A' ' 51' ' ' ALA . 0.0 OUTLIER -109.63 -62.24 1.53 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.212 -0.93 . . . . 0.0 109.818 -179.401 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.429 ' C ' ' O ' ' A' ' 50' ' ' LYS . . . -41.23 -37.81 1.01 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.295 -0.878 . . . . 0.0 109.966 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.589 ' CG ' HG21 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -115.62 129.07 56.37 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.349 -0.845 . . . . 0.0 109.083 -179.547 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.541 ' CB ' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 118.068 -0.968 . . . . 0.0 109.307 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.502 ' ND2' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.455 ' O ' ' HB1' ' A' ' 14' ' ' ALA . . . -80.51 -6.92 58.92 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 178.163 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.421 ' HE2' ' CG ' ' A' ' 33' ' ' ASN . 13.6 tttm -61.31 -35.71 78.11 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 121.614 -0.678 . . . . 0.0 109.985 -179.666 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -89.25 -51.3 5.64 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.05 -1.031 . . . . 0.0 109.115 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -53.97 -21.72 8.72 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.54 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -89.51 -59.16 2.28 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 121.558 -0.714 . . . . 0.0 109.14 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.523 HD11 ' N ' ' A' ' 15' ' ' ILE . 0.2 OUTLIER -41.09 -36.98 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 O-C-N 121.52 -0.737 . . . . 0.0 109.392 179.978 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.22 -48.68 77.26 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.419 ' N ' ' O ' ' A' ' 14' ' ' ALA . 3.7 mm-40 -73.27 -12.68 60.94 Favored 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.834 -0.541 . . . . 0.0 110.79 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.65 ' CB ' ' CZ ' ' A' ' 29' ' ' PHE . 1.0 OUTLIER -88.43 -32.56 18.24 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.637 -1.29 . . . . 0.0 109.694 -179.307 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.29 -17.11 62.48 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.185 -0.947 . . . . 0.0 109.339 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.436 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 1.0 OUTLIER -96.55 -22.36 17.12 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.232 -0.918 . . . . 0.0 109.548 -179.873 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.17 -26.68 66.77 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.218 -0.926 . . . . 0.0 109.411 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 112.66 -23.78 14.52 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.504 HD12 HG23 ' A' ' 48' ' ' ILE . 31.7 mt -75.09 92.57 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.288 -1.125 . . . . 0.0 109.735 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.1 p -95.66 5.5 51.28 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.126 -0.984 . . . . 0.0 109.127 179.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.7 t -57.18 138.34 54.75 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.318 -0.864 . . . . 0.0 109.025 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.476 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 5.0 m-20 -91.78 -5.77 52.93 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.218 -0.927 . . . . 0.0 109.816 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.653 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 2.1 t80 -74.09 -16.27 61.03 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.129 -0.982 . . . . 0.0 108.591 179.702 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.653 ' CE1' ' CE2' ' A' ' 27' ' ' PHE . 21.7 m-85 -103.99 -50.15 3.45 Favored 'General case' 0 C--N 1.298 -1.667 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 179.4 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.65 ' CZ ' ' CB ' ' A' ' 18' ' ' LEU . 3.1 m-85 -55.89 -45.35 78.64 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.476 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 8.3 m120 -60.82 -43.97 97.51 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.251 -0.906 . . . . 0.0 109.091 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.458 ' O ' HD12 ' A' ' 44' ' ' LEU . . . -73.67 -13.75 61.04 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.441 -0.787 . . . . 0.0 109.626 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.532 ' CD1' ' CD1' ' A' ' 18' ' ' LEU . 4.5 mt -71.15 -40.32 74.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.297 -0.877 . . . . 0.0 108.898 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.421 ' CG ' ' HE2' ' A' ' 11' ' ' LYS . 0.9 OUTLIER -76.5 -19.62 57.8 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.205 -0.934 . . . . 0.0 109.317 179.787 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.462 ' O ' ' O ' ' A' ' 35' ' ' ALA . 2.5 mtpt -75.33 -15.66 60.47 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.391 -0.818 . . . . 0.0 109.61 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.514 ' CB ' ' HB3' ' A' ' 40' ' ' GLU . . . -40.39 162.64 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.461 -0.774 . . . . 0.0 109.882 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.452 ' O ' HG21 ' A' ' 37' ' ' THR . 3.4 tttm -101.89 -19.86 15.1 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.424 -0.797 . . . . 0.0 109.021 179.66 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.465 ' O ' HG21 ' A' ' 41' ' ' VAL . 11.2 p -153.2 -179.76 8.0 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.446 -0.784 . . . . 0.0 109.04 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.502 HG23 ' ND2' ' A' ' 9' ' ' ASN . 18.7 t -65.04 -38.48 82.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.1 -1.0 . . . . 0.0 108.912 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.529 ' O ' ' CB ' ' A' ' 43' ' ' ALA . 29.2 mt-10 -64.68 -28.49 69.64 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.254 -0.904 . . . . 0.0 108.782 179.332 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.514 ' HB3' ' CB ' ' A' ' 35' ' ' ALA . 0.3 OUTLIER -79.48 -31.18 42.29 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 179.485 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.465 HG21 ' O ' ' A' ' 37' ' ' THR . 12.5 t -70.49 -65.26 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 178.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -55.7 -33.34 64.11 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.596 -0.69 . . . . 0.0 109.34 179.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.529 ' CB ' ' O ' ' A' ' 39' ' ' GLU . . . -61.2 -42.25 98.26 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.321 -0.862 . . . . 0.0 109.242 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.482 ' O ' HG13 ' A' ' 48' ' ' ILE . 0.4 OUTLIER -57.74 -50.18 74.08 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.225 -0.922 . . . . 0.0 110.04 -179.62 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.545 ' HD3' ' CD1' ' A' ' 18' ' ' LEU . 10.4 tptp -50.02 -29.67 9.16 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.041 -1.037 . . . . 0.0 110.499 -179.367 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 36.5 m-20 -80.02 -46.79 15.98 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.026 -1.046 . . . . 0.0 110.21 -179.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -54.52 -28.4 45.04 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.086 -1.009 . . . . 0.0 110.01 -179.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.618 HG12 ' CD1' ' A' ' 28' ' ' TYR . 21.1 mt -60.37 -44.38 95.88 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 O-C-N 121.016 -1.052 . . . . 0.0 109.237 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.555 ' HA ' ' CB ' ' A' ' 53' ' ' ALA . 1.0 OUTLIER -56.23 -19.06 12.27 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.536 -0.727 . . . . 0.0 110.449 -179.411 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.1 -58.41 1.89 Allowed 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.801 -1.187 . . . . 0.0 110.774 -179.102 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.497 ' O ' ' CB ' ' A' ' 52' ' ' HIS . . . -82.67 46.45 1.08 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.315 -0.865 . . . . 0.0 110.293 -179.014 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.543 ' CG ' ' N ' ' A' ' 53' ' ' ALA . 3.7 t-80 170.22 -81.83 0.0 OUTLIER 'General case' 0 C--N 1.302 -1.488 0 O-C-N 120.83 -1.169 . . . . 0.0 109.476 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.555 ' CB ' ' HA ' ' A' ' 49' ' ' LEU . . . . . . . . 0 N--CA 1.489 1.524 0 CA-C-O 118.01 -0.995 . . . . 0.0 109.456 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.615 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.67 4.59 15.64 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.302 -0.874 . . . . 0.0 109.212 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.532 ' O ' ' CG1' ' A' ' 15' ' ' ILE . 0.5 OUTLIER -52.44 -91.81 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.252 -0.905 . . . . 0.0 110.546 -179.407 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -67.26 -22.93 65.65 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.999 -1.063 . . . . 0.0 111.06 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -62.07 -63.51 1.23 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.763 -1.21 . . . . 0.0 109.508 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.25 -47.97 38.69 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.179 -0.95 . . . . 0.0 109.12 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.605 ' CA ' ' HE3' ' A' ' 45' ' ' LYS . 70.5 mt -47.1 -30.47 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.491 -0.756 . . . . 0.0 109.756 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.47 -52.21 59.09 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.468 -0.77 . . . . 0.0 109.856 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -49.9 -32.15 13.89 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.246 -0.909 . . . . 0.0 110.123 -179.679 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.477 HD22 HD13 ' A' ' 48' ' ' ILE . 10.0 mp -90.37 -24.94 20.66 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.43 -0.794 . . . . 0.0 110.263 -178.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.2 tttt -64.03 -22.3 66.87 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.339 -0.85 . . . . 0.0 110.02 -179.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.42 -13.21 41.03 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.204 -0.935 . . . . 0.0 109.625 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -81.66 -4.12 55.32 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.225 -0.922 . . . . 0.0 109.589 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.06 -41.8 2.2 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.802 -1.319 . . . . 0.0 109.802 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.443 HD12 HG23 ' A' ' 48' ' ' ILE . 59.7 mt -47.04 117.55 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.163 -1.198 . . . . 0.0 109.666 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.73 17.91 5.2 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.306 -0.872 . . . . 0.0 109.508 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.418 ' HB3' ' CD2' ' A' ' 28' ' ' TYR . 3.0 t -54.97 127.67 29.94 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.108 -0.995 . . . . 0.0 109.038 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.558 ' O ' ' CB ' ' A' ' 30' ' ' ASN . 17.4 p-10 -72.15 -13.39 61.54 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.187 -0.946 . . . . 0.0 109.878 -179.394 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.531 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 18.9 t80 -81.44 -3.2 52.24 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 120.479 -1.388 . . . . 0.0 108.901 179.368 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.574 ' CG ' HG12 ' A' ' 48' ' ' ILE . 21.4 m-30 -111.48 -29.88 7.6 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.589 ' CD1' HG12 ' A' ' 15' ' ' ILE . 3.9 m-30 -103.23 -43.75 5.37 Favored 'General case' 0 C--N 1.295 -1.763 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.558 ' CB ' ' O ' ' A' ' 26' ' ' ASP . 3.1 t-20 -68.33 -26.94 65.86 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 108.45 -0.945 . . . . 0.0 108.45 179.127 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -88.55 4.43 46.85 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.53 -0.731 . . . . 0.0 109.68 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.518 HD13 ' CG ' ' A' ' 45' ' ' LYS . 0.7 OUTLIER -84.73 -20.79 8.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.169 -0.957 . . . . 0.0 109.104 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.522 ' HB2' ' CE ' ' A' ' 11' ' ' LYS . 0.7 OUTLIER -76.5 -23.48 53.74 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.127 -0.983 . . . . 0.0 109.004 179.387 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.453 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.4 OUTLIER -80.21 -18.44 49.53 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.396 -0.815 . . . . 0.0 109.313 179.716 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.453 ' O ' ' O ' ' A' ' 34' ' ' LYS . . . -44.54 168.99 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.342 -0.849 . . . . 0.0 109.807 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 45.0 mttp -106.27 -69.85 0.81 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.425 -0.797 . . . . 0.0 109.248 179.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 8.8 t -108.38 179.0 4.33 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.277 -0.889 . . . . 0.0 108.877 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.516 HG11 ' ND2' ' A' ' 42' ' ' ASN . 25.5 t -59.35 -44.92 93.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 O-C-N 120.956 -1.09 . . . . 0.0 108.942 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.46 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 0.5 OUTLIER -56.32 -27.01 54.32 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 179.449 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -78.89 -33.74 45.38 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 179.069 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.502 ' O ' ' HG3' ' A' ' 45' ' ' LYS . 90.7 t -71.09 -73.4 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.389 0 N-CA-C 107.937 -1.135 . . . . 0.0 107.937 178.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.516 ' ND2' HG11 ' A' ' 38' ' ' VAL . 76.2 m-20 -44.26 -28.19 0.5 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.553 -0.717 . . . . 0.0 109.328 179.15 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.46 ' HB3' ' O ' ' A' ' 39' ' ' GLU . . . -68.55 -52.78 28.18 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.155 -0.966 . . . . 0.0 109.291 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.443 ' HB2' HD12 ' A' ' 32' ' ' ILE . 6.1 mt -60.12 -34.79 74.0 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.369 -0.832 . . . . 0.0 110.295 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.605 ' HE3' ' CA ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -77.17 -27.25 53.68 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.063 -1.023 . . . . 0.0 109.271 -179.777 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -80.47 -22.42 41.06 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.266 -0.897 . . . . 0.0 108.84 179.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.525 ' O ' ' CB ' ' A' ' 51' ' ' ALA . 0.6 OUTLIER -78.18 1.31 21.8 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.466 -0.771 . . . . 0.0 109.037 179.456 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.574 HG12 ' CG ' ' A' ' 28' ' ' TYR . 42.2 mt -80.6 -46.66 21.24 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 O-C-N 121.176 -0.953 . . . . 0.0 108.783 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.54 -30.18 68.43 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.652 -0.655 . . . . 0.0 109.944 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.7 mmtt -100.06 -62.61 1.22 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.108 -0.995 . . . . 0.0 109.751 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.525 ' CB ' ' O ' ' A' ' 47' ' ' GLU . . . -51.05 -21.68 1.97 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.214 -0.929 . . . . 0.0 109.031 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.627 ' CG ' ' N ' ' A' ' 53' ' ' ALA . 1.4 t-80 -148.72 170.94 17.05 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 -179.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.627 ' N ' ' CG ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 118.044 -0.979 . . . . 0.0 109.445 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.501 ' O ' ' CB ' ' A' ' 13' ' ' ASP . 5.8 p30 . . . . . 0 N--CA 1.486 1.336 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.543 ' O ' ' CB ' ' A' ' 14' ' ' ALA . . . -81.02 -14.19 58.14 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.422 -0.799 . . . . 0.0 108.949 179.099 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.565 ' HA ' ' CG2' ' A' ' 32' ' ' ILE . 0.7 OUTLIER -48.36 -68.22 0.2 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.045 -1.034 . . . . 0.0 109.863 -179.823 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -98.9 -23.12 15.46 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.993 -1.067 . . . . 0.0 109.804 -179.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.501 ' CB ' ' O ' ' A' ' 9' ' ' ASN . 4.1 t0 -75.7 -19.21 59.28 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.162 -0.961 . . . . 0.0 109.02 179.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.543 ' CB ' ' O ' ' A' ' 10' ' ' ALA . . . -102.27 -44.31 5.45 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.525 ' CD1' ' O ' ' A' ' 11' ' ' LYS . 59.6 mt -54.99 -29.08 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 121.381 -0.824 . . . . 0.0 109.066 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.64 -37.09 84.98 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.502 -0.749 . . . . 0.0 109.364 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -88.22 -16.18 33.95 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.459 -0.776 . . . . 0.0 110.291 -179.41 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.509 HD21 ' CD ' ' A' ' 45' ' ' LYS . 47.6 mt -83.66 -32.32 25.69 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.041 -1.037 . . . . 0.0 109.745 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.4 mtmt -65.06 -35.58 81.6 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.056 -1.027 . . . . 0.0 109.319 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.08 -10.51 56.79 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.419 -0.8 . . . . 0.0 109.248 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.406 ' HB1' ' O ' ' A' ' 18' ' ' LEU . . . -61.14 -42.49 98.64 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.254 -0.904 . . . . 0.0 109.261 179.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 141.74 -13.58 2.67 Favored Glycine 0 N--CA 1.491 2.353 0 N-CA-C 109.67 -1.372 . . . . 0.0 109.67 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.479 ' CD1' HG22 ' A' ' 48' ' ' ILE . 3.5 mt -105.53 146.39 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.108 -1.23 . . . . 0.0 109.85 -179.713 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.1 p -135.38 15.49 3.45 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 179.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.5 m -59.43 -168.51 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.424 -0.797 . . . . 0.0 109.475 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.506 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 0.3 OUTLIER -126.37 -16.05 5.5 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.222 -0.924 . . . . 0.0 109.862 -179.932 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.638 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 4.2 t80 -80.26 -9.07 59.72 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 120.635 -1.291 . . . . 0.0 109.038 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.671 ' CG ' HG12 ' A' ' 48' ' ' ILE . 17.8 m-85 -102.67 -23.97 13.79 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.342 -0.849 . . . . 0.0 108.837 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.465 ' CE2' ' HB2' ' A' ' 18' ' ' LEU . 80.3 m-85 -96.47 -51.95 4.15 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-O 121.149 0.5 . . . . 0.0 109.759 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.506 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 0.4 OUTLIER -63.66 -19.3 64.78 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.196 -0.94 . . . . 0.0 109.618 179.857 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -87.82 16.3 5.99 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.239 -0.913 . . . . 0.0 109.086 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.565 ' CG2' ' HA ' ' A' ' 11' ' ' LYS . 8.6 mm -76.21 -65.77 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 121.547 -0.721 . . . . 0.0 109.373 -179.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -51.28 -26.17 6.91 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.223 -0.923 . . . . 0.0 109.083 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.435 ' O ' ' C ' ' A' ' 35' ' ' ALA . 0.4 OUTLIER -62.3 -44.71 95.89 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.4 -0.812 . . . . 0.0 109.467 179.924 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.477 ' CB ' HG21 ' A' ' 41' ' ' VAL . . . -42.65 146.73 0.34 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.344 -0.847 . . . . 0.0 109.587 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.436 ' HG3' ' OE2' ' A' ' 40' ' ' GLU . 26.8 mttm -69.44 -64.65 0.84 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.272 -0.893 . . . . 0.0 109.825 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.494 ' OG1' ' HG2' ' A' ' 39' ' ' GLU . 1.2 p -118.82 -163.56 0.97 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.121 -0.987 . . . . 0.0 109.48 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.475 ' HA ' HG22 ' A' ' 41' ' ' VAL . 18.0 t -68.61 -55.36 16.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.251 -0.905 . . . . 0.0 109.741 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.545 ' O ' ' CB ' ' A' ' 43' ' ' ALA . 14.2 pt-20 -50.48 -23.16 2.28 Favored 'General case' 0 C--N 1.295 -1.778 0 O-C-N 121.058 -1.027 . . . . 0.0 108.542 179.592 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.438 ' HA ' ' HB1' ' A' ' 43' ' ' ALA . 1.4 mm-40 -83.1 -38.34 22.6 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.434 -0.791 . . . . 0.0 109.02 179.159 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.527 ' CG1' HG21 ' A' ' 32' ' ' ILE . 11.7 t -63.54 -58.87 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 179.263 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -62.52 -29.78 70.81 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.362 -0.836 . . . . 0.0 108.893 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.545 ' CB ' ' O ' ' A' ' 39' ' ' GLU . . . -65.72 -33.41 75.81 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.413 -0.804 . . . . 0.0 109.642 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.533 ' HG ' ' N ' ' A' ' 45' ' ' LYS . 0.3 OUTLIER -61.07 -39.44 89.87 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.174 -0.954 . . . . 0.0 109.519 -179.752 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.533 ' N ' ' HG ' ' A' ' 44' ' ' LEU . 30.5 tptt -66.61 -18.59 65.45 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.127 -0.983 . . . . 0.0 109.475 -179.874 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.465 ' HB2' ' O ' ' A' ' 43' ' ' ALA . 26.0 m-80 -73.41 -40.02 64.6 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.203 -0.936 . . . . 0.0 109.232 179.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.536 ' O ' ' CB ' ' A' ' 51' ' ' ALA . 39.1 mt-10 -62.65 -27.07 68.97 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.273 -0.892 . . . . 0.0 109.308 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.671 HG12 ' CG ' ' A' ' 28' ' ' TYR . 2.5 mp -70.73 -29.81 39.44 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 179.35 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.427 HD11 ' N ' ' A' ' 49' ' ' LEU . 4.5 mp -59.31 -30.39 68.3 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 179.238 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -122.41 5.5 9.63 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.209 -0.932 . . . . 0.0 109.722 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.536 ' CB ' ' O ' ' A' ' 47' ' ' GLU . . . -101.54 -49.54 3.99 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.248 -0.907 . . . . 0.0 109.907 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.59 ' CD2' HG21 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -106.91 -6.82 17.35 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.314 -0.866 . . . . 0.0 110.161 -178.987 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.416 ' HB1' ' CD2' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 118.112 -0.947 . . . . 0.0 109.539 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.416 ' CG ' ' N ' ' A' ' 10' ' ' ALA . 6.1 p30 . . . . . 0 N--CA 1.489 1.499 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.486 ' HB2' ' CG1' ' A' ' 41' ' ' VAL . . . -80.99 -4.51 55.34 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.322 -0.861 . . . . 0.0 109.014 179.199 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.415 ' O ' HG13 ' A' ' 15' ' ' ILE . 0.1 OUTLIER -50.43 -75.99 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.363 -0.836 . . . . 0.0 110.201 -179.572 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.435 ' O ' ' HB1' ' A' ' 16' ' ' ALA . 26.0 tt0 -76.92 -18.42 58.3 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.144 -0.972 . . . . 0.0 110.369 -179.2 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.6 -18.28 62.23 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.947 -1.096 . . . . 0.0 109.441 -179.767 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.495 ' O ' HD21 ' A' ' 18' ' ' LEU . . . -106.75 -38.79 6.0 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 179.58 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.533 HG12 ' CD1' ' A' ' 29' ' ' PHE . 35.8 mt -61.9 -28.36 44.14 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 CA-C-O 121.752 0.787 . . . . 0.0 109.263 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.435 ' HB1' ' O ' ' A' ' 12' ' ' GLU . . . -66.06 -3.06 4.75 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.651 -0.655 . . . . 0.0 110.941 -178.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.526 ' CG ' ' O ' ' A' ' 17' ' ' GLU . 17.0 tt0 -117.56 1.94 12.32 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 120.847 -1.158 . . . . 0.0 109.933 -179.531 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.499 ' HG ' ' HE3' ' A' ' 45' ' ' LYS . 3.7 mm? -100.44 -39.68 7.84 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.001 -1.062 . . . . 0.0 110.511 -179.47 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.63 -19.71 64.06 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.018 -1.051 . . . . 0.0 109.942 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.473 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -96.94 -14.8 21.49 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.144 -0.972 . . . . 0.0 109.381 179.892 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -79.81 -39.33 31.02 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.156 -0.965 . . . . 0.0 109.587 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 125.25 14.07 3.39 Favored Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.954 -1.259 . . . . 0.0 109.954 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.471 HD12 HG23 ' A' ' 48' ' ' ILE . 34.1 mt -105.03 117.99 51.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.078 -1.248 . . . . 0.0 109.257 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.2 p -113.44 -4.74 13.55 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.233 -0.917 . . . . 0.0 109.938 -179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -45.97 133.58 8.66 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.101 -0.999 . . . . 0.0 109.149 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.467 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 7.4 p-10 -88.47 -2.84 58.82 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.282 -0.886 . . . . 0.0 109.732 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.472 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 26.1 t80 -76.21 -13.94 60.16 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.166 -0.959 . . . . 0.0 109.243 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.594 ' CG ' HG12 ' A' ' 48' ' ' ILE . 22.3 m-85 -100.6 -45.21 5.59 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.428 -0.795 . . . . 0.0 108.973 179.734 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.533 ' CD1' HG12 ' A' ' 15' ' ' ILE . 5.5 m-85 -66.84 -44.62 80.58 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.473 -0.767 . . . . 0.0 109.559 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.467 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 14.4 m120 -68.74 -24.66 64.48 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.322 -0.861 . . . . 0.0 110.055 -179.799 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.428 ' HB1' ' O ' ' A' ' 27' ' ' PHE . . . -92.49 -17.27 24.74 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.123 -0.986 . . . . 0.0 110.565 -178.828 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.452 HD12 ' HG2' ' A' ' 45' ' ' LYS . 0.6 OUTLIER -53.69 -39.05 36.81 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 120.981 -1.074 . . . . 0.0 109.242 -179.853 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -71.17 -38.82 72.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.184 -0.947 . . . . 0.0 109.442 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.418 ' O ' ' C ' ' A' ' 35' ' ' ALA . 16.7 mmtt -52.7 -25.65 11.62 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.287 -0.883 . . . . 0.0 109.408 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.471 ' HB2' ' HB3' ' A' ' 40' ' ' GLU . . . -41.69 137.12 1.73 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.457 -0.777 . . . . 0.0 109.764 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.5 mtpt -75.85 -64.85 0.99 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.213 -0.93 . . . . 0.0 109.275 179.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.457 HG21 ' OE1' ' A' ' 40' ' ' GLU . 9.0 t -109.71 -178.4 3.53 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.213 -0.929 . . . . 0.0 108.901 179.541 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 12.1 t -61.25 -46.33 96.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 O-C-N 120.896 -1.127 . . . . 0.0 108.942 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.539 ' O ' ' CB ' ' A' ' 43' ' ' ALA . 5.8 mt-10 -53.34 -25.72 16.26 Favored 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 179.07 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.492 ' OE1' ' N ' ' A' ' 40' ' ' GLU . 0.8 OUTLIER -79.68 -37.14 36.48 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 179.071 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.486 ' CG1' ' HB2' ' A' ' 10' ' ' ALA . 38.4 t -65.53 -66.12 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.434 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 28.2 m-80 -55.68 -29.41 59.32 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.48 -0.762 . . . . 0.0 109.579 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.539 ' CB ' ' O ' ' A' ' 39' ' ' GLU . . . -67.52 -39.87 85.1 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.216 -0.927 . . . . 0.0 109.622 -179.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.45 ' CB ' HD13 ' A' ' 32' ' ' ILE . 3.6 mt -61.39 -45.51 94.06 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.207 -0.933 . . . . 0.0 109.791 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.499 ' HE3' ' HG ' ' A' ' 18' ' ' LEU . 14.1 mmtm -63.14 -25.86 68.55 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.125 -0.984 . . . . 0.0 109.319 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -80.43 -19.83 45.27 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.283 -0.886 . . . . 0.0 109.743 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.471 ' O ' ' HB1' ' A' ' 51' ' ' ALA . 6.8 tt0 -79.51 -16.57 55.79 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.158 -0.964 . . . . 0.0 109.744 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.594 HG12 ' CG ' ' A' ' 28' ' ' TYR . 64.0 mt -71.46 -42.05 73.01 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 O-C-N 120.877 -1.139 . . . . 0.0 108.548 179.525 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 87.4 mt -51.89 -26.41 10.13 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.417 -0.802 . . . . 0.0 109.338 179.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.42 ' O ' ' N ' ' A' ' 52' ' ' HIS . 0.1 OUTLIER -112.31 -71.15 0.77 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.186 -0.946 . . . . 0.0 109.965 -179.89 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.471 ' HB1' ' O ' ' A' ' 47' ' ' GLU . . . -43.58 -25.44 0.16 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.311 -0.868 . . . . 0.0 109.844 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.599 ' CD2' ' HB1' ' A' ' 53' ' ' ALA . 0.0 OUTLIER -130.32 152.04 50.17 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 121.22 -0.925 . . . . 0.0 108.707 -179.644 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.599 ' HB1' ' CD2' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 118.009 -0.996 . . . . 0.0 109.247 -179.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.477 ' OD1' HG23 ' A' ' 38' ' ' VAL . 0.5 OUTLIER . . . . . 0 N--CA 1.487 1.404 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.481 ' O ' ' HB1' ' A' ' 14' ' ' ALA . . . -80.95 -18.97 45.25 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 121.291 -0.88 . . . . 0.0 108.863 179.545 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.543 ' O ' ' CG1' ' A' ' 15' ' ' ILE . 4.7 ptmt -74.88 -14.8 60.71 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.354 -0.842 . . . . 0.0 109.615 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -100.97 -37.84 8.46 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.055 -1.028 . . . . 0.0 109.513 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -74.85 -26.53 59.76 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.247 -0.908 . . . . 0.0 109.684 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.485 ' O ' HD22 ' A' ' 18' ' ' LEU . . . -92.97 -42.58 9.38 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.089 -1.007 . . . . 0.0 109.626 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.575 HG22 ' CE1' ' A' ' 29' ' ' PHE . 20.4 mt -63.28 -31.0 51.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 CA-C-O 121.776 0.798 . . . . 0.0 108.999 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.47 ' HA ' ' HD2' ' A' ' 19' ' ' LYS . . . -67.24 -7.0 20.64 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.641 -0.662 . . . . 0.0 110.132 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.457 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 9.4 tp10 -109.27 -5.97 15.69 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.231 -0.918 . . . . 0.0 109.522 -179.745 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.523 ' N ' HD21 ' A' ' 18' ' ' LEU . 4.0 mm? -93.49 -41.01 10.02 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.113 -0.992 . . . . 0.0 109.031 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.486 ' HG2' ' N ' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -56.42 -23.31 37.59 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.504 -0.747 . . . . 0.0 109.524 -179.942 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.486 ' N ' ' HG2' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -97.64 -20.09 17.87 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.293 -0.879 . . . . 0.0 109.142 179.551 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -75.41 -28.67 59.51 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.259 -0.901 . . . . 0.0 109.575 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 128.36 -45.86 1.12 Allowed Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.26 -1.536 . . . . 0.0 109.26 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.524 HD12 ' NE2' ' A' ' 52' ' ' HIS . 5.5 mt -45.24 122.83 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.205 -1.173 . . . . 0.0 109.008 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -128.93 10.51 5.95 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.162 -0.961 . . . . 0.0 109.842 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.7 t -66.09 156.41 33.96 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.197 -0.939 . . . . 0.0 109.198 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.473 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 2.7 t70 -103.38 -4.11 24.58 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.103 -0.998 . . . . 0.0 109.825 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.472 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 5.9 t80 -77.57 -18.07 57.27 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.11 -0.993 . . . . 0.0 109.232 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.647 ' CG ' ' CG1' ' A' ' 48' ' ' ILE . 22.5 m-85 -95.46 -41.12 9.13 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.263 -0.898 . . . . 0.0 108.926 179.558 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.575 ' CE1' HG22 ' A' ' 15' ' ' ILE . 9.6 m-30 -71.03 -49.88 40.08 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.434 -0.791 . . . . 0.0 109.465 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.473 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 3.5 t-20 -59.12 -52.37 66.03 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.24 -0.912 . . . . 0.0 109.671 -179.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.16 -22.07 65.58 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.27 -0.894 . . . . 0.0 109.645 -179.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.455 ' HB ' ' O ' ' A' ' 29' ' ' PHE . 1.4 mm -67.64 -53.94 27.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.205 -0.935 . . . . 0.0 109.399 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.51 ' CB ' ' HD2' ' A' ' 11' ' ' LYS . 1.6 p-10 -73.53 -1.96 20.74 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.149 -0.969 . . . . 0.0 109.461 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.483 ' O ' ' O ' ' A' ' 35' ' ' ALA . 7.2 mttt -105.3 -8.86 17.99 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.27 -0.894 . . . . 0.0 109.817 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.483 ' O ' ' O ' ' A' ' 34' ' ' LYS . . . -55.2 -158.89 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.531 -0.731 . . . . 0.0 110.088 -179.712 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.7 mttt -110.02 -67.47 0.99 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.128 -0.983 . . . . 0.0 110.087 -179.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.482 ' O ' HG21 ' A' ' 41' ' ' VAL . 0.7 OUTLIER -118.79 -168.5 1.56 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.979 -1.075 . . . . 0.0 109.645 -179.565 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.477 HG23 ' OD1' ' A' ' 9' ' ' ASN . 65.3 t -70.41 -31.6 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.201 -0.937 . . . . 0.0 109.931 -179.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.484 ' OE2' ' N ' ' A' ' 39' ' ' GLU . 1.7 mm-40 -71.01 -26.75 63.26 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 120.945 -1.097 . . . . 0.0 108.139 179.319 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.443 ' HB3' ' HB3' ' A' ' 35' ' ' ALA . 0.1 OUTLIER -84.51 -26.7 27.92 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 178.736 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.482 HG21 ' O ' ' A' ' 37' ' ' THR . 53.9 t -73.8 -70.04 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 178.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -50.14 -29.08 8.4 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 178.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.46 ' CB ' ' O ' ' A' ' 39' ' ' GLU . . . -64.48 -50.66 66.57 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.389 -0.819 . . . . 0.0 108.923 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.532 ' O ' ' CD1' ' A' ' 48' ' ' ILE . 5.9 mt -61.09 -46.58 90.05 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.314 -0.867 . . . . 0.0 109.922 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.468 ' HE3' HD22 ' A' ' 18' ' ' LEU . 0.2 OUTLIER -56.09 -40.9 74.37 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.118 -0.989 . . . . 0.0 109.805 -179.596 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.1 m-20 -76.43 -18.74 58.67 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.149 -0.97 . . . . 0.0 109.388 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.404 ' O ' ' CB ' ' A' ' 51' ' ' ALA . 8.6 tp10 -73.17 -19.89 61.02 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.259 -0.901 . . . . 0.0 109.407 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.647 ' CG1' ' CG ' ' A' ' 28' ' ' TYR . 2.9 mp -68.62 -27.76 37.47 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 179.075 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.46 ' HB2' ' HE2' ' A' ' 50' ' ' LYS . 2.3 mm? -58.24 -38.3 76.59 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.612 -0.68 . . . . 0.0 109.951 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.46 ' HE2' ' HB2' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -114.69 0.16 13.79 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.929 -1.107 . . . . 0.0 110.201 -179.432 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.404 ' CB ' ' O ' ' A' ' 47' ' ' GLU . . . -100.62 -12.17 19.43 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 121.182 -0.949 . . . . 0.0 109.172 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.641 ' CG ' ' N ' ' A' ' 53' ' ' ALA . 0.0 OUTLIER -154.47 -171.61 3.92 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.429 -0.794 . . . . 0.0 108.886 -179.723 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.641 ' N ' ' CG ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 117.945 -1.026 . . . . 0.0 109.585 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.4 p30 . . . . . 0 N--CA 1.488 1.427 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.53 ' CB ' HG13 ' A' ' 41' ' ' VAL . . . -80.44 0.11 34.85 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.487 -0.758 . . . . 0.0 109.255 179.397 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.48 ' HG2' HG23 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -51.31 -88.38 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.961 -1.087 . . . . 0.0 109.49 -179.686 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -67.08 -10.73 53.08 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.064 -1.022 . . . . 0.0 109.907 -179.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.56 -72.31 0.19 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.083 -1.011 . . . . 0.0 109.259 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.488 ' O ' HD21 ' A' ' 18' ' ' LEU . . . -64.16 -35.72 81.72 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.409 -0.807 . . . . 0.0 109.858 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.566 HG21 ' CE1' ' A' ' 29' ' ' PHE . 33.8 mt -61.2 -28.55 44.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 CA-C-O 121.774 0.797 . . . . 0.0 109.389 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.77 -4.15 8.41 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.823 -0.548 . . . . 0.0 110.893 -178.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.483 ' CG ' ' O ' ' A' ' 17' ' ' GLU . 12.1 tt0 -116.12 -2.8 12.14 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 120.938 -1.101 . . . . 0.0 109.874 -179.609 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.581 ' N ' ' CD2' ' A' ' 18' ' ' LEU . 3.6 mm? -99.59 -40.14 7.95 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.945 -1.097 . . . . 0.0 109.707 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.8 ttpp -53.76 -23.81 13.07 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.225 -0.922 . . . . 0.0 109.601 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.77 -22.39 16.43 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.224 -0.922 . . . . 0.0 109.712 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.02 -7.41 28.88 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.179 -0.951 . . . . 0.0 109.534 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.72 -9.3 58.52 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.256 -1.537 . . . . 0.0 109.256 -179.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.507 HD13 ' CG2' ' A' ' 48' ' ' ILE . 4.9 mm -69.15 149.05 11.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.302 -1.117 . . . . 0.0 109.583 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.4 p -155.88 20.13 0.38 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.315 -0.866 . . . . 0.0 109.346 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.0 m -80.17 142.17 34.99 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.361 -0.837 . . . . 0.0 109.428 179.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.471 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 1.8 p30 -88.96 -11.77 43.46 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.309 -0.869 . . . . 0.0 109.561 -179.748 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.511 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 5.8 t80 -75.7 -12.56 60.22 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.208 -0.933 . . . . 0.0 109.121 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.64 ' CG ' ' CG1' ' A' ' 48' ' ' ILE . 24.0 m-85 -100.77 -43.2 6.19 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.33 -0.857 . . . . 0.0 109.204 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.566 ' CE1' HG21 ' A' ' 15' ' ' ILE . 5.2 m-85 -71.87 -45.17 62.27 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.503 -0.748 . . . . 0.0 109.765 -179.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.471 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 0.1 OUTLIER -65.27 -33.57 76.3 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.117 -0.989 . . . . 0.0 109.141 179.96 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -75.32 -11.72 60.12 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.38 -0.825 . . . . 0.0 109.184 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.499 ' CD1' ' HD2' ' A' ' 45' ' ' LYS . 4.3 mm -74.4 -25.2 19.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.343 -0.848 . . . . 0.0 109.367 179.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -80.32 -31.19 38.16 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.185 -0.947 . . . . 0.0 109.252 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.466 ' O ' ' C ' ' A' ' 35' ' ' ALA . 15.6 mtpp -77.12 -17.2 58.82 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.22 -0.925 . . . . 0.0 109.57 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.48 ' HB2' HG21 ' A' ' 41' ' ' VAL . . . -36.97 155.17 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 121.513 0.673 . . . . 0.0 110.497 -179.332 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.8 mmtm -95.6 -66.63 0.9 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.433 -0.792 . . . . 0.0 109.682 -179.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.484 ' O ' HG21 ' A' ' 41' ' ' VAL . 38.2 p -116.44 178.22 4.41 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.149 -0.969 . . . . 0.0 109.198 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 26.3 t -63.29 -42.96 98.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.192 -0.942 . . . . 0.0 109.46 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.484 ' O ' ' CB ' ' A' ' 43' ' ' ALA . 4.4 mm-40 -62.51 -23.07 66.75 Favored 'General case' 0 C--N 1.298 -1.661 0 O-C-N 121.219 -0.926 . . . . 0.0 109.035 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.407 ' HB2' ' H ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -85.71 -30.24 23.3 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.32 -0.862 . . . . 0.0 108.992 179.651 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.53 HG13 ' CB ' ' A' ' 10' ' ' ALA . 12.8 t -71.78 -61.58 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.434 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 179.005 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -57.72 -33.14 68.11 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.727 -0.608 . . . . 0.0 109.448 179.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.484 ' CB ' ' O ' ' A' ' 39' ' ' GLU . . . -69.9 -31.74 69.69 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.323 -0.861 . . . . 0.0 109.753 -179.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.543 ' O ' ' CD1' ' A' ' 48' ' ' ILE . 0.2 OUTLIER -78.46 -24.75 45.87 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 121.105 -0.997 . . . . 0.0 109.346 -179.828 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.499 ' HD2' ' CD1' ' A' ' 32' ' ' ILE . 0.2 OUTLIER -80.5 -30.8 37.29 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.115 -0.991 . . . . 0.0 110.242 -179.314 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -79.87 -15.9 56.45 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 120.992 -1.067 . . . . 0.0 109.982 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.491 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 5.8 pt-20 -82.83 -6.98 59.68 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.058 -1.026 . . . . 0.0 109.521 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.64 ' CG1' ' CG ' ' A' ' 28' ' ' TYR . 1.6 mp -71.74 -48.42 51.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.473 0 N-CA-C 107.81 -1.182 . . . . 0.0 107.81 178.531 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.437 ' O ' ' C ' ' A' ' 53' ' ' ALA . 1.2 tp -50.2 -20.74 1.1 Allowed 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.297 -0.877 . . . . 0.0 109.793 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.421 ' O ' ' N ' ' A' ' 52' ' ' HIS . 0.0 OUTLIER -105.84 -74.49 0.65 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.991 -1.068 . . . . 0.0 109.877 -179.704 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -43.75 -22.62 0.05 Allowed 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.526 -0.734 . . . . 0.0 111.081 -179.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.583 ' CD2' HG21 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -126.91 -8.48 6.05 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.935 -1.103 . . . . 0.0 110.578 -178.397 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.437 ' C ' ' O ' ' A' ' 49' ' ' LEU . . . . . . . . 0 N--CA 1.491 1.587 0 O-C-N 120.943 -1.098 . . . . 0.0 109.643 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -81.03 -13.55 58.72 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.096 -1.003 . . . . 0.0 109.194 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.492 ' HA ' ' CG2' ' A' ' 32' ' ' ILE . 0.0 OUTLIER -53.73 -92.26 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.365 -0.834 . . . . 0.0 110.163 -179.289 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.508 ' HA ' ' HB ' ' A' ' 15' ' ' ILE . 26.0 mt-10 -47.04 -23.57 0.5 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.294 -0.879 . . . . 0.0 110.342 -179.109 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -56.35 -52.1 65.83 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.17 -0.956 . . . . 0.0 108.958 179.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.528 ' O ' ' CD1' ' A' ' 18' ' ' LEU . . . -78.14 -47.92 17.1 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.281 -0.887 . . . . 0.0 109.238 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.556 ' HA ' ' CD2' ' A' ' 18' ' ' LEU . 55.0 mt -46.34 -30.15 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 O-C-N 121.324 -0.86 . . . . 0.0 109.481 -179.801 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.4 -47.25 70.84 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -79.32 4.75 14.29 Favored 'General case' 0 C--N 1.296 -1.755 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.271 178.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.651 ' HB3' ' CE2' ' A' ' 29' ' ' PHE . 5.2 mp -91.57 -46.78 7.77 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.181 -0.95 . . . . 0.0 110.197 -178.191 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.8 ttpt -58.77 -27.62 65.16 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.054 -1.029 . . . . 0.0 109.179 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.0 tttt -95.01 -14.49 24.29 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.398 -0.813 . . . . 0.0 109.116 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.58 -54.73 31.47 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.312 -0.868 . . . . 0.0 109.627 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 151.01 -14.16 0.86 Allowed Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.924 -1.271 . . . . 0.0 109.924 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.2 mt -103.65 161.24 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 120.988 -1.301 . . . . 0.0 109.482 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.4 p -147.81 15.97 1.09 Allowed 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 179.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.72 174.03 0.07 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.366 -0.834 . . . . 0.0 109.429 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.504 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 1.1 m-20 -112.13 -16.02 13.12 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.346 -0.846 . . . . 0.0 109.353 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.556 ' CD1' ' O ' ' A' ' 27' ' ' PHE . 2.8 t80 -81.27 -20.78 40.17 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 120.869 -1.144 . . . . 0.0 108.864 179.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.609 ' CE2' HG21 ' A' ' 48' ' ' ILE . 18.8 m-30 -93.16 -4.75 51.58 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.372 -0.83 . . . . 0.0 109.351 179.482 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.651 ' CE2' ' HB3' ' A' ' 18' ' ' LEU . 23.5 m-85 -115.71 -55.64 2.41 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.475 -0.765 . . . . 0.0 109.57 -179.553 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.504 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 1.0 OUTLIER -64.12 -36.34 83.7 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.548 -0.72 . . . . 0.0 109.749 179.74 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.45 ' O ' ' HB2' ' A' ' 34' ' ' LYS . . . -80.88 -0.11 37.63 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.256 -0.903 . . . . 0.0 109.354 -179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.5 HG21 HD11 ' A' ' 32' ' ' ILE . 15.6 mm -62.41 -55.55 23.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.445 -0.784 . . . . 0.0 109.606 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.5 p30 -64.26 -23.41 67.29 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.257 -0.902 . . . . 0.0 109.269 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.45 ' HB2' ' O ' ' A' ' 31' ' ' ALA . 0.4 OUTLIER -61.63 -28.28 69.26 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.165 -0.959 . . . . 0.0 109.191 179.615 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.419 ' C ' ' O ' ' A' ' 34' ' ' LYS . . . -41.54 159.04 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.424 -0.798 . . . . 0.0 109.917 -179.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 9.8 mtpt -92.04 -61.84 1.54 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.433 -0.792 . . . . 0.0 109.413 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.469 ' OG1' ' N ' ' A' ' 38' ' ' VAL . 0.4 OUTLIER -117.06 178.47 4.34 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.575 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.469 ' N ' ' OG1' ' A' ' 37' ' ' THR . 96.4 t -56.78 -52.98 47.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.094 -1.004 . . . . 0.0 109.143 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.543 ' O ' ' CB ' ' A' ' 43' ' ' ALA . 10.6 pt-20 -48.42 -27.98 2.97 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.352 -0.843 . . . . 0.0 108.934 179.521 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.428 ' HB2' ' O ' ' A' ' 37' ' ' THR . 19.7 mm-40 -79.1 -39.17 34.41 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.329 -0.857 . . . . 0.0 108.852 179.582 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.427 ' O ' ' HB2' ' A' ' 44' ' ' LEU . 21.6 t -64.27 -64.62 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 178.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -55.16 -36.19 65.57 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.432 -0.793 . . . . 0.0 109.204 179.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.543 ' CB ' ' O ' ' A' ' 39' ' ' GLU . . . -59.03 -39.73 82.83 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.381 -0.824 . . . . 0.0 109.08 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.427 ' HB2' ' O ' ' A' ' 41' ' ' VAL . 8.5 mt -53.07 -44.55 67.57 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.337 -0.852 . . . . 0.0 109.831 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.568 ' CE ' ' HG ' ' A' ' 18' ' ' LEU . 4.7 tptp -62.74 -45.34 93.17 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.043 -1.036 . . . . 0.0 109.752 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.448 ' OD1' ' HA ' ' A' ' 43' ' ' ALA . 1.9 m120 -66.49 -19.96 65.92 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.421 -0.799 . . . . 0.0 109.755 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.522 ' O ' ' CB ' ' A' ' 51' ' ' ALA . 0.0 OUTLIER -86.67 11.93 11.81 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.163 -0.961 . . . . 0.0 109.326 179.797 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.618 HG21 ' CG ' ' A' ' 52' ' ' HIS . 11.8 mm -96.55 -51.99 9.88 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.566 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 178.532 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 7.8 mt -52.96 -22.97 6.29 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 121.357 -0.839 . . . . 0.0 108.883 178.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.4 mmpt? -107.68 -45.83 3.94 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.132 -0.98 . . . . 0.0 109.532 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.522 ' CB ' ' O ' ' A' ' 47' ' ' GLU . . . -92.02 44.22 1.16 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.223 -0.923 . . . . 0.0 109.429 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.618 ' CG ' HG21 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -178.2 -27.86 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.191 -0.943 . . . . 0.0 109.979 179.865 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.523 ' N ' ' CD2' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.49 1.569 0 O-C-N 120.999 -1.063 . . . . 0.0 109.505 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.464 ' CG ' ' N ' ' A' ' 10' ' ' ALA . 2.4 p30 . . . . . 0 N--CA 1.493 1.724 0 CA-C-O 120.93 0.395 . . . . 0.0 110.257 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.485 ' O ' ' C ' ' A' ' 11' ' ' LYS . . . -80.83 -31.64 35.46 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.878 -1.139 . . . . 0.0 110.115 -179.571 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.546 ' O ' ' CG1' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -33.29 -55.88 0.41 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.533 -0.73 . . . . 0.0 111.609 -179.138 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -74.67 -50.97 15.67 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 120.868 -1.145 . . . . 0.0 111.893 -177.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -47.76 -56.97 6.18 Favored 'General case' 0 C--N 1.299 -1.626 0 O-C-N 120.555 -1.341 . . . . 0.0 110.142 -178.794 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.448 ' HB2' ' HE3' ' A' ' 45' ' ' LYS . . . -69.62 -58.28 4.13 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.147 -0.971 . . . . 0.0 110.621 -179.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.611 HG12 ' CD1' ' A' ' 29' ' ' PHE . 65.5 mt -42.02 -30.64 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.041 -1.037 . . . . 0.0 109.607 -179.448 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.7 -51.56 40.34 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.419 -0.801 . . . . 0.0 109.438 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.44 ' O ' ' CG ' ' A' ' 17' ' ' GLU . 19.9 tt0 -70.24 -5.52 28.2 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.393 -0.817 . . . . 0.0 109.405 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.554 ' HB2' ' CE ' ' A' ' 45' ' ' LYS . 1.3 tm? -93.68 -39.8 10.59 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.39 -0.819 . . . . 0.0 109.751 -179.56 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.449 ' HG3' ' O ' ' A' ' 19' ' ' LYS . 0.4 OUTLIER -67.59 -23.07 65.34 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.298 -0.877 . . . . 0.0 109.733 -179.463 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.19 -26.07 16.13 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.142 -0.974 . . . . 0.0 109.381 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.26 -37.2 54.71 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.271 -0.893 . . . . 0.0 109.297 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 130.2 11.11 2.59 Favored Glycine 0 N--CA 1.491 2.305 0 C-N-CA 119.939 -1.124 . . . . 0.0 110.393 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.645 ' CG2' ' CE1' ' A' ' 52' ' ' HIS . 0.0 OUTLIER -127.18 154.71 37.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 120.928 -1.337 . . . . 0.0 109.708 179.813 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.413 HG21 ' HD3' ' A' ' 19' ' ' LYS . 18.0 p -140.42 19.63 2.39 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.381 -0.824 . . . . 0.0 109.021 179.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.1 t -58.01 124.28 18.78 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.377 -0.827 . . . . 0.0 109.717 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -80.06 -1.87 41.85 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.239 -0.913 . . . . 0.0 109.405 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -73.69 -33.61 64.49 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.37 -0.831 . . . . 0.0 109.275 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.596 ' CE2' HG21 ' A' ' 48' ' ' ILE . 21.9 m-85 -80.59 -44.98 18.09 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.328 -0.857 . . . . 0.0 109.414 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.611 ' CD1' HG12 ' A' ' 15' ' ' ILE . 18.3 m-30 -62.8 -53.34 55.8 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.315 -0.866 . . . . 0.0 109.859 -179.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.428 ' O ' ' OD1' ' A' ' 33' ' ' ASN . 12.0 t-20 -54.54 -41.83 70.2 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.153 -0.967 . . . . 0.0 109.044 179.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.73 -25.22 63.74 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.498 -0.751 . . . . 0.0 109.451 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.484 ' CG2' ' HG2' ' A' ' 11' ' ' LYS . 5.3 mt -64.43 -46.2 93.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.268 -0.895 . . . . 0.0 109.344 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.428 ' OD1' ' O ' ' A' ' 30' ' ' ASN . 1.2 p-10 -71.87 -10.47 59.81 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.03 -1.044 . . . . 0.0 109.066 179.71 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.405 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -96.97 -20.7 17.9 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.294 -0.879 . . . . 0.0 109.363 179.938 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.466 ' CB ' ' HB3' ' A' ' 40' ' ' GLU . . . -46.75 169.66 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.28 -0.887 . . . . 0.0 109.458 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.7 mtmt -84.82 -58.91 2.52 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.218 -0.926 . . . . 0.0 109.281 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 15.1 t -131.2 -174.16 3.31 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.254 -0.904 . . . . 0.0 109.297 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 54.9 t -60.71 -39.99 83.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.064 -1.022 . . . . 0.0 109.256 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.47 ' O ' ' CB ' ' A' ' 43' ' ' ALA . 3.5 mt-10 -56.2 -28.76 59.46 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 179.159 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.466 ' HB3' ' CB ' ' A' ' 35' ' ' ALA . 0.4 OUTLIER -79.62 -31.41 41.64 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 179.037 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.452 ' CG1' HG22 ' A' ' 32' ' ' ILE . 16.3 t -66.73 -68.05 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 178.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 45.7 m-20 -53.16 -33.92 54.63 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.616 -0.678 . . . . 0.0 109.635 179.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.47 ' CB ' ' O ' ' A' ' 39' ' ' GLU . . . -67.39 -34.95 78.33 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.339 -0.851 . . . . 0.0 110.31 -179.267 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 12.4 mt -76.95 -38.81 52.59 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.029 -1.044 . . . . 0.0 110.065 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.554 ' CE ' ' HB2' ' A' ' 18' ' ' LEU . 0.0 OUTLIER -61.28 -29.57 69.94 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.169 -0.957 . . . . 0.0 109.943 -179.521 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 24.1 m-20 -71.24 -25.56 62.53 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.188 -0.945 . . . . 0.0 109.287 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.511 ' O ' ' CB ' ' A' ' 51' ' ' ALA . 2.8 tt0 -83.43 9.04 12.03 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.233 -0.917 . . . . 0.0 109.04 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.596 HG21 ' CE2' ' A' ' 28' ' ' TYR . 43.9 mt -88.34 -43.18 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 179.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -69.94 -10.93 60.29 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.594 -0.692 . . . . 0.0 110.401 -179.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -120.38 -31.55 4.32 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.695 -1.253 . . . . 0.0 110.835 -179.253 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.511 ' CB ' ' O ' ' A' ' 47' ' ' GLU . . . -79.56 -20.07 47.91 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.881 -1.137 . . . . 0.0 110.617 -179.058 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.645 ' CE1' ' CG2' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -125.83 -16.79 5.58 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.955 -1.091 . . . . 0.0 109.9 -179.474 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.533 0 O-C-N 121.037 -1.039 . . . . 0.0 109.371 179.595 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.552 ' ND2' ' N ' ' A' ' 9' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.689 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.545 ' O ' ' CB ' ' A' ' 14' ' ' ALA . . . -70.68 -3.65 19.57 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.252 -0.905 . . . . 0.0 109.405 179.426 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.528 ' CD ' ' HA ' ' A' ' 33' ' ' ASN . 0.7 OUTLIER -54.47 -53.28 56.43 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.064 -1.022 . . . . 0.0 109.94 -179.823 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -88.83 -42.1 12.08 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.049 -1.032 . . . . 0.0 109.626 -179.648 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.91 -16.26 28.21 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.018 -1.051 . . . . 0.0 108.747 179.44 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.545 ' CB ' ' O ' ' A' ' 10' ' ' ALA . . . -102.99 -41.46 6.11 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.355 -0.84 . . . . 0.0 108.866 179.455 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.575 ' CG1' ' CD1' ' A' ' 32' ' ' ILE . 22.7 mt -52.88 -33.61 19.31 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 179.147 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.87 -38.88 79.99 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 179.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.534 ' CG ' ' O ' ' A' ' 17' ' ' GLU . 15.6 tt0 -90.22 4.22 51.22 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 179.228 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.538 HD21 ' CE ' ' A' ' 45' ' ' LYS . 20.1 mt -96.11 -55.33 3.0 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.262 -0.899 . . . . 0.0 108.725 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 25.5 ttpt -59.05 -40.9 86.54 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.81 -26.53 68.67 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.355 -0.841 . . . . 0.0 108.948 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.92 -39.34 65.75 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.328 -0.857 . . . . 0.0 109.141 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 134.8 -1.72 3.94 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.742 -1.343 . . . . 0.0 109.742 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.457 HD12 ' CG2' ' A' ' 48' ' ' ILE . 9.4 mt -106.74 158.99 6.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.096 -1.237 . . . . 0.0 109.63 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.4 HG21 ' O ' ' A' ' 23' ' ' ILE . 5.8 p -151.17 18.4 0.76 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.414 -0.804 . . . . 0.0 108.926 179.584 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -62.69 -177.44 0.15 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.395 -0.816 . . . . 0.0 109.447 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.467 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 3.4 t0 -116.18 -21.0 9.59 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.42 -0.8 . . . . 0.0 109.009 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.54 ' CD1' ' O ' ' A' ' 27' ' ' PHE . 5.7 t80 -81.04 -3.92 53.44 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 120.991 -1.068 . . . . 0.0 108.443 179.001 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.586 ' CG ' HG12 ' A' ' 48' ' ' ILE . 16.9 m-30 -109.42 -6.9 15.29 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.527 -0.733 . . . . 0.0 109.614 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.521 ' CE1' ' HB3' ' A' ' 18' ' ' LEU . 61.6 m-85 -119.38 -43.93 2.59 Favored 'General case' 0 C--N 1.298 -1.672 0 CA-C-O 121.728 0.775 . . . . 0.0 109.381 -178.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.467 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 0.8 OUTLIER -65.5 -21.06 66.58 Favored 'General case' 0 C--N 1.295 -1.765 0 O-C-N 121.738 -0.601 . . . . 0.0 109.38 179.301 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.28 -3.1 58.71 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.224 -0.922 . . . . 0.0 109.823 -179.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.575 ' CD1' ' CG1' ' A' ' 15' ' ' ILE . 18.1 mt -65.27 -61.6 1.62 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.394 -0.816 . . . . 0.0 109.759 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.528 ' HA ' ' CD ' ' A' ' 11' ' ' LYS . 0.4 OUTLIER -65.29 -9.46 24.42 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.196 -0.94 . . . . 0.0 109.807 -179.617 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.455 ' O ' ' O ' ' A' ' 35' ' ' ALA . 18.7 mmtm -93.62 -19.1 21.47 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.189 -0.945 . . . . 0.0 109.395 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.455 ' O ' ' O ' ' A' ' 34' ' ' LYS . . . -55.17 -164.52 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.413 -0.805 . . . . 0.0 109.72 -179.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.7 -63.89 1.37 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.191 -0.943 . . . . 0.0 109.715 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.426 ' O ' HG21 ' A' ' 41' ' ' VAL . 21.4 p -120.02 178.22 4.7 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.166 -0.958 . . . . 0.0 109.444 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.499 HG21 ' ND2' ' A' ' 9' ' ' ASN . 86.6 t -62.33 -43.45 98.11 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.334 -0.854 . . . . 0.0 109.157 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.438 ' O ' ' CB ' ' A' ' 43' ' ' ALA . 0.0 OUTLIER -57.08 -26.33 60.24 Favored 'General case' 0 C--N 1.297 -1.678 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 179.135 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.452 ' HB3' ' HB3' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -80.69 -33.98 34.99 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 178.896 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.426 HG21 ' O ' ' A' ' 37' ' ' THR . 14.6 t -65.27 -64.53 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 178.821 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 55.9 m-80 -56.34 -31.96 64.24 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.03 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.438 ' CB ' ' O ' ' A' ' 39' ' ' GLU . . . -59.5 -42.34 91.96 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.25 -0.906 . . . . 0.0 108.722 179.569 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.408 ' HB2' ' O ' ' A' ' 41' ' ' VAL . 2.3 mt -49.8 -54.57 18.37 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.407 -0.808 . . . . 0.0 109.89 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.538 ' CE ' HD21 ' A' ' 18' ' ' LEU . 17.1 tptp -49.61 -34.62 18.46 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.094 -1.004 . . . . 0.0 109.607 -179.599 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.472 ' HA ' HD22 ' A' ' 49' ' ' LEU . 2.8 m-20 -67.53 -48.77 66.03 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.26 -0.9 . . . . 0.0 109.428 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.416 ' O ' ' HB1' ' A' ' 51' ' ' ALA . 0.1 OUTLIER -74.27 -0.95 18.62 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.057 -1.027 . . . . 0.0 109.176 179.333 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.586 HG12 ' CG ' ' A' ' 28' ' ' TYR . 20.4 mt -87.63 -53.3 10.18 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 O-C-N 121.237 -0.914 . . . . 0.0 108.649 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.472 HD22 ' HA ' ' A' ' 46' ' ' ASN . 0.6 OUTLIER -67.03 -18.7 65.49 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.046 -1.033 . . . . 0.0 108.424 179.12 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.9 -41.23 11.91 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 179.246 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.416 ' HB1' ' O ' ' A' ' 47' ' ' GLU . . . -89.56 13.7 13.32 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.536 ' O ' ' CB ' ' A' ' 53' ' ' ALA . 0.0 OUTLIER -166.76 164.68 16.58 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 -179.731 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.536 ' CB ' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.493 1.687 0 CA-C-O 118.005 -0.998 . . . . 0.0 109.287 -179.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.469 ' OD1' HG23 ' A' ' 38' ' ' VAL . 4.5 p30 . . . . . 0 N--CA 1.486 1.367 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.448 ' O ' ' C ' ' A' ' 11' ' ' LYS . . . -81.77 -7.16 59.57 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.308 -0.87 . . . . 0.0 109.115 178.915 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.526 ' O ' ' CD1' ' A' ' 15' ' ' ILE . 0.2 OUTLIER -37.89 -46.48 0.96 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.555 -0.716 . . . . 0.0 110.512 -179.503 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.465 ' O ' ' HB1' ' A' ' 16' ' ' ALA . 34.2 mm-40 -97.93 -22.18 16.46 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.005 -1.059 . . . . 0.0 110.455 -179.372 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -61.27 -41.93 97.77 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.069 -1.02 . . . . 0.0 110.483 -179.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.539 ' CB ' ' HA ' ' A' ' 42' ' ' ASN . . . -85.41 -40.31 16.59 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.03 -1.044 . . . . 0.0 109.893 -179.631 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.558 HG22 ' CE1' ' A' ' 29' ' ' PHE . 67.2 mt -61.08 -27.04 40.86 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.542 0 CA-C-O 121.566 0.698 . . . . 0.0 109.81 -179.592 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.465 ' HB1' ' O ' ' A' ' 12' ' ' GLU . . . -65.12 -7.1 10.87 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.643 -0.661 . . . . 0.0 110.743 -178.333 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.465 ' OE2' ' OD1' ' A' ' 46' ' ' ASN . 2.9 pt-20 -109.35 -8.55 15.05 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 121.022 -1.049 . . . . 0.0 109.51 -179.515 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.475 ' HB3' ' HE3' ' A' ' 45' ' ' LYS . 0.6 OUTLIER -100.65 -46.81 5.06 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.19 -0.943 . . . . 0.0 110.125 179.946 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 27.8 ttmt -52.75 -39.38 62.13 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.126 -0.984 . . . . 0.0 109.934 -179.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.403 ' HG3' ' N ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -66.61 -31.27 71.86 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.195 -0.94 . . . . 0.0 109.613 -179.759 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.403 ' N ' ' HG3' ' A' ' 20' ' ' LYS . . . -61.52 -49.07 78.19 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.19 -0.944 . . . . 0.0 109.239 179.705 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 135.46 -8.88 4.34 Favored Glycine 0 N--CA 1.489 2.193 0 N-CA-C 109.661 -1.376 . . . . 0.0 109.661 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.467 ' CD1' ' NE2' ' A' ' 52' ' ' HIS . 48.8 mt -75.08 122.98 29.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.213 -1.169 . . . . 0.0 109.499 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -117.86 19.08 13.88 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.388 -0.82 . . . . 0.0 109.43 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.48 121.58 15.22 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.292 -0.88 . . . . 0.0 109.52 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.409 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 0.3 OUTLIER -74.41 -1.68 22.08 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.238 -0.914 . . . . 0.0 109.598 179.87 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.69 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 4.5 t80 -76.64 -14.99 59.93 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.235 -0.915 . . . . 0.0 109.175 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.69 ' CE1' ' CE2' ' A' ' 27' ' ' PHE . 62.3 m-85 -104.27 -33.37 8.7 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.421 -0.799 . . . . 0.0 109.073 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.587 ' CE1' ' HE2' ' A' ' 45' ' ' LYS . 8.7 m-85 -71.44 -47.37 56.2 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.362 -0.836 . . . . 0.0 108.805 179.082 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.447 ' O ' ' HD2' ' A' ' 34' ' ' LYS . 0.1 OUTLIER -61.33 -29.77 70.1 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.374 -0.829 . . . . 0.0 109.561 179.821 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.6 -22.4 50.91 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.268 -0.895 . . . . 0.0 109.462 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.534 ' CD1' ' O ' ' A' ' 28' ' ' TYR . 1.2 mp -65.18 -42.54 94.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.301 -0.874 . . . . 0.0 108.932 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 31.2 t30 -80.81 8.29 8.52 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.168 -0.957 . . . . 0.0 110.222 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.479 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.2 OUTLIER -122.14 -14.47 7.95 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.027 -1.046 . . . . 0.0 110.034 -179.746 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.549 ' HB3' ' CD1' ' A' ' 44' ' ' LEU . . . -47.65 -102.54 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.36 -0.838 . . . . 0.0 110.599 -179.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -171.05 -68.71 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.803 -1.185 . . . . 0.0 109.565 -179.311 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.453 ' O ' HG21 ' A' ' 41' ' ' VAL . 33.3 p -123.41 -167.72 1.66 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.313 -0.867 . . . . 0.0 109.399 -179.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.469 HG23 ' OD1' ' A' ' 9' ' ' ASN . 26.1 t -64.85 -53.9 36.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.152 -0.968 . . . . 0.0 109.372 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.427 ' O ' ' CB ' ' A' ' 43' ' ' ALA . 9.2 pt-20 -52.97 -27.32 18.51 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.273 -0.892 . . . . 0.0 109.469 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.471 ' HB3' ' HB2' ' A' ' 35' ' ' ALA . 2.8 mm-40 -81.08 -33.09 33.63 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.167 -0.958 . . . . 0.0 109.001 179.507 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.453 HG21 ' O ' ' A' ' 37' ' ' THR . 15.6 t -70.61 -62.35 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.391 -0.818 . . . . 0.0 108.959 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.539 ' HA ' ' CB ' ' A' ' 14' ' ' ALA . 69.1 m-80 -57.12 -31.7 65.58 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.467 -0.771 . . . . 0.0 109.61 179.54 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.427 ' CB ' ' O ' ' A' ' 39' ' ' GLU . . . -67.36 -40.47 85.8 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.181 -0.949 . . . . 0.0 109.058 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.549 ' CD1' ' HB3' ' A' ' 35' ' ' ALA . 6.0 mt -61.91 -48.52 80.08 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.313 -0.867 . . . . 0.0 110.704 -179.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.587 ' HE2' ' CE1' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -65.73 -24.94 67.08 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.868 -1.145 . . . . 0.0 110.356 -178.898 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.465 ' OD1' ' OE2' ' A' ' 17' ' ' GLU . 41.1 m-20 -80.94 -25.1 37.66 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.964 -1.085 . . . . 0.0 110.398 -179.513 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.456 ' O ' ' HB1' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -77.69 -18.97 56.08 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.986 -1.072 . . . . 0.0 110.412 -179.365 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.668 ' CG1' ' CD1' ' A' ' 28' ' ' TYR . 1.1 mt -66.14 -29.06 45.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.084 -1.01 . . . . 0.0 108.989 179.528 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.466 ' O ' ' OXT' ' A' ' 53' ' ' ALA . 1.4 mm? -60.34 -25.66 65.99 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.037 -1.039 . . . . 0.0 109.19 179.373 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.59 6.37 5.67 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.062 -1.024 . . . . 0.0 109.87 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.456 ' HB1' ' O ' ' A' ' 47' ' ' GLU . . . -101.0 -19.52 15.8 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.283 -0.886 . . . . 0.0 109.496 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.584 ' CD2' HG21 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -143.36 8.55 1.59 Allowed 'General case' 0 C--N 1.303 -1.454 0 C-N-CA 119.573 -0.851 . . . . 0.0 110.156 -178.398 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.466 ' OXT' ' O ' ' A' ' 49' ' ' LEU . . . . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 117.999 -1.0 . . . . 0.0 109.596 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.527 ' OD1' ' CG1' ' A' ' 38' ' ' VAL . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 121.278 0.561 . . . . 0.0 109.799 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -81.15 10.98 4.56 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.251 -0.906 . . . . 0.0 109.709 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.503 ' O ' HG13 ' A' ' 15' ' ' ILE . 0.1 OUTLIER -50.98 -78.15 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.028 -1.045 . . . . 0.0 110.505 -179.244 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -88.16 -18.34 28.98 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.011 -1.056 . . . . 0.0 110.94 -178.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -61.08 -39.48 90.06 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.826 -1.171 . . . . 0.0 109.308 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.5 ' O ' HD21 ' A' ' 18' ' ' LEU . . . -85.86 -45.93 11.09 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.27 -0.894 . . . . 0.0 109.254 179.724 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.59 HG12 ' CD1' ' A' ' 29' ' ' PHE . 95.2 mt -50.49 -29.23 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.535 -0.728 . . . . 0.0 110.288 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.3 -39.05 89.04 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.407 -0.808 . . . . 0.0 110.145 -178.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -83.37 -2.02 54.77 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.411 -0.806 . . . . 0.0 110.969 -178.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.5 HD21 ' O ' ' A' ' 14' ' ' ALA . 4.1 mm? -98.1 -38.01 9.51 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.814 -1.179 . . . . 0.0 110.066 -179.685 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.66 -38.92 49.12 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.237 -0.914 . . . . 0.0 109.736 -179.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.9 ttpt -71.51 -32.78 68.59 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.015 -1.053 . . . . 0.0 109.263 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.62 -22.21 32.44 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.259 -0.901 . . . . 0.0 109.582 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.444 ' O ' ' N ' ' A' ' 24' ' ' THR . . . 106.26 -41.14 2.25 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 46.8 mt -52.01 94.2 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.3 -1.118 . . . . 0.0 109.397 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.444 ' N ' ' O ' ' A' ' 22' ' ' GLY . 0.8 OUTLIER -97.27 19.8 12.53 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.22 -0.925 . . . . 0.0 109.848 -179.843 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.98 150.85 32.14 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.119 -0.988 . . . . 0.0 109.752 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -96.77 -8.18 31.86 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.244 -0.91 . . . . 0.0 109.276 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.514 ' CD1' ' O ' ' A' ' 27' ' ' PHE . 8.4 t80 -80.65 -8.8 59.75 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.038 -1.039 . . . . 0.0 109.476 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.635 ' CG ' ' CG1' ' A' ' 48' ' ' ILE . 18.6 m-30 -106.18 -15.33 14.89 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.384 -0.823 . . . . 0.0 109.207 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.59 ' CD1' HG12 ' A' ' 15' ' ' ILE . 10.7 m-30 -104.66 -49.75 3.46 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.577 -0.702 . . . . 0.0 109.376 -179.783 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -64.61 -41.23 96.34 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.244 -0.91 . . . . 0.0 109.35 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.7 1.27 20.45 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.228 -0.92 . . . . 0.0 109.775 -179.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.536 HD11 ' CG1' ' A' ' 15' ' ' ILE . 0.1 OUTLIER -72.96 -41.45 60.13 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.154 -0.966 . . . . 0.0 109.017 179.914 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 23.0 p30 -80.19 -0.78 37.66 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.339 -0.851 . . . . 0.0 109.576 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.497 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -107.03 -16.54 14.41 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.264 -0.898 . . . . 0.0 109.752 -179.563 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.518 ' O ' ' CG ' ' A' ' 36' ' ' LYS . . . -39.61 -98.91 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.641 -0.662 . . . . 0.0 110.624 -179.273 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.518 ' CG ' ' O ' ' A' ' 35' ' ' ALA . 5.3 mttt -171.15 -69.28 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.993 -1.067 . . . . 0.0 109.027 -179.235 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.455 HG21 ' HB2' ' A' ' 40' ' ' GLU . 5.1 t -127.94 -177.65 4.21 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.527 ' CG1' ' OD1' ' A' ' 9' ' ' ASN . 4.6 t -61.53 -48.87 86.79 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 O-C-N 120.909 -1.119 . . . . 0.0 109.661 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.53 ' O ' ' CB ' ' A' ' 43' ' ' ALA . 1.1 tt0 -61.35 -18.47 58.81 Favored 'General case' 0 C--N 1.296 -1.749 0 O-C-N 121.087 -1.008 . . . . 0.0 109.103 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.513 ' OE1' ' CA ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -90.78 -26.15 19.61 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.208 -0.932 . . . . 0.0 109.019 179.657 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 20.2 t -76.09 -54.75 12.92 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.398 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 179.007 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -66.68 -28.49 68.49 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.514 -0.741 . . . . 0.0 109.493 179.08 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.53 ' CB ' ' O ' ' A' ' 39' ' ' GLU . . . -76.99 -23.97 52.26 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.201 -0.937 . . . . 0.0 109.678 -179.68 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.536 ' HG ' ' N ' ' A' ' 45' ' ' LYS . 0.3 OUTLIER -78.75 -41.23 31.24 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.162 -0.961 . . . . 0.0 109.86 -179.581 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.536 ' N ' ' HG ' ' A' ' 44' ' ' LEU . 6.4 mmtt -61.58 -35.17 77.05 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.959 -1.088 . . . . 0.0 109.592 -179.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.2 m-20 -70.39 -23.5 62.78 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.083 -1.01 . . . . 0.0 108.457 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.532 ' O ' ' CB ' ' A' ' 51' ' ' ALA . 2.2 tt0 -78.85 1.56 23.0 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.5 -0.75 . . . . 0.0 109.038 179.183 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.635 ' CG1' ' CG ' ' A' ' 28' ' ' TYR . 1.7 mp -79.33 -33.16 15.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 23.1 tp -69.98 -30.86 68.3 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.426 -0.796 . . . . 0.0 109.938 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.6 mttt -102.79 -14.89 16.43 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.025 -1.047 . . . . 0.0 110.01 -179.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.532 ' CB ' ' O ' ' A' ' 47' ' ' GLU . . . -100.77 19.69 16.67 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.154 -0.966 . . . . 0.0 109.72 -179.768 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -165.52 -44.26 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.272 -0.892 . . . . 0.0 109.153 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 117.953 -1.023 . . . . 0.0 109.558 -179.998 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.578 ' ND2' ' N ' ' A' ' 9' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.425 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.444 ' HB2' ' OD1' ' A' ' 42' ' ' ASN . . . -54.45 -18.3 4.09 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.333 -0.854 . . . . 0.0 109.687 179.782 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.456 ' O ' HG13 ' A' ' 15' ' ' ILE . 0.4 OUTLIER -57.82 -71.46 0.11 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.237 -0.915 . . . . 0.0 110.181 -179.471 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -64.29 -28.54 69.79 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.002 -1.061 . . . . 0.0 110.013 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -61.77 -31.87 72.1 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 120.975 -1.078 . . . . 0.0 109.125 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.28 -58.25 2.83 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.312 -0.868 . . . . 0.0 108.775 179.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.577 HG12 ' CD1' ' A' ' 29' ' ' PHE . 8.3 mt -43.33 -35.22 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 O-C-N 121.531 -0.731 . . . . 0.0 110.413 179.717 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -77.15 29.26 0.14 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.294 -0.879 . . . . 0.0 110.652 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.411 ' H ' ' C ' ' A' ' 15' ' ' ILE . 2.8 tt0 -151.66 -36.62 0.13 Allowed 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.541 ' CD1' ' HE3' ' A' ' 45' ' ' LYS . 14.9 mt -78.72 -31.31 46.34 Favored 'General case' 0 C--N 1.306 -1.287 0 O-C-N 121.64 -0.662 . . . . 0.0 109.558 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.9 tttt -58.95 -21.53 58.5 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.131 -0.981 . . . . 0.0 109.674 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 41.1 mtmt -84.03 -25.91 29.51 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.289 -0.882 . . . . 0.0 109.527 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.32 -4.06 13.11 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.27 -0.894 . . . . 0.0 109.773 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 102.36 -34.73 5.49 Favored Glycine 0 N--CA 1.488 2.149 0 N-CA-C 108.966 -1.654 . . . . 0.0 108.966 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.472 ' CG2' ' O ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -46.9 117.67 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 O-C-N 121.44 -1.035 . . . . 0.0 108.864 179.735 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.39 6.77 6.36 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.08 -1.013 . . . . 0.0 110.042 -179.661 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -54.01 121.1 7.35 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.237 -0.914 . . . . 0.0 109.222 179.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.48 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 33.3 m-20 -73.51 -1.4 18.4 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.083 -1.01 . . . . 0.0 109.641 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.466 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 3.2 t80 -80.82 -39.79 26.02 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.034 -1.041 . . . . 0.0 109.247 179.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.597 ' CE2' ' CG2' ' A' ' 48' ' ' ILE . 21.7 m-30 -74.83 -25.03 58.72 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.472 -0.768 . . . . 0.0 110.129 -179.467 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.577 ' CD1' HG12 ' A' ' 15' ' ' ILE . 11.7 m-85 -94.97 -49.93 5.33 Favored 'General case' 0 C--N 1.297 -1.677 0 O-C-N 121.271 -0.893 . . . . 0.0 110.205 -178.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.48 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 66.3 m-20 -61.0 -35.77 77.72 Favored 'General case' 0 C--N 1.297 -1.704 0 O-C-N 121.152 -0.968 . . . . 0.0 109.476 179.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.423 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . . . -85.26 -4.39 59.14 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.256 -0.903 . . . . 0.0 110.328 -179.033 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.547 HD11 ' CG1' ' A' ' 15' ' ' ILE . 0.4 OUTLIER -62.59 -44.82 99.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.074 -1.016 . . . . 0.0 109.554 -179.67 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -77.82 -5.63 51.46 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.14 -0.975 . . . . 0.0 109.489 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.452 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -77.99 -22.86 48.72 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.244 -0.91 . . . . 0.0 109.607 -179.92 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.53 ' CB ' ' HB3' ' A' ' 40' ' ' GLU . . . -51.53 -175.47 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.216 -0.928 . . . . 0.0 109.973 -179.683 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.413 ' H ' ' CB ' ' A' ' 40' ' ' GLU . 0.5 OUTLIER -106.58 -54.04 2.53 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.498 -0.751 . . . . 0.0 109.096 179.824 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.479 ' O ' HG21 ' A' ' 41' ' ' VAL . 51.9 p -123.61 -172.95 2.63 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.312 -0.868 . . . . 0.0 109.24 179.752 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.506 HG23 ' ND2' ' A' ' 9' ' ' ASN . 67.4 t -66.91 -26.17 36.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.111 -0.993 . . . . 0.0 109.474 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.472 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 63.7 mt-10 -73.12 -29.18 62.71 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 179.381 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.53 ' HB3' ' CB ' ' A' ' 35' ' ' ALA . 2.9 mm-40 -79.23 -32.54 43.94 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 178.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.479 HG21 ' O ' ' A' ' 37' ' ' THR . 21.1 t -68.61 -68.37 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.444 ' OD1' ' HB2' ' A' ' 10' ' ' ALA . 88.1 m-20 -51.3 -28.27 11.63 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 179.222 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.472 ' HB3' ' O ' ' A' ' 39' ' ' GLU . . . -64.21 -50.34 68.45 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.43 -0.794 . . . . 0.0 109.031 179.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.9 mt -54.98 -44.0 74.05 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.29 -0.882 . . . . 0.0 109.881 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.552 ' NZ ' ' HB3' ' A' ' 28' ' ' TYR . 0.3 OUTLIER -57.64 -40.53 79.45 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.16 -0.963 . . . . 0.0 109.162 179.862 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.5 m-20 -69.65 -21.87 63.5 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.263 -0.898 . . . . 0.0 109.622 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -82.96 10.27 8.27 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.212 -0.93 . . . . 0.0 109.314 179.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.597 ' CG2' ' CE2' ' A' ' 28' ' ' TYR . 62.0 mt -90.03 -45.02 15.1 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 179.154 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 7.4 mp -61.72 -21.48 64.53 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.436 -0.79 . . . . 0.0 109.681 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -106.42 -43.22 4.82 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.902 -1.124 . . . . 0.0 109.906 -179.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.519 ' O ' ' CB ' ' A' ' 52' ' ' HIS . . . -84.71 43.15 0.96 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.163 -0.961 . . . . 0.0 109.134 179.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.526 ' O ' ' CB ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER 163.14 157.03 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 -179.54 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.526 ' CB ' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 118.037 -0.982 . . . . 0.0 109.425 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.469 ' HB1' HG12 ' A' ' 38' ' ' VAL . . . -81.87 29.73 0.39 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.184 -0.947 . . . . 0.0 110.396 179.583 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.539 ' O ' ' CD1' ' A' ' 15' ' ' ILE . 0.4 OUTLIER -63.81 -42.86 97.59 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 120.788 -1.195 . . . . 0.0 109.915 -179.715 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.469 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 1.5 tt0 -96.01 -26.04 15.7 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.048 -1.033 . . . . 0.0 110.437 -179.241 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -65.83 -56.43 11.93 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.822 -1.174 . . . . 0.0 110.146 -179.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.501 ' O ' ' HE3' ' A' ' 45' ' ' LYS . . . -69.77 -46.78 65.03 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.203 -0.936 . . . . 0.0 110.009 -179.531 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.602 ' CG2' ' CZ ' ' A' ' 29' ' ' PHE . 46.0 mt -57.85 -29.59 35.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 CA-C-O 121.718 0.77 . . . . 0.0 109.652 -179.699 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' A' ' 12' ' ' GLU . . . -61.79 -6.8 2.92 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.51 -0.744 . . . . 0.0 111.284 -178.84 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.465 ' HB3' ' NZ ' ' A' ' 45' ' ' LYS . 28.6 tt0 -105.39 -22.61 12.99 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 120.906 -1.121 . . . . 0.0 109.996 -179.365 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.538 ' CD1' ' HE2' ' A' ' 45' ' ' LYS . 0.7 OUTLIER -76.78 -35.98 57.31 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.924 -1.11 . . . . 0.0 109.449 -179.87 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.7 ttmt -50.34 -35.12 26.35 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.323 -0.861 . . . . 0.0 109.843 -179.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.85 -21.77 21.29 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.141 -0.974 . . . . 0.0 109.746 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . 0.473 ' HB1' ' HA ' ' A' ' 18' ' ' LEU . . . -64.27 -28.13 69.52 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.154 -0.966 . . . . 0.0 109.17 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 115.61 -16.93 16.37 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.517 HD12 ' NE2' ' A' ' 52' ' ' HIS . 67.4 mt -84.19 115.13 25.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.198 -1.178 . . . . 0.0 109.798 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.414 ' O ' ' C ' ' A' ' 25' ' ' SER . 0.0 OUTLIER -117.47 0.45 12.15 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.187 -0.946 . . . . 0.0 109.302 179.36 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.414 ' C ' ' O ' ' A' ' 24' ' ' THR . 49.6 m -44.75 157.44 0.07 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.177 -0.952 . . . . 0.0 109.45 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.474 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 4.8 p-10 -104.11 -7.17 20.42 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.22 -0.925 . . . . 0.0 109.866 -179.621 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.563 ' O ' ' CG ' ' A' ' 27' ' ' PHE . 27.0 t80 -80.54 1.3 30.13 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.982 -1.073 . . . . 0.0 109.55 -179.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.582 ' CG ' HG12 ' A' ' 48' ' ' ILE . 15.6 m-85 -117.34 -50.66 2.54 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 179.205 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.602 ' CZ ' ' CG2' ' A' ' 15' ' ' ILE . 1.2 m-30 -66.41 -38.83 88.34 Favored 'General case' 0 C--N 1.302 -1.48 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.121 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.474 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 12.0 m-20 -69.76 -34.33 73.64 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.209 -0.932 . . . . 0.0 108.833 179.435 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.91 -15.42 58.35 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.476 -0.765 . . . . 0.0 109.471 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.522 HG21 ' CG1' ' A' ' 41' ' ' VAL . 1.3 mm -53.12 -27.72 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.251 -0.905 . . . . 0.0 108.968 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.457 ' OD1' ' O ' ' A' ' 30' ' ' ASN . 2.2 p-10 -80.38 -33.32 37.24 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.031 -1.043 . . . . 0.0 109.486 179.784 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.46 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -54.71 -27.98 44.61 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.245 -0.909 . . . . 0.0 109.428 179.986 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.46 ' O ' ' O ' ' A' ' 34' ' ' LYS . . . -44.99 169.27 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.288 -0.883 . . . . 0.0 109.476 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.3 mttp -99.0 -47.0 5.4 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.319 -0.863 . . . . 0.0 109.455 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.433 ' OG1' ' HG2' ' A' ' 40' ' ' GLU . 70.6 p -126.73 -163.08 1.2 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.208 -0.932 . . . . 0.0 109.388 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.469 HG12 ' HB1' ' A' ' 10' ' ' ALA . 87.3 t -70.56 -54.98 15.96 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 O-C-N 121.301 -0.874 . . . . 0.0 109.317 179.818 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.522 ' O ' ' CB ' ' A' ' 43' ' ' ALA . 3.2 tt0 -53.33 -27.94 26.02 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.275 -0.891 . . . . 0.0 109.228 179.755 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.433 ' HG2' ' OG1' ' A' ' 37' ' ' THR . 4.8 mm-40 -79.07 -35.38 42.54 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 179.295 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.522 ' CG1' HG21 ' A' ' 32' ' ' ILE . 55.4 t -65.76 -67.18 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 178.685 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.472 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 7.4 m-20 -53.9 -30.71 47.29 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.674 -0.641 . . . . 0.0 109.537 179.228 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.522 ' CB ' ' O ' ' A' ' 39' ' ' GLU . . . -66.14 -39.89 90.2 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.215 -0.928 . . . . 0.0 109.457 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.0 mt -61.67 -43.11 99.48 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.262 -0.899 . . . . 0.0 110.699 -179.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.538 ' HE2' ' CD1' ' A' ' 18' ' ' LEU . 0.0 OUTLIER -67.32 -43.51 81.42 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.846 -1.159 . . . . 0.0 109.883 -179.163 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.475 ' N ' ' CG ' ' A' ' 45' ' ' LYS . 28.0 m-20 -69.35 -21.47 63.81 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.108 -0.995 . . . . 0.0 108.69 179.626 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.469 ' O ' ' HB1' ' A' ' 51' ' ' ALA . 1.3 tm-20 -73.32 -12.71 60.93 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.593 HG23 ' CD2' ' A' ' 52' ' ' HIS . 53.9 mt -65.81 -41.08 89.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 179.082 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.449 HD11 ' N ' ' A' ' 49' ' ' LEU . 2.2 mp -50.76 -29.47 11.56 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.78 -0.575 . . . . 0.0 110.353 -179.728 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.45 ' CD ' ' O ' ' A' ' 50' ' ' LYS . 0.1 OUTLIER -111.99 -13.89 13.54 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.778 -1.201 . . . . 0.0 110.675 -179.228 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.469 ' HB1' ' O ' ' A' ' 47' ' ' GLU . . . -100.9 20.49 15.32 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 179.36 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.593 ' CD2' HG23 ' A' ' 48' ' ' ILE . 0.0 OUTLIER 173.47 155.21 0.11 Allowed 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.84 -1.171 . . . . 0.0 107.84 -179.248 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.552 ' CB ' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.492 1.654 0 CA-C-O 117.943 -1.027 . . . . 0.0 109.252 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 121.143 0.497 . . . . 0.0 110.032 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.447 ' HB2' ' CG1' ' A' ' 41' ' ' VAL . . . -80.22 -9.54 59.73 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.218 -0.926 . . . . 0.0 110.401 -179.213 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.484 ' O ' HG13 ' A' ' 15' ' ' ILE . 36.4 mtpt -45.26 -69.89 0.12 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.118 -0.989 . . . . 0.0 110.152 -179.44 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -90.79 -20.67 22.09 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.05 -1.031 . . . . 0.0 110.322 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.82 -30.86 71.8 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 120.911 -1.118 . . . . 0.0 109.426 -179.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.549 ' O ' ' CD2' ' A' ' 18' ' ' LEU . . . -93.77 -49.04 6.03 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.685 -0.858 . . . . 0.0 108.685 179.458 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.582 HG21 ' CE1' ' A' ' 29' ' ' PHE . 70.0 mt -53.65 -27.32 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 CA-C-O 121.547 0.689 . . . . 0.0 110.65 179.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.4 -3.05 1.21 Allowed 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.444 -0.785 . . . . 0.0 111.351 -178.39 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -122.31 -3.6 8.94 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 120.683 -1.261 . . . . 0.0 110.201 -179.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.549 ' CD2' ' O ' ' A' ' 14' ' ' ALA . 2.5 mm? -99.71 -38.53 8.66 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.036 -1.04 . . . . 0.0 109.562 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.7 tptp -50.91 -45.07 60.24 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.245 -0.909 . . . . 0.0 109.148 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.93 -31.27 72.1 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.232 -0.917 . . . . 0.0 109.548 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.97 -48.86 79.98 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.254 -0.904 . . . . 0.0 109.52 -179.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 136.29 -22.25 3.4 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.294 -1.522 . . . . 0.0 109.294 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.521 HD12 ' CG2' ' A' ' 48' ' ' ILE . 53.9 mt -66.57 122.5 17.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.336 -1.097 . . . . 0.0 109.301 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.421 ' O ' ' C ' ' A' ' 25' ' ' SER . 13.7 p -128.99 1.38 5.29 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.192 -0.942 . . . . 0.0 109.845 -179.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.421 ' C ' ' O ' ' A' ' 24' ' ' THR . 18.3 t -44.22 161.2 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.178 -0.951 . . . . 0.0 108.958 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.528 ' O ' ' CB ' ' A' ' 30' ' ' ASN . 3.6 p30 -99.6 -10.89 21.48 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.129 -0.982 . . . . 0.0 109.573 -179.834 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.608 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 18.4 t80 -81.01 -6.38 58.72 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.029 -1.045 . . . . 0.0 109.611 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.634 ' CG ' ' CG1' ' A' ' 48' ' ' ILE . 23.1 m-85 -110.97 -37.11 5.47 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.205 -0.934 . . . . 0.0 108.494 179.446 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.582 ' CE1' HG21 ' A' ' 15' ' ' ILE . 3.5 m-85 -85.39 -43.53 13.57 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 179.175 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.528 ' CB ' ' O ' ' A' ' 26' ' ' ASP . 48.3 t30 -69.87 -57.87 4.55 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.4 -0.813 . . . . 0.0 108.955 179.636 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.456 ' HB1' ' O ' ' A' ' 27' ' ' PHE . . . -59.5 -16.29 23.35 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.437 -0.79 . . . . 0.0 109.203 179.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.478 HG23 HD13 ' A' ' 15' ' ' ILE . 0.4 OUTLIER -54.15 -39.38 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.34 -0.85 . . . . 0.0 108.814 179.924 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.526 ' ND2' ' N ' ' A' ' 34' ' ' LYS . 0.7 OUTLIER -75.77 -35.03 60.26 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.274 -0.891 . . . . 0.0 109.094 179.618 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.526 ' N ' ' ND2' ' A' ' 33' ' ' ASN . 0.7 OUTLIER -55.41 -25.2 34.51 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.377 -0.827 . . . . 0.0 109.501 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.45 ' HB3' HD11 ' A' ' 44' ' ' LEU . . . -40.12 155.96 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.667 -0.646 . . . . 0.0 109.914 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.39 -70.85 0.58 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.318 -0.864 . . . . 0.0 109.535 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.439 ' O ' HG21 ' A' ' 41' ' ' VAL . 0.6 OUTLIER -108.55 -179.94 4.02 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.159 -0.963 . . . . 0.0 109.138 179.758 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 27.8 t -59.3 -37.77 70.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.23 -0.918 . . . . 0.0 109.234 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.528 ' O ' ' CB ' ' A' ' 43' ' ' ALA . 43.4 mt-10 -63.51 -28.48 69.98 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 121.281 -0.887 . . . . 0.0 108.747 179.378 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.502 ' OE1' ' N ' ' A' ' 40' ' ' GLU . 1.1 mp0 -79.49 -31.27 42.26 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 179.131 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.447 ' CG1' ' HB2' ' A' ' 10' ' ' ALA . 12.7 t -67.21 -66.67 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.343 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 178.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -55.46 -35.29 65.32 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 179.182 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.528 ' CB ' ' O ' ' A' ' 39' ' ' GLU . . . -62.05 -35.82 79.78 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.283 -0.885 . . . . 0.0 109.164 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.465 ' O ' HD11 ' A' ' 48' ' ' ILE . 3.7 mt -59.44 -52.15 66.85 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.433 -0.792 . . . . 0.0 110.314 -179.758 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.467 ' HE3' ' HG ' ' A' ' 18' ' ' LEU . 43.0 mmtt -64.39 -25.67 68.13 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.106 -0.997 . . . . 0.0 109.998 -179.119 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.4 m-20 -76.46 -18.07 58.98 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.054 -1.029 . . . . 0.0 109.621 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.534 ' O ' ' CB ' ' A' ' 51' ' ' ALA . 0.0 OUTLIER -90.18 -12.79 37.1 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.186 -0.946 . . . . 0.0 109.294 179.76 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.634 ' CG1' ' CG ' ' A' ' 28' ' ' TYR . 1.2 mp -73.3 -35.38 46.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 179.529 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 5.7 tp -61.82 -24.03 66.62 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.074 -1.016 . . . . 0.0 110.081 -179.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 26.1 mttt -121.76 -1.72 9.42 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.818 -1.176 . . . . 0.0 110.076 -179.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.534 ' CB ' ' O ' ' A' ' 47' ' ' GLU . . . -101.11 -28.11 12.88 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.111 -0.993 . . . . 0.0 109.886 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.607 ' CD2' HG21 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -131.96 -0.03 3.82 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.094 -1.004 . . . . 0.0 109.87 -179.334 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.656 0 CA-C-O 118.027 -0.987 . . . . 0.0 109.572 179.769 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.58 ' ND2' ' N ' ' A' ' 9' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.494 1.771 0 CA-C-O 121.179 0.514 . . . . 0.0 110.632 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.494 ' HA ' ' HB2' ' A' ' 13' ' ' ASP . . . -69.8 0.2 6.1 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.177 -0.952 . . . . 0.0 110.818 -179.085 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.538 ' HG2' ' CG2' ' A' ' 32' ' ' ILE . 0.1 OUTLIER -44.63 -74.05 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.464 0 O-C-N 120.819 -1.176 . . . . 0.0 110.571 -179.712 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.464 ' HA ' ' HB ' ' A' ' 15' ' ' ILE . 76.0 mt-10 -75.76 -5.77 47.38 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.962 -1.086 . . . . 0.0 110.307 -179.103 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.494 ' HB2' ' HA ' ' A' ' 10' ' ' ALA . 1.0 OUTLIER -70.37 -44.82 67.3 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.208 -0.933 . . . . 0.0 109.333 179.8 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -87.25 -31.7 20.12 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.329 -0.857 . . . . 0.0 109.284 179.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.529 HG12 ' CD1' ' A' ' 29' ' ' PHE . 31.4 mt -62.39 -28.84 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 CA-C-O 121.917 0.865 . . . . 0.0 109.051 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.29 -10.96 12.53 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.808 -0.557 . . . . 0.0 110.145 -179.087 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -101.27 -18.66 16.01 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.299 -0.876 . . . . 0.0 109.526 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.581 ' HG ' ' CE ' ' A' ' 45' ' ' LYS . 4.2 mm? -90.02 -56.07 3.37 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.278 -0.889 . . . . 0.0 109.824 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.6 tttp -49.5 -29.59 6.96 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.4 -0.813 . . . . 0.0 109.908 -179.288 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.0 tttp -86.7 -29.53 22.36 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.1 -1.0 . . . . 0.0 109.715 -179.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.23 -33.99 75.41 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.27 -0.894 . . . . 0.0 109.713 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 131.04 -45.15 1.15 Allowed Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.414 -1.475 . . . . 0.0 109.414 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.417 HD12 ' CG2' ' A' ' 48' ' ' ILE . 66.0 mt -45.62 136.6 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.272 -1.134 . . . . 0.0 109.517 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 64.1 p -137.74 25.22 2.84 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.249 -0.907 . . . . 0.0 109.457 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 9.8 t -65.11 156.63 30.96 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.281 -0.887 . . . . 0.0 109.329 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.462 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 68.7 m-20 -96.45 -6.98 36.03 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.223 -0.923 . . . . 0.0 109.597 -179.871 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.528 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 8.6 t80 -81.83 -19.27 41.43 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 120.971 -1.081 . . . . 0.0 109.013 179.625 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.6 ' CD2' HG12 ' A' ' 48' ' ' ILE . 22.2 m-30 -97.16 -11.82 23.84 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.39 -0.819 . . . . 0.0 109.615 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.529 ' CD1' HG12 ' A' ' 15' ' ' ILE . 9.8 m-85 -112.55 -49.96 2.92 Favored 'General case' 0 C--N 1.297 -1.697 0 O-C-N 121.296 -0.877 . . . . 0.0 109.45 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.462 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 8.5 t30 -62.19 -40.55 96.43 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.581 -0.699 . . . . 0.0 109.285 179.501 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . 0.445 ' HB1' ' O ' ' A' ' 27' ' ' PHE . . . -81.16 -1.2 43.64 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.39 -0.819 . . . . 0.0 109.886 -179.686 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.538 ' CG2' ' HG2' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -76.45 -55.93 9.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.108 -0.995 . . . . 0.0 109.611 -179.659 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.517 ' N ' HG23 ' A' ' 32' ' ' ILE . 6.8 t-20 -69.24 -6.42 29.07 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.136 -0.977 . . . . 0.0 109.193 179.77 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.48 ' O ' ' O ' ' A' ' 35' ' ' ALA . 4.2 mttt -103.38 -20.63 14.01 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.255 -0.903 . . . . 0.0 109.636 -179.838 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.48 ' O ' ' O ' ' A' ' 34' ' ' LYS . . . -40.29 164.09 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.747 0 CA-C-O 121.625 0.726 . . . . 0.0 110.175 -179.568 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.6 mttp -51.4 -78.93 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.336 -0.852 . . . . 0.0 110.165 -179.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.524 ' CG2' ' HG2' ' A' ' 39' ' ' GLU . 4.8 t -128.76 -154.09 0.61 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.186 -0.946 . . . . 0.0 109.724 -179.555 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.446 ' N ' ' CG2' ' A' ' 37' ' ' THR . 12.3 t -75.79 -53.9 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 O-C-N 121.119 -0.988 . . . . 0.0 109.845 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.524 ' HG2' ' CG2' ' A' ' 37' ' ' THR . 1.3 pt-20 -55.36 -22.6 20.21 Favored 'General case' 0 C--N 1.296 -1.732 0 O-C-N 121.007 -1.058 . . . . 0.0 108.575 179.542 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.457 ' O ' ' HB3' ' A' ' 44' ' ' LEU . 20.0 tp10 -84.9 -32.82 22.94 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.881 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.461 HG21 ' HB2' ' A' ' 35' ' ' ALA . 53.9 t -66.62 -59.96 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.432 ' O ' ' OD1' ' A' ' 46' ' ' ASN . 35.9 m-80 -58.75 -34.93 71.95 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.474 -0.766 . . . . 0.0 109.735 179.574 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.451 ' HB1' ' O ' ' A' ' 39' ' ' GLU . . . -72.85 -26.64 61.54 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.156 -0.965 . . . . 0.0 109.631 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.478 ' CD2' ' HA ' ' A' ' 32' ' ' ILE . 0.3 OUTLIER -75.83 -30.15 58.86 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.139 -0.976 . . . . 0.0 108.464 179.502 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.581 ' CE ' ' HG ' ' A' ' 18' ' ' LEU . 0.0 OUTLIER -64.62 -26.21 68.3 Favored 'General case' 0 N--CA 1.487 1.408 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.369 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . 0.432 ' OD1' ' O ' ' A' ' 42' ' ' ASN . 23.1 m120 -80.18 -15.86 56.11 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.554 -0.716 . . . . 0.0 109.813 -179.657 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -83.01 -7.61 59.65 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.201 -0.937 . . . . 0.0 109.82 -179.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.6 HG12 ' CD2' ' A' ' 28' ' ' TYR . 2.4 mp -74.82 -46.67 40.46 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 O-C-N 120.966 -1.084 . . . . 0.0 108.586 179.348 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.2 mp -54.09 -40.12 66.97 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.311 -0.868 . . . . 0.0 109.105 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.6 tmtt? -80.4 -73.14 0.38 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.162 -0.962 . . . . 0.0 108.548 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.476 ' O ' ' HB3' ' A' ' 52' ' ' HIS . . . -55.88 161.46 2.23 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.075 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.625 ' CG ' ' O ' ' A' ' 52' ' ' HIS . 0.4 OUTLIER 64.73 10.46 6.04 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 120.911 -1.118 . . . . 0.0 108.964 179.674 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.453 0 O-C-N 120.963 -1.086 . . . . 0.0 109.455 179.722 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.532 ' ND2' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.591 0 CA-C-O 121.353 0.597 . . . . 0.0 109.619 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.437 ' HA ' ' HB2' ' A' ' 13' ' ' ASP . . . -80.78 0.82 33.09 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.262 -0.899 . . . . 0.0 109.617 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.414 ' HA ' HG22 ' A' ' 32' ' ' ILE . 5.4 mtpm? -62.52 -88.01 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.171 -0.956 . . . . 0.0 109.969 -179.463 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.453 ' O ' ' HB1' ' A' ' 16' ' ' ALA . 4.7 tt0 -57.83 -17.15 14.32 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.159 -0.963 . . . . 0.0 110.077 -179.3 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.437 ' HB2' ' HA ' ' A' ' 10' ' ' ALA . 61.8 m-20 -59.94 -73.61 0.09 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.097 -1.002 . . . . 0.0 109.475 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.473 ' O ' HD13 ' A' ' 18' ' ' LEU . . . -68.47 -42.36 78.84 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.228 -0.92 . . . . 0.0 109.461 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.594 HG21 ' CE1' ' A' ' 29' ' ' PHE . 10.6 mt -49.86 -30.82 6.33 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.524 0 O-C-N 121.206 -0.934 . . . . 0.0 109.033 179.796 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.453 ' HB1' ' O ' ' A' ' 12' ' ' GLU . . . -66.4 -38.74 88.17 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.633 -0.667 . . . . 0.0 110.582 -178.43 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.3 tp10 -76.21 -25.0 54.67 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.179 -0.951 . . . . 0.0 110.763 -178.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.505 ' CD1' ' HB3' ' A' ' 45' ' ' LYS . 0.9 OUTLIER -88.69 -30.21 19.29 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 120.929 -1.107 . . . . 0.0 110.37 -178.945 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.6 -29.67 68.14 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.305 -0.872 . . . . 0.0 109.504 -179.516 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -86.29 -26.37 24.98 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.335 -0.853 . . . . 0.0 109.211 179.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.31 -30.57 69.59 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.236 -0.915 . . . . 0.0 109.316 179.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 121.19 -28.99 5.88 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.779 -1.328 . . . . 0.0 109.779 179.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.471 HD12 HG22 ' A' ' 23' ' ' ILE . 26.8 mt -48.87 110.51 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.153 -1.204 . . . . 0.0 109.485 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -105.99 -7.12 18.28 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.213 -0.929 . . . . 0.0 109.4 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -48.12 118.62 2.47 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.25 -0.906 . . . . 0.0 109.182 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.485 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 0.3 OUTLIER -80.05 6.45 11.46 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.336 -0.853 . . . . 0.0 109.644 -179.868 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.442 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 20.4 t80 -78.85 -22.58 45.89 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.107 -0.996 . . . . 0.0 109.462 -179.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.58 ' CG ' HG12 ' A' ' 48' ' ' ILE . 22.6 m-85 -94.75 -45.2 7.44 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.179 -0.95 . . . . 0.0 108.821 179.464 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.628 ' CE1' ' HE2' ' A' ' 45' ' ' LYS . 14.4 m-85 -61.03 -50.95 71.26 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 179.08 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.485 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 1.9 t30 -60.34 -31.32 70.2 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.419 -0.801 . . . . 0.0 108.901 179.615 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.04 -22.08 53.52 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.453 -0.779 . . . . 0.0 109.682 -179.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.545 ' CG2' HD13 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -68.28 -34.09 64.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.212 -0.93 . . . . 0.0 108.837 179.914 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -75.91 -4.54 41.49 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.213 -0.929 . . . . 0.0 109.021 179.366 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.448 ' O ' ' C ' ' A' ' 35' ' ' ALA . 6.5 mmmt -108.83 -17.78 13.85 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.212 -0.93 . . . . 0.0 109.531 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.448 ' C ' ' O ' ' A' ' 34' ' ' LYS . . . -38.45 154.82 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.71 -0.619 . . . . 0.0 110.127 -179.711 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.407 ' CE ' ' HA ' ' A' ' 36' ' ' LYS . 0.5 OUTLIER -87.74 -73.09 0.49 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.295 -0.878 . . . . 0.0 109.954 -179.791 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.474 ' O ' HG21 ' A' ' 41' ' ' VAL . 0.8 OUTLIER -105.89 -177.38 3.35 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.152 -0.968 . . . . 0.0 109.365 -179.741 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.532 HG23 ' ND2' ' A' ' 9' ' ' ASN . 92.4 t -67.44 -30.05 47.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.134 -0.979 . . . . 0.0 109.028 179.649 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.522 ' HG3' ' N ' ' A' ' 40' ' ' GLU . 3.0 pt-20 -71.33 -25.29 62.34 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 178.254 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.522 ' N ' ' HG3' ' A' ' 39' ' ' GLU . 4.5 mm-40 -80.97 -30.74 35.05 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 178.592 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.474 HG21 ' O ' ' A' ' 37' ' ' THR . 48.7 t -67.41 -61.16 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 179.038 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 58.1 m-80 -62.05 -29.4 70.27 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.589 -0.695 . . . . 0.0 109.306 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.478 ' CB ' ' O ' ' A' ' 39' ' ' GLU . . . -71.17 -29.4 65.15 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.259 -0.901 . . . . 0.0 109.497 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 7.4 mt -75.1 -47.94 26.23 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.117 -0.989 . . . . 0.0 110.947 -179.228 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.628 ' HE2' ' CE1' ' A' ' 29' ' ' PHE . 0.3 OUTLIER -75.29 -43.45 51.09 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.861 -1.15 . . . . 0.0 110.081 -178.888 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -68.32 -21.08 64.77 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.029 -1.045 . . . . 0.0 109.436 179.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.476 ' O ' ' HB1' ' A' ' 51' ' ' ALA . 14.6 tt0 -79.79 -7.11 58.47 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.176 -0.952 . . . . 0.0 109.674 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.598 ' CG2' ' CD2' ' A' ' 52' ' ' HIS . 83.3 mt -68.95 -41.67 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 178.729 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.7 mt -47.32 -32.33 4.66 Favored 'General case' 0 C--N 1.302 -1.472 0 C-N-CA 119.688 -0.805 . . . . 0.0 109.435 179.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.7 mttm -115.66 -3.61 12.28 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.977 -1.077 . . . . 0.0 110.177 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.476 ' HB1' ' O ' ' A' ' 47' ' ' GLU . . . -100.58 -2.55 32.58 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.126 -0.984 . . . . 0.0 109.218 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.604 ' CG ' ' N ' ' A' ' 53' ' ' ALA . 0.0 OUTLIER -160.89 -164.97 1.28 Allowed 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.343 -0.848 . . . . 0.0 108.957 -179.614 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.604 ' N ' ' CG ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.49 1.542 0 O-C-N 121.11 -0.994 . . . . 0.0 109.277 -179.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.424 ' CG ' ' N ' ' A' ' 10' ' ' ALA . 4.5 p30 . . . . . 0 N--CA 1.486 1.358 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.44 ' HB3' ' OD1' ' A' ' 42' ' ' ASN . . . -81.56 -11.82 59.01 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 178.041 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.528 ' HA ' ' CG2' ' A' ' 32' ' ' ILE . 1.3 ttpt -43.82 -64.22 0.7 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.459 -0.776 . . . . 0.0 110.926 -179.424 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -95.95 -22.83 17.16 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.895 -1.128 . . . . 0.0 111.18 -178.428 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -61.28 -28.78 69.43 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.794 -1.191 . . . . 0.0 109.876 -179.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.475 ' O ' HD21 ' A' ' 18' ' ' LEU . . . -96.65 -43.62 7.48 Favored 'General case' 0 C--N 1.301 -1.5 0 O-C-N 121.096 -1.003 . . . . 0.0 108.853 179.549 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.599 HG12 ' CD1' ' A' ' 29' ' ' PHE . 88.0 mt -54.31 -28.72 18.69 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 O-C-N 121.66 -0.65 . . . . 0.0 109.705 179.815 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.473 ' HA ' ' CE ' ' A' ' 19' ' ' LYS . . . -64.06 -37.51 87.71 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.42 -0.8 . . . . 0.0 109.639 -179.03 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -86.86 9.6 18.7 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.386 -0.822 . . . . 0.0 109.913 -179.48 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.555 ' HG ' ' CE ' ' A' ' 45' ' ' LYS . 0.5 OUTLIER -101.04 -47.93 4.59 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.249 -0.907 . . . . 0.0 109.627 -179.766 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.473 ' CE ' ' HA ' ' A' ' 16' ' ' ALA . 2.1 ptpt -59.43 -28.76 67.24 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.457 -0.777 . . . . 0.0 109.345 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.06 -16.79 23.5 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.41 -0.807 . . . . 0.0 108.966 179.664 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -69.09 -29.92 68.11 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.334 -0.854 . . . . 0.0 109.532 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 126.87 -12.76 6.85 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.768 -1.333 . . . . 0.0 109.768 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.58 HG22 ' CE1' ' A' ' 52' ' ' HIS . 0.2 OUTLIER -101.97 123.05 54.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.101 -1.235 . . . . 0.0 109.696 -179.792 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -122.89 28.62 7.16 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.3 -0.875 . . . . 0.0 108.986 179.468 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.98 177.81 2.48 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.363 -0.836 . . . . 0.0 109.64 -179.748 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.465 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 9.0 m-20 -122.22 0.78 9.62 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.26 -0.9 . . . . 0.0 109.659 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.591 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 2.3 t80 -81.15 -40.41 24.02 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.159 -0.963 . . . . 0.0 109.569 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.591 ' CE1' ' CD2' ' A' ' 27' ' ' PHE . 21.5 m-85 -78.34 -31.05 48.42 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.351 -0.843 . . . . 0.0 110.198 -179.008 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.599 ' CD1' HG12 ' A' ' 15' ' ' ILE . 6.7 m-30 -75.53 -49.24 19.27 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.282 -0.886 . . . . 0.0 109.924 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.465 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 0.4 OUTLIER -59.37 -25.65 64.42 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.156 -0.965 . . . . 0.0 110.175 -179.504 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -87.15 -16.18 36.19 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.97 -1.081 . . . . 0.0 110.44 -179.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.528 ' CG2' ' HA ' ' A' ' 11' ' ' LYS . 0.6 OUTLIER -64.8 -38.16 82.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.096 -1.002 . . . . 0.0 109.873 -179.596 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 45.9 p-10 -79.74 -8.65 59.37 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.023 -1.048 . . . . 0.0 110.348 -179.238 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.437 ' O ' ' C ' ' A' ' 35' ' ' ALA . 3.5 mtmt -99.64 -17.16 17.93 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.962 -1.086 . . . . 0.0 109.976 -179.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.505 ' CB ' HG21 ' A' ' 41' ' ' VAL . . . -43.14 154.54 0.07 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.23 -0.919 . . . . 0.0 109.554 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.493 ' HB2' ' HG3' ' A' ' 40' ' ' GLU . 0.1 OUTLIER -73.09 -59.49 2.68 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.077 -1.014 . . . . 0.0 109.634 -179.775 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.45 ' OG1' ' HG2' ' A' ' 39' ' ' GLU . 70.2 p -124.01 -167.0 1.57 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.09 -1.006 . . . . 0.0 109.754 -179.834 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.483 ' HA ' HG22 ' A' ' 41' ' ' VAL . 16.0 t -66.63 -52.09 49.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.406 -0.809 . . . . 0.0 109.587 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.531 ' O ' ' CB ' ' A' ' 43' ' ' ALA . 11.7 pt-20 -52.36 -26.51 12.55 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 179.597 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.493 ' HG3' ' HB2' ' A' ' 36' ' ' LYS . 27.6 mm-40 -80.45 -35.6 34.7 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.321 -0.862 . . . . 0.0 108.763 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.505 HG21 ' CB ' ' A' ' 35' ' ' ALA . 7.0 t -67.88 -66.88 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 179.051 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.44 ' OD1' ' HB3' ' A' ' 10' ' ' ALA . 76.1 m-20 -53.85 -28.6 36.9 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.565 -0.709 . . . . 0.0 109.375 179.391 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.531 ' CB ' ' O ' ' A' ' 39' ' ' GLU . . . -66.88 -46.18 75.77 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.287 -0.883 . . . . 0.0 109.605 -179.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.1 mt -57.85 -37.14 73.34 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.244 -0.91 . . . . 0.0 109.985 -179.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.555 ' CE ' ' HG ' ' A' ' 18' ' ' LEU . 0.2 OUTLIER -63.4 -34.01 76.79 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.087 -1.008 . . . . 0.0 109.5 -179.847 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 8.4 m-20 -77.77 -30.23 51.31 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.196 -0.94 . . . . 0.0 109.504 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -57.09 -23.33 46.14 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.338 -0.851 . . . . 0.0 109.165 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.58 HG12 ' CG ' ' A' ' 28' ' ' TYR . 41.4 mt -66.64 -45.7 87.78 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 179.518 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.2 mp -48.17 -36.78 14.22 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.178 -0.951 . . . . 0.0 108.558 179.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.6 mttt -90.53 -80.78 0.32 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.42 -0.8 . . . . 0.0 108.917 179.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.5 ' O ' ' HB3' ' A' ' 52' ' ' HIS . . . -54.81 151.57 8.32 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 178.809 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.587 ' CD2' ' HB1' ' A' ' 53' ' ' ALA . 0.5 OUTLIER 64.95 165.7 0.16 Allowed 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.658 -1.276 . . . . 0.0 107.784 -179.276 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.587 ' HB1' ' CD2' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 118.045 -0.979 . . . . 0.0 109.414 -179.559 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.53 ' ND2' ' N ' ' A' ' 9' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.664 0 CA-C-O 121.017 0.436 . . . . 0.0 110.061 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.527 ' CB ' HG11 ' A' ' 38' ' ' VAL . . . -55.77 -16.82 4.87 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 120.979 -1.076 . . . . 0.0 109.619 -179.883 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.54 ' CG ' ' CG2' ' A' ' 32' ' ' ILE . 2.5 tttp -40.85 -35.47 0.51 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.196 -0.94 . . . . 0.0 110.241 -179.734 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -88.07 -32.6 18.65 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.109 -0.994 . . . . 0.0 110.038 -179.51 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.82 -56.23 21.57 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.154 -0.966 . . . . 0.0 109.399 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.68 -55.7 24.47 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.294 -0.879 . . . . 0.0 110.149 -179.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.565 HG22 ' CE1' ' A' ' 29' ' ' PHE . 73.0 mt -53.41 -30.85 18.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.151 -0.968 . . . . 0.0 109.48 -179.819 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.29 -38.73 88.44 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.457 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 2.4 pt-20 -83.57 1.88 39.94 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 109.111 -0.699 . . . . 0.0 109.111 179.634 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.528 ' CG ' ' HE3' ' A' ' 45' ' ' LYS . 1.1 tm? -97.86 -53.64 3.34 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.286 -0.884 . . . . 0.0 109.377 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.416 ' O ' ' HG2' ' A' ' 19' ' ' LYS . 5.7 ttmt -56.71 -18.2 11.6 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.32 -0.863 . . . . 0.0 109.294 -179.857 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.4 ttmt -96.16 -26.15 15.57 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.315 -0.865 . . . . 0.0 109.264 179.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.33 -49.74 75.18 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.257 -0.902 . . . . 0.0 109.557 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 138.86 -3.57 2.86 Favored Glycine 0 N--CA 1.49 2.236 0 C-N-CA 119.665 -1.255 . . . . 0.0 110.133 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.588 ' CG2' ' CE1' ' A' ' 52' ' ' HIS . 0.0 OUTLIER -100.18 149.26 6.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 120.867 -1.372 . . . . 0.0 109.574 179.846 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -133.23 11.58 4.19 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.432 -0.792 . . . . 0.0 109.234 179.755 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.34 139.88 58.53 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.234 -0.916 . . . . 0.0 109.447 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.401 ' N ' ' OD1' ' A' ' 26' ' ' ASP . 1.3 m-20 -87.64 6.07 36.45 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.313 -0.867 . . . . 0.0 109.784 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.688 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 8.3 t80 -80.26 -17.23 52.78 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.119 -0.988 . . . . 0.0 109.321 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.688 ' CE1' ' CD2' ' A' ' 27' ' ' PHE . 18.1 m-85 -101.36 -28.46 12.59 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.226 -0.921 . . . . 0.0 109.12 179.687 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.565 ' CE1' HG22 ' A' ' 15' ' ' ILE . 9.5 m-85 -83.07 -47.05 12.08 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.474 -0.766 . . . . 0.0 109.193 179.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 40.7 m-20 -60.78 -36.63 79.48 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.479 -0.763 . . . . 0.0 109.406 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.6 -13.7 59.84 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.342 -0.849 . . . . 0.0 109.691 -179.55 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.54 ' CG2' ' CG ' ' A' ' 11' ' ' LYS . 4.3 mt -68.01 -48.61 73.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.268 -0.895 . . . . 0.0 109.351 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.526 ' HB2' ' CE ' ' A' ' 11' ' ' LYS . 8.4 t30 -64.92 -22.53 67.01 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.218 -0.926 . . . . 0.0 109.624 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.473 ' O ' ' O ' ' A' ' 35' ' ' ALA . 5.7 mptp? -96.54 -14.71 22.07 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.178 -0.951 . . . . 0.0 109.744 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.473 ' O ' ' O ' ' A' ' 34' ' ' LYS . . . -43.61 168.68 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.315 -0.865 . . . . 0.0 109.795 -179.67 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.7 tttm -77.3 -78.73 0.12 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.211 -0.931 . . . . 0.0 109.582 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.466 ' O ' ' CG2' ' A' ' 41' ' ' VAL . 14.8 t -121.54 -174.34 2.84 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.233 -0.917 . . . . 0.0 108.868 179.787 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.527 HG11 ' CB ' ' A' ' 10' ' ' ALA . 24.9 t -59.79 -57.31 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.105 -0.997 . . . . 0.0 109.436 179.828 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.556 ' O ' ' CB ' ' A' ' 43' ' ' ALA . 73.2 mm-40 -51.37 -19.51 1.36 Allowed 'General case' 0 C--N 1.295 -1.797 0 O-C-N 120.974 -1.079 . . . . 0.0 109.414 -179.639 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.473 ' OE1' ' HA ' ' A' ' 40' ' ' GLU . 4.6 tp10 -90.5 -33.24 16.02 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.924 -1.11 . . . . 0.0 109.181 179.596 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.489 HG12 HG21 ' A' ' 32' ' ' ILE . 2.2 t -76.7 -66.27 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.456 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 178.372 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.407 ' OD1' ' C ' ' A' ' 42' ' ' ASN . 0.0 OUTLIER -46.94 -40.73 14.82 Favored 'General case' 0 C--N 1.296 -1.738 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.19 178.317 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.556 ' CB ' ' O ' ' A' ' 39' ' ' GLU . . . -68.49 -37.37 80.05 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.263 -0.898 . . . . 0.0 109.748 179.884 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.494 ' CD1' ' C ' ' A' ' 44' ' ' LEU . 0.3 OUTLIER -65.28 -30.56 71.44 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.152 -0.967 . . . . 0.0 109.051 -179.916 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.534 ' CE ' HD13 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -63.39 -43.94 96.13 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.179 -0.95 . . . . 0.0 109.181 179.641 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -75.76 -13.93 60.31 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.426 -0.796 . . . . 0.0 109.537 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.46 ' O ' ' HB1' ' A' ' 51' ' ' ALA . 4.4 mm-40 -79.7 -28.33 40.64 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.29 -0.881 . . . . 0.0 109.716 -179.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.581 HG12 ' CG ' ' A' ' 28' ' ' TYR . 14.4 mt -56.15 -41.61 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.115 -0.991 . . . . 0.0 108.725 179.429 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 89.7 mt -45.24 -36.1 3.74 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.31 -0.869 . . . . 0.0 109.978 179.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.4 mttt -117.68 2.17 12.27 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.985 -1.072 . . . . 0.0 110.789 -179.361 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.46 ' HB1' ' O ' ' A' ' 47' ' ' GLU . . . -100.83 -7.74 23.29 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.98 -1.075 . . . . 0.0 109.503 179.79 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.588 ' CE1' ' CG2' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -145.13 8.74 1.23 Allowed 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.153 -0.967 . . . . 0.0 110.232 -178.822 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.522 0 CA-C-O 117.95 -1.024 . . . . 0.0 109.449 -179.94 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.57 ' ND2' ' N ' ' A' ' 9' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.494 1.735 0 CA-C-O 121.284 0.564 . . . . 0.0 110.995 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.459 ' O ' ' C ' ' A' ' 11' ' ' LYS . . . -54.93 -13.2 1.01 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.181 -0.949 . . . . 0.0 111.037 -179.076 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.489 ' HG3' ' HB3' ' A' ' 33' ' ' ASN . 0.0 OUTLIER -36.9 -43.01 0.42 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.231 -0.918 . . . . 0.0 110.982 -179.407 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -100.63 -21.07 15.37 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.888 -1.132 . . . . 0.0 110.28 -179.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -69.21 -15.95 63.5 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.044 -1.035 . . . . 0.0 109.454 -179.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -105.75 -40.61 5.68 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.346 -0.846 . . . . 0.0 108.927 179.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.585 ' CG2' ' CZ ' ' A' ' 29' ' ' PHE . 55.2 mt -62.81 -28.6 45.27 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 O-C-N 121.494 -0.754 . . . . 0.0 109.17 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.5 -22.67 22.1 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.404 -0.81 . . . . 0.0 109.675 -179.466 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -85.26 -28.06 25.6 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.377 -0.827 . . . . 0.0 110.343 -179.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.524 ' CD1' ' HE2' ' A' ' 45' ' ' LYS . 2.2 mt -84.25 -32.33 24.51 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.14 -0.975 . . . . 0.0 110.693 -178.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -56.5 -21.64 27.36 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 120.97 -1.081 . . . . 0.0 109.736 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 6.5 tttm -100.9 -29.46 12.2 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.21 -0.931 . . . . 0.0 110.038 -179.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -69.14 -33.32 73.25 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.136 -0.978 . . . . 0.0 109.741 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 124.81 -26.58 5.62 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.356 -1.497 . . . . 0.0 109.356 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . 0.558 HG12 ' CE1' ' A' ' 52' ' ' HIS . 62.0 mt -66.2 106.44 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.368 -1.077 . . . . 0.0 109.393 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 9.6 p -128.99 17.67 6.15 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.085 -1.009 . . . . 0.0 109.56 -179.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 65.6 m -65.62 152.63 43.69 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.255 -0.903 . . . . 0.0 109.242 179.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.458 ' O ' ' CB ' ' A' ' 30' ' ' ASN . 7.9 m-20 -87.21 -3.08 59.03 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.189 -0.944 . . . . 0.0 109.787 -179.765 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.722 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 18.0 t80 -80.08 -7.5 58.91 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.155 -0.966 . . . . 0.0 109.269 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.722 ' CE1' ' CE2' ' A' ' 27' ' ' PHE . 37.8 m-85 -118.49 -34.78 3.92 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 179.308 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' PHE . . . . . 0.585 ' CZ ' ' CG2' ' A' ' 15' ' ' ILE . 6.1 m-30 -78.58 -40.9 33.37 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 178.838 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.458 ' CB ' ' O ' ' A' ' 26' ' ' ASP . 19.8 t30 -68.62 -49.61 57.87 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.465 -0.772 . . . . 0.0 108.966 179.527 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.06 -12.85 62.06 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.495 -0.753 . . . . 0.0 109.603 -179.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ILE . . . . . 0.478 ' CD1' ' O ' ' A' ' 28' ' ' TYR . 0.7 OUTLIER -73.7 -50.52 29.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.262 -0.899 . . . . 0.0 108.961 179.839 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASN . . . . . 0.489 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 17.2 p30 -79.7 -10.93 59.86 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.242 -0.911 . . . . 0.0 109.366 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.479 ' O ' ' O ' ' A' ' 35' ' ' ALA . 7.8 mmtt -91.29 -14.83 30.13 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.344 -0.848 . . . . 0.0 109.654 -179.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.479 ' O ' ' O ' ' A' ' 34' ' ' LYS . . . -55.09 -160.74 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.527 -0.733 . . . . 0.0 110.198 -179.517 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 27.8 mmtp -101.79 -62.87 1.2 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.103 -0.998 . . . . 0.0 110.401 -179.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.496 ' O ' HG21 ' A' ' 41' ' ' VAL . 66.6 p -125.86 178.02 5.97 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.945 -1.097 . . . . 0.0 110.082 -179.415 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.411 HG11 ' HB2' ' A' ' 10' ' ' ALA . 88.6 t -61.39 -34.46 61.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.331 -0.856 . . . . 0.0 109.331 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.13 -27.39 69.05 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 178.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -79.58 -31.27 41.83 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.662 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.496 HG21 ' O ' ' A' ' 37' ' ' THR . 18.6 t -68.32 -67.53 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 178.796 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -49.56 -39.37 34.61 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.429 -0.794 . . . . 0.0 109.468 179.496 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.9 -38.96 93.01 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.294 -0.879 . . . . 0.0 109.619 -179.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.469 ' O ' HD13 ' A' ' 48' ' ' ILE . 7.6 mt -66.85 -46.61 74.54 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.282 -0.887 . . . . 0.0 110.258 -179.531 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.529 ' HA ' ' CD1' ' A' ' 48' ' ' ILE . 0.2 OUTLIER -65.61 -19.65 66.0 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.037 -1.04 . . . . 0.0 110.23 -179.243 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -79.84 -18.23 51.29 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.054 -1.029 . . . . 0.0 109.566 -179.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.539 ' O ' ' CB ' ' A' ' 51' ' ' ALA . 55.7 tt0 -90.76 -17.74 26.14 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.186 -0.946 . . . . 0.0 109.172 179.669 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.677 ' CG1' ' CD1' ' A' ' 28' ' ' TYR . 1.4 mt -68.6 -35.43 70.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.252 -0.905 . . . . 0.0 108.91 179.478 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 14.5 tp -56.4 -30.05 62.29 Favored 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.162 -0.961 . . . . 0.0 109.324 179.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.412 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -122.28 5.87 9.68 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.197 -0.939 . . . . 0.0 109.889 -179.894 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . 0.539 ' CB ' ' O ' ' A' ' 47' ' ' GLU . . . -101.39 -46.62 4.95 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.092 -1.005 . . . . 0.0 109.466 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.572 ' CD2' HG22 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -112.66 -19.5 12.03 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.447 -0.783 . . . . 0.0 109.661 -178.975 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.486 ' N ' ' CD2' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.489 1.512 0 CA-C-O 118.012 -0.994 . . . . 0.0 109.42 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.592 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 25.5 mt -137.1 46.27 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 O-C-N 121.213 -0.929 . . . . 0.0 109.47 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.73 -26.48 68.39 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.155 -0.966 . . . . 0.0 108.43 179.512 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -50.71 -23.94 3.03 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.557 -0.715 . . . . 0.0 109.229 179.271 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.511 ' O ' ' N ' ' A' ' 7' ' ' LEU . 1.7 t90 -44.52 -62.94 1.01 Allowed 'General case' 0 C--N 1.305 -1.34 0 O-C-N 121.503 -0.748 . . . . 0.0 111.091 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.515 ' CD1' ' HB2' ' A' ' 8' ' ' LYS . 3.4 tm? -30.47 -38.51 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.932 -0.48 . . . . 0.0 110.541 -178.637 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.514 ' CD2' HG23 ' A' ' 41' ' ' VAL . 4.5 tp 69.94 -122.78 0.12 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.281 -0.887 . . . . 0.0 109.755 179.22 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.515 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 0.6 OUTLIER 66.4 36.13 5.36 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.802 -1.186 . . . . 0.0 109.6 -179.814 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.462 ' ND2' ' HG ' ' A' ' 7' ' ' LEU . 1.8 p30 -131.28 -49.2 1.0 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.273 -0.892 . . . . 0.0 109.87 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.464 ' O ' ' HB1' ' A' ' 14' ' ' ALA . . . -80.43 -15.37 56.95 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.1 -1.0 . . . . 0.0 109.501 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.548 ' O ' ' CG1' ' A' ' 15' ' ' ILE . 0.1 OUTLIER -63.44 -32.6 74.09 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.271 -0.893 . . . . 0.0 109.91 -179.44 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.454 ' HG2' ' CE ' ' A' ' 11' ' ' LYS . 3.8 mm-40 -92.36 -44.12 8.88 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.865 -1.147 . . . . 0.0 109.627 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -65.94 -18.71 65.52 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.132 -0.98 . . . . 0.0 109.696 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.477 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -99.0 -43.83 6.54 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.313 -0.867 . . . . 0.0 109.262 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.572 HG12 ' CD1' ' A' ' 29' ' ' PHE . 58.6 mt -62.83 -29.04 46.14 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.529 0 O-C-N 121.491 -0.756 . . . . 0.0 109.371 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.04 -15.55 63.65 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.499 -0.75 . . . . 0.0 110.342 -178.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.447 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 32.7 tt0 -116.98 -14.41 10.62 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.074 -1.016 . . . . 0.0 109.857 -179.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.522 ' CD2' ' HG2' ' A' ' 45' ' ' LYS . 5.7 mt -90.21 -33.0 16.35 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.111 -0.993 . . . . 0.0 109.459 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.1 ptmm? -56.84 -19.54 17.98 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.14 -0.975 . . . . 0.0 108.702 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -86.95 -31.22 20.76 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.466 -0.771 . . . . 0.0 108.973 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.65 -20.25 7.76 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.387 -0.821 . . . . 0.0 109.389 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 116.14 -39.16 2.8 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.42 -1.472 . . . . 0.0 109.42 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.524 HD12 ' CG2' ' A' ' 48' ' ' ILE . 13.0 mt -54.03 107.89 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.224 -1.162 . . . . 0.0 109.332 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -115.2 7.51 15.32 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.259 -0.901 . . . . 0.0 109.629 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.3 t -59.95 152.98 22.29 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.15 -0.969 . . . . 0.0 109.265 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.49 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 9.4 p-10 -100.46 -9.13 22.45 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.238 -0.914 . . . . 0.0 109.578 -179.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.538 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 15.1 t80 -74.83 -24.45 58.61 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.078 -1.014 . . . . 0.0 109.583 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.639 ' CG ' ' CG1' ' A' ' 48' ' ' ILE . 23.6 m-85 -94.95 -42.39 8.68 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.217 -0.927 . . . . 0.0 109.171 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.572 ' CD1' HG12 ' A' ' 15' ' ' ILE . 5.3 m-85 -62.81 -45.87 90.59 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 121.54 -0.725 . . . . 0.0 109.734 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.49 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 0.4 OUTLIER -65.78 -39.55 91.1 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.13 -0.981 . . . . 0.0 109.626 -179.844 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.6 -10.73 60.21 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.206 -0.934 . . . . 0.0 109.519 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.468 HD11 ' O ' ' A' ' 28' ' ' TYR . 0.3 OUTLIER -65.94 -24.36 33.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.399 -0.813 . . . . 0.0 109.071 -179.869 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.8 m-20 -80.51 -37.61 31.31 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.315 -0.865 . . . . 0.0 109.764 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -57.88 -20.44 36.8 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.259 -0.901 . . . . 0.0 109.438 -179.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.457 ' HB2' HG21 ' A' ' 41' ' ' VAL . . . -47.13 155.93 0.26 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.248 -0.908 . . . . 0.0 109.343 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.494 ' CD ' ' N ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -90.94 -55.3 3.61 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.323 -0.861 . . . . 0.0 109.382 -179.967 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 13.7 t -125.02 -175.79 3.39 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.244 -0.91 . . . . 0.0 109.466 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 95.9 t -63.21 -30.32 49.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.049 -1.032 . . . . 0.0 109.267 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.54 ' O ' ' CB ' ' A' ' 43' ' ' ALA . 1.9 tt0 -72.14 -21.7 61.42 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 179.456 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.429 ' HG3' ' HG2' ' A' ' 36' ' ' LYS . 37.6 mm-40 -86.48 -31.09 21.52 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.39 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.514 HG23 ' CD2' ' A' ' 7' ' ' LEU . 24.5 t -72.72 -56.68 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 179.108 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 65.8 m-20 -62.86 -27.93 69.68 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 178.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.54 ' CB ' ' O ' ' A' ' 39' ' ' GLU . . . -66.87 -46.74 74.01 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.485 -0.76 . . . . 0.0 109.448 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.518 ' O ' ' CD1' ' A' ' 48' ' ' ILE . 2.1 mt -59.2 -35.15 73.1 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.233 -0.917 . . . . 0.0 108.87 179.748 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.522 ' HG2' ' CD2' ' A' ' 18' ' ' LEU . 0.0 OUTLIER -62.0 -40.48 95.8 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.321 -0.862 . . . . 0.0 108.973 179.494 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.468 ' O ' ' HB2' ' A' ' 49' ' ' LEU . 75.1 m-20 -65.9 -20.69 66.31 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.315 -0.865 . . . . 0.0 109.04 179.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.07 -36.31 61.77 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.298 -0.876 . . . . 0.0 109.659 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.639 ' CG1' ' CG ' ' A' ' 28' ' ' TYR . 3.7 mp -58.47 -27.41 33.39 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 O-C-N 120.959 -1.088 . . . . 0.0 108.376 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.468 ' HB2' ' O ' ' A' ' 46' ' ' ASN . 2.5 mm? -56.07 -39.0 71.42 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.435 -0.79 . . . . 0.0 109.072 179.189 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.429 ' O ' ' C ' ' A' ' 51' ' ' ALA . 0.0 OUTLIER -109.63 -62.24 1.53 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.212 -0.93 . . . . 0.0 109.818 -179.401 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.429 ' C ' ' O ' ' A' ' 50' ' ' LYS . . . -41.23 -37.81 1.01 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.295 -0.878 . . . . 0.0 109.966 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.589 ' CG ' HG21 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -115.62 129.07 56.37 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.349 -0.845 . . . . 0.0 109.083 -179.547 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.541 ' CB ' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 118.068 -0.968 . . . . 0.0 109.307 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 17.7 p . . . . . 0 N--CA 1.49 1.551 0 CA-C-O 121.367 0.603 . . . . 0.0 109.462 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -114.84 49.46 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.332 -0.855 . . . . 0.0 109.339 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -72.11 -4.5 29.38 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.231 -0.918 . . . . 0.0 109.072 179.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.471 ' O ' ' O ' ' A' ' 5' ' ' TRP . 0.4 OUTLIER -63.66 -9.45 13.94 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.397 -0.814 . . . . 0.0 109.842 -179.978 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.482 ' O ' ' N ' ' A' ' 7' ' ' LEU . 1.7 t90 -52.67 -105.45 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.226 -0.921 . . . . 0.0 109.879 -179.806 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.474 ' O ' ' HB3' ' A' ' 7' ' ' LEU . 4.0 mt 41.04 23.92 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.666 -1.272 . . . . 0.0 110.869 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.569 ' CD1' ' CG2' ' A' ' 41' ' ' VAL . 0.1 OUTLIER 72.9 -16.11 0.48 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 120.879 -1.138 . . . . 0.0 110.921 179.463 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.21 88.96 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.509 0 O-C-N 120.569 -1.332 . . . . 0.0 109.679 -179.58 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.502 ' ND2' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -143.0 -65.12 0.4 Allowed 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 179.431 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.455 ' O ' ' HB1' ' A' ' 14' ' ' ALA . . . -80.51 -6.92 58.92 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 178.163 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.421 ' HE2' ' CG ' ' A' ' 33' ' ' ASN . 13.6 tttm -61.31 -35.71 78.11 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 121.614 -0.678 . . . . 0.0 109.985 -179.666 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -89.25 -51.3 5.64 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.05 -1.031 . . . . 0.0 109.115 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -53.97 -21.72 8.72 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.54 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -89.51 -59.16 2.28 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 121.558 -0.714 . . . . 0.0 109.14 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.523 HD11 ' N ' ' A' ' 15' ' ' ILE . 0.2 OUTLIER -41.09 -36.98 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 O-C-N 121.52 -0.737 . . . . 0.0 109.392 179.978 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.22 -48.68 77.26 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.419 ' N ' ' O ' ' A' ' 14' ' ' ALA . 3.7 mm-40 -73.27 -12.68 60.94 Favored 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.834 -0.541 . . . . 0.0 110.79 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.65 ' CB ' ' CZ ' ' A' ' 29' ' ' PHE . 1.0 OUTLIER -88.43 -32.56 18.24 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.637 -1.29 . . . . 0.0 109.694 -179.307 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.29 -17.11 62.48 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.185 -0.947 . . . . 0.0 109.339 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.436 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 1.0 OUTLIER -96.55 -22.36 17.12 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.232 -0.918 . . . . 0.0 109.548 -179.873 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.17 -26.68 66.77 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.218 -0.926 . . . . 0.0 109.411 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 112.66 -23.78 14.52 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.504 HD12 HG23 ' A' ' 48' ' ' ILE . 31.7 mt -75.09 92.57 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.288 -1.125 . . . . 0.0 109.735 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.1 p -95.66 5.5 51.28 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.126 -0.984 . . . . 0.0 109.127 179.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.7 t -57.18 138.34 54.75 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.318 -0.864 . . . . 0.0 109.025 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.476 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 5.0 m-20 -91.78 -5.77 52.93 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.218 -0.927 . . . . 0.0 109.816 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.653 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 2.1 t80 -74.09 -16.27 61.03 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.129 -0.982 . . . . 0.0 108.591 179.702 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.653 ' CE1' ' CE2' ' A' ' 27' ' ' PHE . 21.7 m-85 -103.99 -50.15 3.45 Favored 'General case' 0 C--N 1.298 -1.667 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 179.4 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.65 ' CZ ' ' CB ' ' A' ' 18' ' ' LEU . 3.1 m-85 -55.89 -45.35 78.64 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.476 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 8.3 m120 -60.82 -43.97 97.51 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.251 -0.906 . . . . 0.0 109.091 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.458 ' O ' HD12 ' A' ' 44' ' ' LEU . . . -73.67 -13.75 61.04 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.441 -0.787 . . . . 0.0 109.626 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.532 ' CD1' ' CD1' ' A' ' 18' ' ' LEU . 4.5 mt -71.15 -40.32 74.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.297 -0.877 . . . . 0.0 108.898 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.421 ' CG ' ' HE2' ' A' ' 11' ' ' LYS . 0.9 OUTLIER -76.5 -19.62 57.8 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.205 -0.934 . . . . 0.0 109.317 179.787 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.462 ' O ' ' O ' ' A' ' 35' ' ' ALA . 2.5 mtpt -75.33 -15.66 60.47 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.391 -0.818 . . . . 0.0 109.61 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.525 ' O ' ' CD2' ' A' ' 7' ' ' LEU . . . -40.39 162.64 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.461 -0.774 . . . . 0.0 109.882 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.452 ' O ' HG21 ' A' ' 37' ' ' THR . 3.4 tttm -101.89 -19.86 15.1 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.424 -0.797 . . . . 0.0 109.021 179.66 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.465 ' O ' HG21 ' A' ' 41' ' ' VAL . 11.2 p -153.2 -179.76 8.0 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.446 -0.784 . . . . 0.0 109.04 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.502 HG23 ' ND2' ' A' ' 9' ' ' ASN . 18.7 t -65.04 -38.48 82.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.1 -1.0 . . . . 0.0 108.912 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.529 ' O ' ' CB ' ' A' ' 43' ' ' ALA . 29.2 mt-10 -64.68 -28.49 69.64 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.254 -0.904 . . . . 0.0 108.782 179.332 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.514 ' HB3' ' CB ' ' A' ' 35' ' ' ALA . 0.3 OUTLIER -79.48 -31.18 42.29 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 179.485 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.569 ' CG2' ' CD1' ' A' ' 7' ' ' LEU . 12.5 t -70.49 -65.26 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 178.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -55.7 -33.34 64.11 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.596 -0.69 . . . . 0.0 109.34 179.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.529 ' CB ' ' O ' ' A' ' 39' ' ' GLU . . . -61.2 -42.25 98.26 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.321 -0.862 . . . . 0.0 109.242 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.482 ' O ' HG13 ' A' ' 48' ' ' ILE . 0.4 OUTLIER -57.74 -50.18 74.08 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.225 -0.922 . . . . 0.0 110.04 -179.62 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.545 ' HD3' ' CD1' ' A' ' 18' ' ' LEU . 10.4 tptp -50.02 -29.67 9.16 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.041 -1.037 . . . . 0.0 110.499 -179.367 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 36.5 m-20 -80.02 -46.79 15.98 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.026 -1.046 . . . . 0.0 110.21 -179.236 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -54.52 -28.4 45.04 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.086 -1.009 . . . . 0.0 110.01 -179.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.618 HG12 ' CD1' ' A' ' 28' ' ' TYR . 21.1 mt -60.37 -44.38 95.88 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 O-C-N 121.016 -1.052 . . . . 0.0 109.237 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.555 ' HA ' ' CB ' ' A' ' 53' ' ' ALA . 1.0 OUTLIER -56.23 -19.06 12.27 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.536 -0.727 . . . . 0.0 110.449 -179.411 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.1 -58.41 1.89 Allowed 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.801 -1.187 . . . . 0.0 110.774 -179.102 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.497 ' O ' ' CB ' ' A' ' 52' ' ' HIS . . . -82.67 46.45 1.08 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.315 -0.865 . . . . 0.0 110.293 -179.014 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.543 ' CG ' ' N ' ' A' ' 53' ' ' ALA . 3.7 t-80 170.22 -81.83 0.0 OUTLIER 'General case' 0 C--N 1.302 -1.488 0 O-C-N 120.83 -1.169 . . . . 0.0 109.476 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.555 ' CB ' ' HA ' ' A' ' 49' ' ' LEU . . . . . . . . 0 N--CA 1.489 1.524 0 CA-C-O 118.01 -0.995 . . . . 0.0 109.456 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 13.5 t . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.295 0.569 . . . . 0.0 109.538 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.571 HD12 ' CH2' ' A' ' 5' ' ' TRP . 1.2 pp -104.15 17.68 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.396 0 O-C-N 121.278 -0.889 . . . . 0.0 109.794 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.434 ' O ' ' C ' ' A' ' 4' ' ' GLN . 7.5 t70 -58.51 -13.92 6.72 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.334 -0.854 . . . . 0.0 109.559 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.434 ' C ' ' O ' ' A' ' 3' ' ' ASP . 1.4 mm-40 -39.91 -47.88 2.25 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.428 -0.795 . . . . 0.0 110.869 -179.686 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.571 ' CH2' HD12 ' A' ' 2' ' ' ILE . 11.9 p-90 -115.48 -135.0 0.35 Allowed 'General case' 0 C--N 1.309 -1.184 0 O-C-N 120.694 -1.254 . . . . 0.0 109.147 -179.159 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -176.57 91.22 0.04 OUTLIER 'General case' 0 C--N 1.299 -1.604 0 O-C-N 121.096 -1.002 . . . . 0.0 109.026 -179.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.511 HD23 ' CG2' ' A' ' 41' ' ' VAL . 14.8 tp 49.77 -128.33 2.15 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 121.433 -0.792 . . . . 0.0 109.492 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.457 ' HB2' ' O ' ' A' ' 7' ' ' LEU . 1.3 mmmm 64.19 62.05 0.87 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 120.851 -1.156 . . . . 0.0 109.613 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -144.97 -55.73 0.32 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.36 -0.837 . . . . 0.0 108.84 179.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -79.67 4.59 15.64 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.302 -0.874 . . . . 0.0 109.212 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.532 ' O ' ' CG1' ' A' ' 15' ' ' ILE . 0.5 OUTLIER -52.44 -91.81 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.252 -0.905 . . . . 0.0 110.546 -179.407 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -67.26 -22.93 65.65 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.999 -1.063 . . . . 0.0 111.06 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -62.07 -63.51 1.23 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.763 -1.21 . . . . 0.0 109.508 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.25 -47.97 38.69 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.179 -0.95 . . . . 0.0 109.12 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.605 ' CA ' ' HE3' ' A' ' 45' ' ' LYS . 70.5 mt -47.1 -30.47 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.491 -0.756 . . . . 0.0 109.756 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.47 -52.21 59.09 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.468 -0.77 . . . . 0.0 109.856 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -49.9 -32.15 13.89 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.246 -0.909 . . . . 0.0 110.123 -179.679 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.477 HD22 HD13 ' A' ' 48' ' ' ILE . 10.0 mp -90.37 -24.94 20.66 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.43 -0.794 . . . . 0.0 110.263 -178.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.2 tttt -64.03 -22.3 66.87 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.339 -0.85 . . . . 0.0 110.02 -179.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.42 -13.21 41.03 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.204 -0.935 . . . . 0.0 109.625 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -81.66 -4.12 55.32 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.225 -0.922 . . . . 0.0 109.589 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.06 -41.8 2.2 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.802 -1.319 . . . . 0.0 109.802 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.443 HD12 HG23 ' A' ' 48' ' ' ILE . 59.7 mt -47.04 117.55 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.163 -1.198 . . . . 0.0 109.666 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.73 17.91 5.2 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.306 -0.872 . . . . 0.0 109.508 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.418 ' HB3' ' CD2' ' A' ' 28' ' ' TYR . 3.0 t -54.97 127.67 29.94 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.108 -0.995 . . . . 0.0 109.038 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.558 ' O ' ' CB ' ' A' ' 30' ' ' ASN . 17.4 p-10 -72.15 -13.39 61.54 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.187 -0.946 . . . . 0.0 109.878 -179.394 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.531 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 18.9 t80 -81.44 -3.2 52.24 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 120.479 -1.388 . . . . 0.0 108.901 179.368 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.574 ' CG ' HG12 ' A' ' 48' ' ' ILE . 21.4 m-30 -111.48 -29.88 7.6 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.589 ' CD1' HG12 ' A' ' 15' ' ' ILE . 3.9 m-30 -103.23 -43.75 5.37 Favored 'General case' 0 C--N 1.295 -1.763 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.558 ' CB ' ' O ' ' A' ' 26' ' ' ASP . 3.1 t-20 -68.33 -26.94 65.86 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 108.45 -0.945 . . . . 0.0 108.45 179.127 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -88.55 4.43 46.85 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.53 -0.731 . . . . 0.0 109.68 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.518 HD13 ' CG ' ' A' ' 45' ' ' LYS . 0.7 OUTLIER -84.73 -20.79 8.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.169 -0.957 . . . . 0.0 109.104 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.522 ' HB2' ' CE ' ' A' ' 11' ' ' LYS . 0.7 OUTLIER -76.5 -23.48 53.74 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.127 -0.983 . . . . 0.0 109.004 179.387 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.453 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.4 OUTLIER -80.21 -18.44 49.53 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.396 -0.815 . . . . 0.0 109.313 179.716 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.453 ' O ' ' O ' ' A' ' 34' ' ' LYS . . . -44.54 168.99 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.342 -0.849 . . . . 0.0 109.807 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 45.0 mttp -106.27 -69.85 0.81 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.425 -0.797 . . . . 0.0 109.248 179.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 8.8 t -108.38 179.0 4.33 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.277 -0.889 . . . . 0.0 108.877 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.516 HG11 ' ND2' ' A' ' 42' ' ' ASN . 25.5 t -59.35 -44.92 93.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 O-C-N 120.956 -1.09 . . . . 0.0 108.942 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.46 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 0.5 OUTLIER -56.32 -27.01 54.32 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 179.449 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -78.89 -33.74 45.38 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 179.069 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.511 ' CG2' HD23 ' A' ' 7' ' ' LEU . 90.7 t -71.09 -73.4 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.389 0 N-CA-C 107.937 -1.135 . . . . 0.0 107.937 178.706 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.516 ' ND2' HG11 ' A' ' 38' ' ' VAL . 76.2 m-20 -44.26 -28.19 0.5 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.553 -0.717 . . . . 0.0 109.328 179.15 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.46 ' HB3' ' O ' ' A' ' 39' ' ' GLU . . . -68.55 -52.78 28.18 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.155 -0.966 . . . . 0.0 109.291 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.443 ' HB2' HD12 ' A' ' 32' ' ' ILE . 6.1 mt -60.12 -34.79 74.0 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.369 -0.832 . . . . 0.0 110.295 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.605 ' HE3' ' CA ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -77.17 -27.25 53.68 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.063 -1.023 . . . . 0.0 109.271 -179.777 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -80.47 -22.42 41.06 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.266 -0.897 . . . . 0.0 108.84 179.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.525 ' O ' ' CB ' ' A' ' 51' ' ' ALA . 0.6 OUTLIER -78.18 1.31 21.8 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.466 -0.771 . . . . 0.0 109.037 179.456 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.574 HG12 ' CG ' ' A' ' 28' ' ' TYR . 42.2 mt -80.6 -46.66 21.24 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 O-C-N 121.176 -0.953 . . . . 0.0 108.783 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.54 -30.18 68.43 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.652 -0.655 . . . . 0.0 109.944 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.7 mmtt -100.06 -62.61 1.22 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.108 -0.995 . . . . 0.0 109.751 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.525 ' CB ' ' O ' ' A' ' 47' ' ' GLU . . . -51.05 -21.68 1.97 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.214 -0.929 . . . . 0.0 109.031 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.627 ' CG ' ' N ' ' A' ' 53' ' ' ALA . 1.4 t-80 -148.72 170.94 17.05 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 -179.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.627 ' N ' ' CG ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 118.044 -0.979 . . . . 0.0 109.445 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' THR . . . . . 0.533 ' O ' ' CG2' ' A' ' 2' ' ' ILE . 6.3 t . . . . . 0 N--CA 1.49 1.546 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.533 ' CG2' ' O ' ' A' ' 1' ' ' THR . 15.0 tt 41.83 41.63 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.486 -0.759 . . . . 0.0 109.654 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.38 -9.18 38.92 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.303 -0.873 . . . . 0.0 109.176 179.461 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.482 ' O ' ' O ' ' A' ' 5' ' ' TRP . 0.0 OUTLIER -73.29 -2.24 21.19 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.335 -0.853 . . . . 0.0 109.622 179.943 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.493 ' O ' ' N ' ' A' ' 7' ' ' LEU . 18.4 t90 -40.35 -96.64 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.411 -0.806 . . . . 0.0 110.899 -179.399 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.529 ' N ' ' CD2' ' A' ' 6' ' ' LEU . 3.8 mm? 38.87 28.11 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.996 -1.065 . . . . 0.0 110.355 -179.575 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.542 ' CD1' ' O ' ' A' ' 7' ' ' LEU . 0.7 OUTLIER 40.57 74.06 0.11 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.341 -0.85 . . . . 0.0 109.39 -179.567 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 21.5 mtpt -129.65 17.36 5.82 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 121.284 -0.885 . . . . 0.0 108.621 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.501 ' O ' ' CB ' ' A' ' 13' ' ' ASP . 5.8 p30 -85.5 -47.12 10.22 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 179.294 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.543 ' O ' ' CB ' ' A' ' 14' ' ' ALA . . . -81.02 -14.19 58.14 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.422 -0.799 . . . . 0.0 108.949 179.099 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.565 ' HA ' ' CG2' ' A' ' 32' ' ' ILE . 0.7 OUTLIER -48.36 -68.22 0.2 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.045 -1.034 . . . . 0.0 109.863 -179.823 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -98.9 -23.12 15.46 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.993 -1.067 . . . . 0.0 109.804 -179.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.501 ' CB ' ' O ' ' A' ' 9' ' ' ASN . 4.1 t0 -75.7 -19.21 59.28 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.162 -0.961 . . . . 0.0 109.02 179.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.543 ' CB ' ' O ' ' A' ' 10' ' ' ALA . . . -102.27 -44.31 5.45 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.525 ' CD1' ' O ' ' A' ' 11' ' ' LYS . 59.6 mt -54.99 -29.08 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 121.381 -0.824 . . . . 0.0 109.066 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.64 -37.09 84.98 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.502 -0.749 . . . . 0.0 109.364 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -88.22 -16.18 33.95 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.459 -0.776 . . . . 0.0 110.291 -179.41 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.509 HD21 ' CD ' ' A' ' 45' ' ' LYS . 47.6 mt -83.66 -32.32 25.69 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.041 -1.037 . . . . 0.0 109.745 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.4 mtmt -65.06 -35.58 81.6 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.056 -1.027 . . . . 0.0 109.319 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.08 -10.51 56.79 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.419 -0.8 . . . . 0.0 109.248 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.406 ' HB1' ' O ' ' A' ' 18' ' ' LEU . . . -61.14 -42.49 98.64 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.254 -0.904 . . . . 0.0 109.261 179.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 141.74 -13.58 2.67 Favored Glycine 0 N--CA 1.491 2.353 0 N-CA-C 109.67 -1.372 . . . . 0.0 109.67 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.479 ' CD1' HG22 ' A' ' 48' ' ' ILE . 3.5 mt -105.53 146.39 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.108 -1.23 . . . . 0.0 109.85 -179.713 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.1 p -135.38 15.49 3.45 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 179.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.5 m -59.43 -168.51 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.424 -0.797 . . . . 0.0 109.475 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.506 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 0.3 OUTLIER -126.37 -16.05 5.5 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.222 -0.924 . . . . 0.0 109.862 -179.932 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.638 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 4.2 t80 -80.26 -9.07 59.72 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 120.635 -1.291 . . . . 0.0 109.038 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.671 ' CG ' HG12 ' A' ' 48' ' ' ILE . 17.8 m-85 -102.67 -23.97 13.79 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.342 -0.849 . . . . 0.0 108.837 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.465 ' CE2' ' HB2' ' A' ' 18' ' ' LEU . 80.3 m-85 -96.47 -51.95 4.15 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-O 121.149 0.5 . . . . 0.0 109.759 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.506 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 0.4 OUTLIER -63.66 -19.3 64.78 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.196 -0.94 . . . . 0.0 109.618 179.857 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -87.82 16.3 5.99 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.239 -0.913 . . . . 0.0 109.086 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.565 ' CG2' ' HA ' ' A' ' 11' ' ' LYS . 8.6 mm -76.21 -65.77 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 121.547 -0.721 . . . . 0.0 109.373 -179.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -51.28 -26.17 6.91 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.223 -0.923 . . . . 0.0 109.083 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.435 ' O ' ' C ' ' A' ' 35' ' ' ALA . 0.4 OUTLIER -62.3 -44.71 95.89 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.4 -0.812 . . . . 0.0 109.467 179.924 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.477 ' CB ' HG21 ' A' ' 41' ' ' VAL . . . -42.65 146.73 0.34 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.344 -0.847 . . . . 0.0 109.587 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.436 ' HG3' ' OE2' ' A' ' 40' ' ' GLU . 26.8 mttm -69.44 -64.65 0.84 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.272 -0.893 . . . . 0.0 109.825 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.494 ' OG1' ' HG2' ' A' ' 39' ' ' GLU . 1.2 p -118.82 -163.56 0.97 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.121 -0.987 . . . . 0.0 109.48 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.475 ' HA ' HG22 ' A' ' 41' ' ' VAL . 18.0 t -68.61 -55.36 16.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.251 -0.905 . . . . 0.0 109.741 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.545 ' O ' ' CB ' ' A' ' 43' ' ' ALA . 14.2 pt-20 -50.48 -23.16 2.28 Favored 'General case' 0 C--N 1.295 -1.778 0 O-C-N 121.058 -1.027 . . . . 0.0 108.542 179.592 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.438 ' HA ' ' HB1' ' A' ' 43' ' ' ALA . 1.4 mm-40 -83.1 -38.34 22.6 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.434 -0.791 . . . . 0.0 109.02 179.159 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.527 ' CG1' HG21 ' A' ' 32' ' ' ILE . 11.7 t -63.54 -58.87 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 179.263 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -62.52 -29.78 70.81 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.362 -0.836 . . . . 0.0 108.893 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.545 ' CB ' ' O ' ' A' ' 39' ' ' GLU . . . -65.72 -33.41 75.81 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.413 -0.804 . . . . 0.0 109.642 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.533 ' HG ' ' N ' ' A' ' 45' ' ' LYS . 0.3 OUTLIER -61.07 -39.44 89.87 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.174 -0.954 . . . . 0.0 109.519 -179.752 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.533 ' N ' ' HG ' ' A' ' 44' ' ' LEU . 30.5 tptt -66.61 -18.59 65.45 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.127 -0.983 . . . . 0.0 109.475 -179.874 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.465 ' HB2' ' O ' ' A' ' 43' ' ' ALA . 26.0 m-80 -73.41 -40.02 64.6 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.203 -0.936 . . . . 0.0 109.232 179.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.536 ' O ' ' CB ' ' A' ' 51' ' ' ALA . 39.1 mt-10 -62.65 -27.07 68.97 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.273 -0.892 . . . . 0.0 109.308 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.671 HG12 ' CG ' ' A' ' 28' ' ' TYR . 2.5 mp -70.73 -29.81 39.44 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 179.35 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.427 HD11 ' N ' ' A' ' 49' ' ' LEU . 4.5 mp -59.31 -30.39 68.3 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 179.238 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -122.41 5.5 9.63 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.209 -0.932 . . . . 0.0 109.722 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.536 ' CB ' ' O ' ' A' ' 47' ' ' GLU . . . -101.54 -49.54 3.99 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.248 -0.907 . . . . 0.0 109.907 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.59 ' CD2' HG21 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -106.91 -6.82 17.35 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.314 -0.866 . . . . 0.0 110.161 -178.987 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.416 ' HB1' ' CD2' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 118.112 -0.947 . . . . 0.0 109.539 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.619 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.522 ' O ' ' CD1' ' A' ' 2' ' ' ILE . 0.0 OUTLIER -127.0 -7.59 4.61 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.159 -0.963 . . . . 0.0 109.699 -179.767 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.454 ' O ' ' N ' ' A' ' 5' ' ' TRP . 3.2 m-20 -51.83 -20.55 2.28 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.962 -1.086 . . . . 0.0 108.801 178.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.514 ' HG3' ' N ' ' A' ' 5' ' ' TRP . 0.4 OUTLIER -41.0 -25.74 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.467 -0.771 . . . . 0.0 110.402 179.724 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.514 ' N ' ' HG3' ' A' ' 4' ' ' GLN . 1.1 t90 -37.92 -69.28 0.12 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.221 -0.924 . . . . 0.0 111.323 -179.566 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.512 ' C ' ' O ' ' A' ' 5' ' ' TRP . 30.4 tp -27.7 -43.76 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.005 0 CA-C-O 121.14 0.495 . . . . 0.0 110.939 -178.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.527 HD23 ' CG2' ' A' ' 41' ' ' VAL . 0.3 OUTLIER 75.9 -157.98 0.04 OUTLIER 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.257 -0.902 . . . . 0.0 109.358 179.761 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.521 ' CB ' ' O ' ' A' ' 7' ' ' LEU . 0.1 OUTLIER 76.57 -2.94 2.62 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.201 -0.937 . . . . 0.0 109.428 -179.711 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.416 ' CG ' ' N ' ' A' ' 10' ' ' ALA . 6.1 p30 -73.6 -47.15 42.52 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.211 -0.931 . . . . 0.0 108.662 179.392 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.486 ' HB2' ' CG1' ' A' ' 41' ' ' VAL . . . -80.99 -4.51 55.34 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.322 -0.861 . . . . 0.0 109.014 179.199 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.415 ' O ' HG13 ' A' ' 15' ' ' ILE . 0.1 OUTLIER -50.43 -75.99 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.363 -0.836 . . . . 0.0 110.201 -179.572 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.435 ' O ' ' HB1' ' A' ' 16' ' ' ALA . 26.0 tt0 -76.92 -18.42 58.3 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.144 -0.972 . . . . 0.0 110.369 -179.2 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.6 -18.28 62.23 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.947 -1.096 . . . . 0.0 109.441 -179.767 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.495 ' O ' HD21 ' A' ' 18' ' ' LEU . . . -106.75 -38.79 6.0 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 179.58 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.533 HG12 ' CD1' ' A' ' 29' ' ' PHE . 35.8 mt -61.9 -28.36 44.14 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 CA-C-O 121.752 0.787 . . . . 0.0 109.263 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.435 ' HB1' ' O ' ' A' ' 12' ' ' GLU . . . -66.06 -3.06 4.75 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.651 -0.655 . . . . 0.0 110.941 -178.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.526 ' CG ' ' O ' ' A' ' 17' ' ' GLU . 17.0 tt0 -117.56 1.94 12.32 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 120.847 -1.158 . . . . 0.0 109.933 -179.531 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.499 ' HG ' ' HE3' ' A' ' 45' ' ' LYS . 3.7 mm? -100.44 -39.68 7.84 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.001 -1.062 . . . . 0.0 110.511 -179.47 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.63 -19.71 64.06 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.018 -1.051 . . . . 0.0 109.942 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.473 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -96.94 -14.8 21.49 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.144 -0.972 . . . . 0.0 109.381 179.892 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -79.81 -39.33 31.02 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.156 -0.965 . . . . 0.0 109.587 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 125.25 14.07 3.39 Favored Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.954 -1.259 . . . . 0.0 109.954 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.471 HD12 HG23 ' A' ' 48' ' ' ILE . 34.1 mt -105.03 117.99 51.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.078 -1.248 . . . . 0.0 109.257 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.2 p -113.44 -4.74 13.55 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.233 -0.917 . . . . 0.0 109.938 -179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -45.97 133.58 8.66 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.101 -0.999 . . . . 0.0 109.149 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.467 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 7.4 p-10 -88.47 -2.84 58.82 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.282 -0.886 . . . . 0.0 109.732 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.472 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 26.1 t80 -76.21 -13.94 60.16 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.166 -0.959 . . . . 0.0 109.243 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.594 ' CG ' HG12 ' A' ' 48' ' ' ILE . 22.3 m-85 -100.6 -45.21 5.59 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.428 -0.795 . . . . 0.0 108.973 179.734 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.533 ' CD1' HG12 ' A' ' 15' ' ' ILE . 5.5 m-85 -66.84 -44.62 80.58 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.473 -0.767 . . . . 0.0 109.559 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.467 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 14.4 m120 -68.74 -24.66 64.48 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.322 -0.861 . . . . 0.0 110.055 -179.799 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.428 ' HB1' ' O ' ' A' ' 27' ' ' PHE . . . -92.49 -17.27 24.74 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.123 -0.986 . . . . 0.0 110.565 -178.828 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.452 HD12 ' HG2' ' A' ' 45' ' ' LYS . 0.6 OUTLIER -53.69 -39.05 36.81 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 120.981 -1.074 . . . . 0.0 109.242 -179.853 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -71.17 -38.82 72.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.184 -0.947 . . . . 0.0 109.442 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.418 ' O ' ' C ' ' A' ' 35' ' ' ALA . 16.7 mmtt -52.7 -25.65 11.62 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.287 -0.883 . . . . 0.0 109.408 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.471 ' HB2' ' HB3' ' A' ' 40' ' ' GLU . . . -41.69 137.12 1.73 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.457 -0.777 . . . . 0.0 109.764 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.486 ' O ' ' CD1' ' A' ' 7' ' ' LEU . 6.5 mtpt -75.85 -64.85 0.99 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.213 -0.93 . . . . 0.0 109.275 179.792 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.457 HG21 ' OE1' ' A' ' 40' ' ' GLU . 9.0 t -109.71 -178.4 3.53 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.213 -0.929 . . . . 0.0 108.901 179.541 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 12.1 t -61.25 -46.33 96.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 O-C-N 120.896 -1.127 . . . . 0.0 108.942 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.539 ' O ' ' CB ' ' A' ' 43' ' ' ALA . 5.8 mt-10 -53.34 -25.72 16.26 Favored 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 179.07 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.492 ' OE1' ' N ' ' A' ' 40' ' ' GLU . 0.8 OUTLIER -79.68 -37.14 36.48 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 179.071 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.527 ' CG2' HD23 ' A' ' 7' ' ' LEU . 38.4 t -65.53 -66.12 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.434 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 28.2 m-80 -55.68 -29.41 59.32 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.48 -0.762 . . . . 0.0 109.579 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.539 ' CB ' ' O ' ' A' ' 39' ' ' GLU . . . -67.52 -39.87 85.1 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.216 -0.927 . . . . 0.0 109.622 -179.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.45 ' CB ' HD13 ' A' ' 32' ' ' ILE . 3.6 mt -61.39 -45.51 94.06 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.207 -0.933 . . . . 0.0 109.791 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.499 ' HE3' ' HG ' ' A' ' 18' ' ' LEU . 14.1 mmtm -63.14 -25.86 68.55 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.125 -0.984 . . . . 0.0 109.319 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -80.43 -19.83 45.27 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.283 -0.886 . . . . 0.0 109.743 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.471 ' O ' ' HB1' ' A' ' 51' ' ' ALA . 6.8 tt0 -79.51 -16.57 55.79 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.158 -0.964 . . . . 0.0 109.744 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.594 HG12 ' CG ' ' A' ' 28' ' ' TYR . 64.0 mt -71.46 -42.05 73.01 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 O-C-N 120.877 -1.139 . . . . 0.0 108.548 179.525 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 87.4 mt -51.89 -26.41 10.13 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.417 -0.802 . . . . 0.0 109.338 179.442 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.42 ' O ' ' N ' ' A' ' 52' ' ' HIS . 0.1 OUTLIER -112.31 -71.15 0.77 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.186 -0.946 . . . . 0.0 109.965 -179.89 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.471 ' HB1' ' O ' ' A' ' 47' ' ' GLU . . . -43.58 -25.44 0.16 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.311 -0.868 . . . . 0.0 109.844 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.599 ' CD2' ' HB1' ' A' ' 53' ' ' ALA . 0.0 OUTLIER -130.32 152.04 50.17 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 121.22 -0.925 . . . . 0.0 108.707 -179.644 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.599 ' HB1' ' CD2' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 118.009 -0.996 . . . . 0.0 109.247 -179.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 121.234 0.54 . . . . 0.0 109.555 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.652 ' CG2' ' CZ2' ' A' ' 5' ' ' TRP . 14.7 mm 47.01 60.35 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.28 -0.887 . . . . 0.0 109.574 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -96.78 24.98 5.57 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 178.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -76.05 -50.21 15.39 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.718 -0.614 . . . . 0.0 110.573 -178.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.652 ' CZ2' ' CG2' ' A' ' 2' ' ' ILE . 4.2 p-90 -105.77 -49.55 3.38 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.16 -0.963 . . . . 0.0 111.08 -178.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.602 ' O ' ' CB ' ' A' ' 7' ' ' LEU . 0.5 OUTLIER 38.99 29.7 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.559 -0.713 . . . . 0.0 109.504 -178.773 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.602 ' CB ' ' O ' ' A' ' 6' ' ' LEU . 11.6 tp 96.41 38.21 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 -179.271 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.422 ' N ' ' O ' ' A' ' 5' ' ' TRP . 9.7 mtmt -136.71 63.59 1.57 Allowed 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 179.629 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.477 ' OD1' HG23 ' A' ' 38' ' ' VAL . 0.5 OUTLIER -142.4 -48.71 0.35 Allowed 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.464 -0.773 . . . . 0.0 109.137 -179.384 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.481 ' O ' ' HB1' ' A' ' 14' ' ' ALA . . . -80.95 -18.97 45.25 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 121.291 -0.88 . . . . 0.0 108.863 179.545 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.543 ' O ' ' CG1' ' A' ' 15' ' ' ILE . 4.7 ptmt -74.88 -14.8 60.71 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.354 -0.842 . . . . 0.0 109.615 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -100.97 -37.84 8.46 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.055 -1.028 . . . . 0.0 109.513 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -74.85 -26.53 59.76 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.247 -0.908 . . . . 0.0 109.684 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.485 ' O ' HD22 ' A' ' 18' ' ' LEU . . . -92.97 -42.58 9.38 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.089 -1.007 . . . . 0.0 109.626 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.575 HG22 ' CE1' ' A' ' 29' ' ' PHE . 20.4 mt -63.28 -31.0 51.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 CA-C-O 121.776 0.798 . . . . 0.0 108.999 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.47 ' HA ' ' HD2' ' A' ' 19' ' ' LYS . . . -67.24 -7.0 20.64 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.641 -0.662 . . . . 0.0 110.132 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.457 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 9.4 tp10 -109.27 -5.97 15.69 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.231 -0.918 . . . . 0.0 109.522 -179.745 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.523 ' N ' HD21 ' A' ' 18' ' ' LEU . 4.0 mm? -93.49 -41.01 10.02 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.113 -0.992 . . . . 0.0 109.031 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.486 ' HG2' ' N ' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -56.42 -23.31 37.59 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.504 -0.747 . . . . 0.0 109.524 -179.942 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.486 ' N ' ' HG2' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -97.64 -20.09 17.87 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.293 -0.879 . . . . 0.0 109.142 179.551 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -75.41 -28.67 59.51 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.259 -0.901 . . . . 0.0 109.575 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 128.36 -45.86 1.12 Allowed Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.26 -1.536 . . . . 0.0 109.26 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.524 HD12 ' NE2' ' A' ' 52' ' ' HIS . 5.5 mt -45.24 122.83 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.205 -1.173 . . . . 0.0 109.008 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -128.93 10.51 5.95 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.162 -0.961 . . . . 0.0 109.842 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.7 t -66.09 156.41 33.96 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.197 -0.939 . . . . 0.0 109.198 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.473 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 2.7 t70 -103.38 -4.11 24.58 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.103 -0.998 . . . . 0.0 109.825 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.472 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 5.9 t80 -77.57 -18.07 57.27 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.11 -0.993 . . . . 0.0 109.232 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.647 ' CG ' ' CG1' ' A' ' 48' ' ' ILE . 22.5 m-85 -95.46 -41.12 9.13 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.263 -0.898 . . . . 0.0 108.926 179.558 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.575 ' CE1' HG22 ' A' ' 15' ' ' ILE . 9.6 m-30 -71.03 -49.88 40.08 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.434 -0.791 . . . . 0.0 109.465 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.473 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 3.5 t-20 -59.12 -52.37 66.03 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.24 -0.912 . . . . 0.0 109.671 -179.746 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.16 -22.07 65.58 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.27 -0.894 . . . . 0.0 109.645 -179.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.455 ' HB ' ' O ' ' A' ' 29' ' ' PHE . 1.4 mm -67.64 -53.94 27.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.205 -0.935 . . . . 0.0 109.399 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.51 ' CB ' ' HD2' ' A' ' 11' ' ' LYS . 1.6 p-10 -73.53 -1.96 20.74 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.149 -0.969 . . . . 0.0 109.461 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.483 ' O ' ' O ' ' A' ' 35' ' ' ALA . 7.2 mttt -105.3 -8.86 17.99 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.27 -0.894 . . . . 0.0 109.817 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.509 ' O ' ' CD2' ' A' ' 7' ' ' LEU . . . -55.2 -158.89 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.531 -0.731 . . . . 0.0 110.088 -179.712 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.7 mttt -110.02 -67.47 0.99 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.128 -0.983 . . . . 0.0 110.087 -179.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.482 ' O ' HG21 ' A' ' 41' ' ' VAL . 0.7 OUTLIER -118.79 -168.5 1.56 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.979 -1.075 . . . . 0.0 109.645 -179.565 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.477 HG23 ' OD1' ' A' ' 9' ' ' ASN . 65.3 t -70.41 -31.6 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.201 -0.937 . . . . 0.0 109.931 -179.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.484 ' OE2' ' N ' ' A' ' 39' ' ' GLU . 1.7 mm-40 -71.01 -26.75 63.26 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 120.945 -1.097 . . . . 0.0 108.139 179.319 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.443 ' HB3' ' HB3' ' A' ' 35' ' ' ALA . 0.1 OUTLIER -84.51 -26.7 27.92 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 178.736 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.54 ' CG2' HD12 ' A' ' 7' ' ' LEU . 53.9 t -73.8 -70.04 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 178.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -50.14 -29.08 8.4 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 178.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.46 ' CB ' ' O ' ' A' ' 39' ' ' GLU . . . -64.48 -50.66 66.57 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.389 -0.819 . . . . 0.0 108.923 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.532 ' O ' ' CD1' ' A' ' 48' ' ' ILE . 5.9 mt -61.09 -46.58 90.05 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.314 -0.867 . . . . 0.0 109.922 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.468 ' HE3' HD22 ' A' ' 18' ' ' LEU . 0.2 OUTLIER -56.09 -40.9 74.37 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.118 -0.989 . . . . 0.0 109.805 -179.596 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.1 m-20 -76.43 -18.74 58.67 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.149 -0.97 . . . . 0.0 109.388 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.404 ' O ' ' CB ' ' A' ' 51' ' ' ALA . 8.6 tp10 -73.17 -19.89 61.02 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.259 -0.901 . . . . 0.0 109.407 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.647 ' CG1' ' CG ' ' A' ' 28' ' ' TYR . 2.9 mp -68.62 -27.76 37.47 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 179.075 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.46 ' HB2' ' HE2' ' A' ' 50' ' ' LYS . 2.3 mm? -58.24 -38.3 76.59 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.612 -0.68 . . . . 0.0 109.951 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.46 ' HE2' ' HB2' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -114.69 0.16 13.79 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.929 -1.107 . . . . 0.0 110.201 -179.432 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.404 ' CB ' ' O ' ' A' ' 47' ' ' GLU . . . -100.62 -12.17 19.43 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 121.182 -0.949 . . . . 0.0 109.172 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.641 ' CG ' ' N ' ' A' ' 53' ' ' ALA . 0.0 OUTLIER -154.47 -171.61 3.92 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.429 -0.794 . . . . 0.0 108.886 -179.723 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.641 ' N ' ' CG ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 117.945 -1.026 . . . . 0.0 109.585 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.648 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.54 ' O ' ' CZ2' ' A' ' 5' ' ' TRP . 0.2 OUTLIER -147.4 33.68 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.265 -0.897 . . . . 0.0 109.495 -179.763 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -90.09 37.64 0.9 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.141 -0.974 . . . . 0.0 108.466 179.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 42.7 tp60 -62.91 -23.34 67.31 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.7 -0.625 . . . . 0.0 110.319 -179.343 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.54 ' CZ2' ' O ' ' A' ' 2' ' ' ILE . 0.0 OUTLIER -104.32 -102.72 0.31 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.974 -1.079 . . . . 0.0 110.055 -179.553 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.531 ' O ' ' CB ' ' A' ' 7' ' ' LEU . 2.1 pt? -152.54 -19.06 0.17 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 120.715 -1.241 . . . . 0.0 111.446 -179.466 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.534 HD23 ' CG2' ' A' ' 41' ' ' VAL . 1.2 tp 83.17 -135.87 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.889 -1.132 . . . . 0.0 109.112 -179.396 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.484 ' HA ' ' HG3' ' A' ' 11' ' ' LYS . 29.2 mttt 64.49 6.42 3.12 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.026 -1.046 . . . . 0.0 109.878 -179.365 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -80.99 -45.57 16.4 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.024 -1.048 . . . . 0.0 108.501 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.53 ' CB ' HG13 ' A' ' 41' ' ' VAL . . . -80.44 0.11 34.85 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.487 -0.758 . . . . 0.0 109.255 179.397 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.484 ' HG3' ' HA ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -51.31 -88.38 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.961 -1.087 . . . . 0.0 109.49 -179.686 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -67.08 -10.73 53.08 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.064 -1.022 . . . . 0.0 109.907 -179.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.56 -72.31 0.19 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.083 -1.011 . . . . 0.0 109.259 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.488 ' O ' HD21 ' A' ' 18' ' ' LEU . . . -64.16 -35.72 81.72 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.409 -0.807 . . . . 0.0 109.858 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.566 HG21 ' CE1' ' A' ' 29' ' ' PHE . 33.8 mt -61.2 -28.55 44.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 CA-C-O 121.774 0.797 . . . . 0.0 109.389 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.77 -4.15 8.41 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.823 -0.548 . . . . 0.0 110.893 -178.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.483 ' CG ' ' O ' ' A' ' 17' ' ' GLU . 12.1 tt0 -116.12 -2.8 12.14 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 120.938 -1.101 . . . . 0.0 109.874 -179.609 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.581 ' N ' ' CD2' ' A' ' 18' ' ' LEU . 3.6 mm? -99.59 -40.14 7.95 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.945 -1.097 . . . . 0.0 109.707 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.8 ttpp -53.76 -23.81 13.07 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.225 -0.922 . . . . 0.0 109.601 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.77 -22.39 16.43 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.224 -0.922 . . . . 0.0 109.712 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.02 -7.41 28.88 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.179 -0.951 . . . . 0.0 109.534 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.72 -9.3 58.52 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.256 -1.537 . . . . 0.0 109.256 -179.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.507 HD13 ' CG2' ' A' ' 48' ' ' ILE . 4.9 mm -69.15 149.05 11.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.302 -1.117 . . . . 0.0 109.583 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.4 p -155.88 20.13 0.38 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.315 -0.866 . . . . 0.0 109.346 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.0 m -80.17 142.17 34.99 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.361 -0.837 . . . . 0.0 109.428 179.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.471 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 1.8 p30 -88.96 -11.77 43.46 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.309 -0.869 . . . . 0.0 109.561 -179.748 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.511 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 5.8 t80 -75.7 -12.56 60.22 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.208 -0.933 . . . . 0.0 109.121 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.64 ' CG ' ' CG1' ' A' ' 48' ' ' ILE . 24.0 m-85 -100.77 -43.2 6.19 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.33 -0.857 . . . . 0.0 109.204 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.566 ' CE1' HG21 ' A' ' 15' ' ' ILE . 5.2 m-85 -71.87 -45.17 62.27 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.503 -0.748 . . . . 0.0 109.765 -179.849 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.471 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 0.1 OUTLIER -65.27 -33.57 76.3 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.117 -0.989 . . . . 0.0 109.141 179.96 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -75.32 -11.72 60.12 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.38 -0.825 . . . . 0.0 109.184 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.499 ' CD1' ' HD2' ' A' ' 45' ' ' LYS . 4.3 mm -74.4 -25.2 19.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.343 -0.848 . . . . 0.0 109.367 179.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.484 ' ND2' ' HE2' ' A' ' 8' ' ' LYS . 4.8 t-20 -80.32 -31.19 38.16 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.185 -0.947 . . . . 0.0 109.252 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.466 ' O ' ' C ' ' A' ' 35' ' ' ALA . 15.6 mtpp -77.12 -17.2 58.82 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.22 -0.925 . . . . 0.0 109.57 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.48 ' HB2' HG21 ' A' ' 41' ' ' VAL . . . -36.97 155.17 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 121.513 0.673 . . . . 0.0 110.497 -179.332 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.463 ' O ' HD12 ' A' ' 7' ' ' LEU . 2.8 mmtm -95.6 -66.63 0.9 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.433 -0.792 . . . . 0.0 109.682 -179.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.51 ' CG2' HG21 ' A' ' 2' ' ' ILE . 38.2 p -116.44 178.22 4.41 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.149 -0.969 . . . . 0.0 109.198 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 26.3 t -63.29 -42.96 98.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.192 -0.942 . . . . 0.0 109.46 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.484 ' O ' ' CB ' ' A' ' 43' ' ' ALA . 4.4 mm-40 -62.51 -23.07 66.75 Favored 'General case' 0 C--N 1.298 -1.661 0 O-C-N 121.219 -0.926 . . . . 0.0 109.035 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.407 ' HB2' ' H ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -85.71 -30.24 23.3 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.32 -0.862 . . . . 0.0 108.992 179.651 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.534 ' CG2' HD23 ' A' ' 7' ' ' LEU . 12.8 t -71.78 -61.58 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.434 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 179.005 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -57.72 -33.14 68.11 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.727 -0.608 . . . . 0.0 109.448 179.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.484 ' CB ' ' O ' ' A' ' 39' ' ' GLU . . . -69.9 -31.74 69.69 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.323 -0.861 . . . . 0.0 109.753 -179.692 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.543 ' O ' ' CD1' ' A' ' 48' ' ' ILE . 0.2 OUTLIER -78.46 -24.75 45.87 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 121.105 -0.997 . . . . 0.0 109.346 -179.828 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.499 ' HD2' ' CD1' ' A' ' 32' ' ' ILE . 0.2 OUTLIER -80.5 -30.8 37.29 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.115 -0.991 . . . . 0.0 110.242 -179.314 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -79.87 -15.9 56.45 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 120.992 -1.067 . . . . 0.0 109.982 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.491 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 5.8 pt-20 -82.83 -6.98 59.68 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.058 -1.026 . . . . 0.0 109.521 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.64 ' CG1' ' CG ' ' A' ' 28' ' ' TYR . 1.6 mp -71.74 -48.42 51.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.473 0 N-CA-C 107.81 -1.182 . . . . 0.0 107.81 178.531 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.437 ' O ' ' C ' ' A' ' 53' ' ' ALA . 1.2 tp -50.2 -20.74 1.1 Allowed 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.297 -0.877 . . . . 0.0 109.793 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.421 ' O ' ' N ' ' A' ' 52' ' ' HIS . 0.0 OUTLIER -105.84 -74.49 0.65 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.991 -1.068 . . . . 0.0 109.877 -179.704 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -43.75 -22.62 0.05 Allowed 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.526 -0.734 . . . . 0.0 111.081 -179.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.583 ' CD2' HG21 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -126.91 -8.48 6.05 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.935 -1.103 . . . . 0.0 110.578 -178.397 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.437 ' C ' ' O ' ' A' ' 49' ' ' LEU . . . . . . . . 0 N--CA 1.491 1.587 0 O-C-N 120.943 -1.098 . . . . 0.0 109.643 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 1.5 p . . . . . 0 N--CA 1.489 1.512 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.543 ' CG1' ' O ' ' A' ' 2' ' ' ILE . 1.9 tt -169.88 41.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.136 -0.977 . . . . 0.0 109.479 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -49.3 -22.99 1.21 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.075 -1.015 . . . . 0.0 108.711 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.439 ' O ' ' O ' ' A' ' 5' ' ' TRP . 0.0 OUTLIER -64.44 -67.92 0.4 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.509 -0.744 . . . . 0.0 109.13 179.497 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.439 ' O ' ' O ' ' A' ' 4' ' ' GLN . 0.6 OUTLIER 59.75 128.75 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.343 0 CA-C-O 122.415 1.102 . . . . 0.0 110.862 179.557 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.557 ' O ' ' CB ' ' A' ' 7' ' ' LEU . 0.5 OUTLIER -164.75 14.31 0.05 OUTLIER 'General case' 0 C--N 1.289 -2.024 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.636 -179.735 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.557 ' CB ' ' O ' ' A' ' 6' ' ' LEU . 10.1 tp 83.89 -145.46 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.384 -0.823 . . . . 0.0 109.645 179.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.478 ' HD2' HD11 ' A' ' 6' ' ' LEU . 45.3 mttp 56.74 34.18 24.19 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 120.961 -1.087 . . . . 0.0 108.915 -178.798 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -131.18 -50.1 1.01 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.346 -0.846 . . . . 0.0 109.481 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -81.03 -13.55 58.72 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.096 -1.003 . . . . 0.0 109.194 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.492 ' HA ' ' CG2' ' A' ' 32' ' ' ILE . 0.0 OUTLIER -53.73 -92.26 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.365 -0.834 . . . . 0.0 110.163 -179.289 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.508 ' HA ' ' HB ' ' A' ' 15' ' ' ILE . 26.0 mt-10 -47.04 -23.57 0.5 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.294 -0.879 . . . . 0.0 110.342 -179.109 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -56.35 -52.1 65.83 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.17 -0.956 . . . . 0.0 108.958 179.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.528 ' O ' ' CD1' ' A' ' 18' ' ' LEU . . . -78.14 -47.92 17.1 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.281 -0.887 . . . . 0.0 109.238 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.556 ' HA ' ' CD2' ' A' ' 18' ' ' LEU . 55.0 mt -46.34 -30.15 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 O-C-N 121.324 -0.86 . . . . 0.0 109.481 -179.801 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.4 -47.25 70.84 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 11.4 mt-10 -79.32 4.75 14.29 Favored 'General case' 0 C--N 1.296 -1.755 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.271 178.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.651 ' HB3' ' CE2' ' A' ' 29' ' ' PHE . 5.2 mp -91.57 -46.78 7.77 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.181 -0.95 . . . . 0.0 110.197 -178.191 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.8 ttpt -58.77 -27.62 65.16 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.054 -1.029 . . . . 0.0 109.179 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.0 tttt -95.01 -14.49 24.29 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.398 -0.813 . . . . 0.0 109.116 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.58 -54.73 31.47 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.312 -0.868 . . . . 0.0 109.627 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 151.01 -14.16 0.86 Allowed Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.924 -1.271 . . . . 0.0 109.924 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.2 mt -103.65 161.24 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 120.988 -1.301 . . . . 0.0 109.482 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.4 p -147.81 15.97 1.09 Allowed 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 179.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.72 174.03 0.07 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.366 -0.834 . . . . 0.0 109.429 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.504 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 1.1 m-20 -112.13 -16.02 13.12 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.346 -0.846 . . . . 0.0 109.353 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.556 ' CD1' ' O ' ' A' ' 27' ' ' PHE . 2.8 t80 -81.27 -20.78 40.17 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 120.869 -1.144 . . . . 0.0 108.864 179.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.609 ' CE2' HG21 ' A' ' 48' ' ' ILE . 18.8 m-30 -93.16 -4.75 51.58 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.372 -0.83 . . . . 0.0 109.351 179.482 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.651 ' CE2' ' HB3' ' A' ' 18' ' ' LEU . 23.5 m-85 -115.71 -55.64 2.41 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.475 -0.765 . . . . 0.0 109.57 -179.553 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.504 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 1.0 OUTLIER -64.12 -36.34 83.7 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.548 -0.72 . . . . 0.0 109.749 179.74 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.45 ' O ' ' HB2' ' A' ' 34' ' ' LYS . . . -80.88 -0.11 37.63 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.256 -0.903 . . . . 0.0 109.354 -179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.5 HG21 HD11 ' A' ' 32' ' ' ILE . 15.6 mm -62.41 -55.55 23.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.445 -0.784 . . . . 0.0 109.606 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.5 p30 -64.26 -23.41 67.29 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.257 -0.902 . . . . 0.0 109.269 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.45 ' HB2' ' O ' ' A' ' 31' ' ' ALA . 0.4 OUTLIER -61.63 -28.28 69.26 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.165 -0.959 . . . . 0.0 109.191 179.615 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.419 ' C ' ' O ' ' A' ' 34' ' ' LYS . . . -41.54 159.04 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.424 -0.798 . . . . 0.0 109.917 -179.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 9.8 mtpt -92.04 -61.84 1.54 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.433 -0.792 . . . . 0.0 109.413 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.479 ' C ' ' CD1' ' A' ' 7' ' ' LEU . 0.4 OUTLIER -117.06 178.47 4.34 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.575 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.469 ' N ' ' OG1' ' A' ' 37' ' ' THR . 96.4 t -56.78 -52.98 47.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.094 -1.004 . . . . 0.0 109.143 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.543 ' O ' ' CB ' ' A' ' 43' ' ' ALA . 10.6 pt-20 -48.42 -27.98 2.97 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.352 -0.843 . . . . 0.0 108.934 179.521 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.428 ' HB2' ' O ' ' A' ' 37' ' ' THR . 19.7 mm-40 -79.1 -39.17 34.41 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.329 -0.857 . . . . 0.0 108.852 179.582 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.457 ' CG2' HD12 ' A' ' 7' ' ' LEU . 21.6 t -64.27 -64.62 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 178.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -55.16 -36.19 65.57 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.432 -0.793 . . . . 0.0 109.204 179.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.543 ' CB ' ' O ' ' A' ' 39' ' ' GLU . . . -59.03 -39.73 82.83 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.381 -0.824 . . . . 0.0 109.08 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.427 ' HB2' ' O ' ' A' ' 41' ' ' VAL . 8.5 mt -53.07 -44.55 67.57 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.337 -0.852 . . . . 0.0 109.831 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.568 ' CE ' ' HG ' ' A' ' 18' ' ' LEU . 4.7 tptp -62.74 -45.34 93.17 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.043 -1.036 . . . . 0.0 109.752 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.448 ' OD1' ' HA ' ' A' ' 43' ' ' ALA . 1.9 m120 -66.49 -19.96 65.92 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.421 -0.799 . . . . 0.0 109.755 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.522 ' O ' ' CB ' ' A' ' 51' ' ' ALA . 0.0 OUTLIER -86.67 11.93 11.81 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.163 -0.961 . . . . 0.0 109.326 179.797 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.618 HG21 ' CG ' ' A' ' 52' ' ' HIS . 11.8 mm -96.55 -51.99 9.88 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.566 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 178.532 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 7.8 mt -52.96 -22.97 6.29 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 121.357 -0.839 . . . . 0.0 108.883 178.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.4 mmpt? -107.68 -45.83 3.94 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.132 -0.98 . . . . 0.0 109.532 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.522 ' CB ' ' O ' ' A' ' 47' ' ' GLU . . . -92.02 44.22 1.16 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.223 -0.923 . . . . 0.0 109.429 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.618 ' CG ' HG21 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -178.2 -27.86 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.191 -0.943 . . . . 0.0 109.979 179.865 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.523 ' N ' ' CD2' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.49 1.569 0 O-C-N 120.999 -1.063 . . . . 0.0 109.505 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 1.3 pt -114.17 60.34 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.177 -0.952 . . . . 0.0 109.817 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.63 -10.93 30.09 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.222 -0.924 . . . . 0.0 109.134 179.433 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.12 -52.95 48.34 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.382 -0.823 . . . . 0.0 110.275 -179.551 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.569 ' O ' ' CB ' ' A' ' 6' ' ' LEU . 20.5 p-90 -129.09 -138.26 0.23 Allowed 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.098 -1.001 . . . . 0.0 109.348 -179.164 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.595 ' O ' ' N ' ' A' ' 8' ' ' LYS . 1.3 tp 93.46 -4.54 0.13 Allowed 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.548 ' O ' ' N ' ' A' ' 9' ' ' ASN . 0.1 OUTLIER 40.05 -80.1 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.094 0 O-C-N 122.047 -0.408 . . . . 0.0 112.099 178.884 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.595 ' N ' ' O ' ' A' ' 6' ' ' LEU . 2.9 mtpt -35.91 -28.43 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.108 -0.995 . . . . 0.0 110.963 -179.008 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.548 ' N ' ' O ' ' A' ' 7' ' ' LEU . 2.4 p30 -47.12 -50.55 19.98 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.02 -1.05 . . . . 0.0 110.257 -179.761 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.485 ' O ' ' C ' ' A' ' 11' ' ' LYS . . . -80.83 -31.64 35.46 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.878 -1.139 . . . . 0.0 110.115 -179.571 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.546 ' O ' ' CG1' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -33.29 -55.88 0.41 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.533 -0.73 . . . . 0.0 111.609 -179.138 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -74.67 -50.97 15.67 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 120.868 -1.145 . . . . 0.0 111.893 -177.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -47.76 -56.97 6.18 Favored 'General case' 0 C--N 1.299 -1.626 0 O-C-N 120.555 -1.341 . . . . 0.0 110.142 -178.794 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.448 ' HB2' ' HE3' ' A' ' 45' ' ' LYS . . . -69.62 -58.28 4.13 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.147 -0.971 . . . . 0.0 110.621 -179.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.611 HG12 ' CD1' ' A' ' 29' ' ' PHE . 65.5 mt -42.02 -30.64 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.041 -1.037 . . . . 0.0 109.607 -179.448 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.7 -51.56 40.34 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.419 -0.801 . . . . 0.0 109.438 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.44 ' O ' ' CG ' ' A' ' 17' ' ' GLU . 19.9 tt0 -70.24 -5.52 28.2 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.393 -0.817 . . . . 0.0 109.405 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.554 ' HB2' ' CE ' ' A' ' 45' ' ' LYS . 1.3 tm? -93.68 -39.8 10.59 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.39 -0.819 . . . . 0.0 109.751 -179.56 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.449 ' HG3' ' O ' ' A' ' 19' ' ' LYS . 0.4 OUTLIER -67.59 -23.07 65.34 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.298 -0.877 . . . . 0.0 109.733 -179.463 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.19 -26.07 16.13 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.142 -0.974 . . . . 0.0 109.381 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.26 -37.2 54.71 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.271 -0.893 . . . . 0.0 109.297 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 130.2 11.11 2.59 Favored Glycine 0 N--CA 1.491 2.305 0 C-N-CA 119.939 -1.124 . . . . 0.0 110.393 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.645 ' CG2' ' CE1' ' A' ' 52' ' ' HIS . 0.0 OUTLIER -127.18 154.71 37.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 120.928 -1.337 . . . . 0.0 109.708 179.813 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.413 HG21 ' HD3' ' A' ' 19' ' ' LYS . 18.0 p -140.42 19.63 2.39 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.381 -0.824 . . . . 0.0 109.021 179.663 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.1 t -58.01 124.28 18.78 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.377 -0.827 . . . . 0.0 109.717 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -80.06 -1.87 41.85 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.239 -0.913 . . . . 0.0 109.405 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -73.69 -33.61 64.49 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.37 -0.831 . . . . 0.0 109.275 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.596 ' CE2' HG21 ' A' ' 48' ' ' ILE . 21.9 m-85 -80.59 -44.98 18.09 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.328 -0.857 . . . . 0.0 109.414 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.611 ' CD1' HG12 ' A' ' 15' ' ' ILE . 18.3 m-30 -62.8 -53.34 55.8 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.315 -0.866 . . . . 0.0 109.859 -179.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.428 ' O ' ' OD1' ' A' ' 33' ' ' ASN . 12.0 t-20 -54.54 -41.83 70.2 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.153 -0.967 . . . . 0.0 109.044 179.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.73 -25.22 63.74 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.498 -0.751 . . . . 0.0 109.451 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.484 ' CG2' ' HG2' ' A' ' 11' ' ' LYS . 5.3 mt -64.43 -46.2 93.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.268 -0.895 . . . . 0.0 109.344 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.428 ' OD1' ' O ' ' A' ' 30' ' ' ASN . 1.2 p-10 -71.87 -10.47 59.81 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.03 -1.044 . . . . 0.0 109.066 179.71 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.405 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -96.97 -20.7 17.9 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.294 -0.879 . . . . 0.0 109.363 179.938 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.466 ' CB ' ' HB3' ' A' ' 40' ' ' GLU . . . -46.75 169.66 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.28 -0.887 . . . . 0.0 109.458 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.7 mtmt -84.82 -58.91 2.52 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.218 -0.926 . . . . 0.0 109.281 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 15.1 t -131.2 -174.16 3.31 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.254 -0.904 . . . . 0.0 109.297 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 54.9 t -60.71 -39.99 83.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.064 -1.022 . . . . 0.0 109.256 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.47 ' O ' ' CB ' ' A' ' 43' ' ' ALA . 3.5 mt-10 -56.2 -28.76 59.46 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 179.159 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.466 ' HB3' ' CB ' ' A' ' 35' ' ' ALA . 0.4 OUTLIER -79.62 -31.41 41.64 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 179.037 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.454 HG23 HD13 ' A' ' 7' ' ' LEU . 16.3 t -66.73 -68.05 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 178.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 45.7 m-20 -53.16 -33.92 54.63 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.616 -0.678 . . . . 0.0 109.635 179.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.47 ' CB ' ' O ' ' A' ' 39' ' ' GLU . . . -67.39 -34.95 78.33 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.339 -0.851 . . . . 0.0 110.31 -179.267 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 12.4 mt -76.95 -38.81 52.59 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.029 -1.044 . . . . 0.0 110.065 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.554 ' CE ' ' HB2' ' A' ' 18' ' ' LEU . 0.0 OUTLIER -61.28 -29.57 69.94 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.169 -0.957 . . . . 0.0 109.943 -179.521 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 24.1 m-20 -71.24 -25.56 62.53 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.188 -0.945 . . . . 0.0 109.287 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.511 ' O ' ' CB ' ' A' ' 51' ' ' ALA . 2.8 tt0 -83.43 9.04 12.03 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.233 -0.917 . . . . 0.0 109.04 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.596 HG21 ' CE2' ' A' ' 28' ' ' TYR . 43.9 mt -88.34 -43.18 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 179.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -69.94 -10.93 60.29 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.594 -0.692 . . . . 0.0 110.401 -179.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -120.38 -31.55 4.32 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.695 -1.253 . . . . 0.0 110.835 -179.253 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.511 ' CB ' ' O ' ' A' ' 47' ' ' GLU . . . -79.56 -20.07 47.91 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.881 -1.137 . . . . 0.0 110.617 -179.058 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.645 ' CE1' ' CG2' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -125.83 -16.79 5.58 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.955 -1.091 . . . . 0.0 109.9 -179.474 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.533 0 O-C-N 121.037 -1.039 . . . . 0.0 109.371 179.595 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' THR . . . . . 0.441 ' O ' ' C ' ' A' ' 2' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.511 ' O ' ' CD1' ' A' ' 5' ' ' TRP . 1.0 OUTLIER 42.5 35.69 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.271 -0.893 . . . . 0.0 109.778 179.622 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -49.17 -18.52 0.34 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.232 -0.917 . . . . 0.0 109.833 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -74.99 13.9 0.6 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.269 -0.894 . . . . 0.0 111.338 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.531 ' CE3' ' N ' ' A' ' 6' ' ' LEU . 1.2 p-90 -57.06 -46.92 82.09 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.389 -1.444 . . . . 0.0 109.147 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.531 ' N ' ' CE3' ' A' ' 5' ' ' TRP . 68.9 mt 48.07 16.78 0.09 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.485 -0.76 . . . . 0.0 111.394 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.536 HD12 ' CG2' ' A' ' 41' ' ' VAL . 14.2 tp 60.86 6.51 1.21 Allowed 'General case' 0 N--CA 1.497 1.903 0 O-C-N 120.652 -1.28 . . . . 0.0 110.662 179.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.498 ' HG3' ' NZ ' ' A' ' 11' ' ' LYS . 5.9 mttm -102.98 84.45 2.37 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 120.765 -1.209 . . . . 0.0 108.912 179.591 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.552 ' ND2' ' N ' ' A' ' 9' ' ' ASN . 0.0 OUTLIER -151.57 -82.26 0.1 Allowed 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 -179.806 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.545 ' O ' ' CB ' ' A' ' 14' ' ' ALA . . . -70.68 -3.65 19.57 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.252 -0.905 . . . . 0.0 109.405 179.426 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.528 ' CD ' ' HA ' ' A' ' 33' ' ' ASN . 0.7 OUTLIER -54.47 -53.28 56.43 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.064 -1.022 . . . . 0.0 109.94 -179.823 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -88.83 -42.1 12.08 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.049 -1.032 . . . . 0.0 109.626 -179.648 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.91 -16.26 28.21 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.018 -1.051 . . . . 0.0 108.747 179.44 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.545 ' CB ' ' O ' ' A' ' 10' ' ' ALA . . . -102.99 -41.46 6.11 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.355 -0.84 . . . . 0.0 108.866 179.455 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.575 ' CG1' ' CD1' ' A' ' 32' ' ' ILE . 22.7 mt -52.88 -33.61 19.31 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 179.147 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.87 -38.88 79.99 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 179.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.534 ' CG ' ' O ' ' A' ' 17' ' ' GLU . 15.6 tt0 -90.22 4.22 51.22 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 179.228 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.538 HD21 ' CE ' ' A' ' 45' ' ' LYS . 20.1 mt -96.11 -55.33 3.0 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.262 -0.899 . . . . 0.0 108.725 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 25.5 ttpt -59.05 -40.9 86.54 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.81 -26.53 68.67 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.355 -0.841 . . . . 0.0 108.948 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -53.92 -39.34 65.75 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.328 -0.857 . . . . 0.0 109.141 179.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 134.8 -1.72 3.94 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.742 -1.343 . . . . 0.0 109.742 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.457 HD12 ' CG2' ' A' ' 48' ' ' ILE . 9.4 mt -106.74 158.99 6.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.096 -1.237 . . . . 0.0 109.63 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.4 HG21 ' O ' ' A' ' 23' ' ' ILE . 5.8 p -151.17 18.4 0.76 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.414 -0.804 . . . . 0.0 108.926 179.584 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -62.69 -177.44 0.15 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.395 -0.816 . . . . 0.0 109.447 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.467 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 3.4 t0 -116.18 -21.0 9.59 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.42 -0.8 . . . . 0.0 109.009 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.54 ' CD1' ' O ' ' A' ' 27' ' ' PHE . 5.7 t80 -81.04 -3.92 53.44 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 120.991 -1.068 . . . . 0.0 108.443 179.001 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.586 ' CG ' HG12 ' A' ' 48' ' ' ILE . 16.9 m-30 -109.42 -6.9 15.29 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.527 -0.733 . . . . 0.0 109.614 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.521 ' CE1' ' HB3' ' A' ' 18' ' ' LEU . 61.6 m-85 -119.38 -43.93 2.59 Favored 'General case' 0 C--N 1.298 -1.672 0 CA-C-O 121.728 0.775 . . . . 0.0 109.381 -178.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.467 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 0.8 OUTLIER -65.5 -21.06 66.58 Favored 'General case' 0 C--N 1.295 -1.765 0 O-C-N 121.738 -0.601 . . . . 0.0 109.38 179.301 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.28 -3.1 58.71 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.224 -0.922 . . . . 0.0 109.823 -179.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.575 ' CD1' ' CG1' ' A' ' 15' ' ' ILE . 18.1 mt -65.27 -61.6 1.62 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.394 -0.816 . . . . 0.0 109.759 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.528 ' HA ' ' CD ' ' A' ' 11' ' ' LYS . 0.4 OUTLIER -65.29 -9.46 24.42 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.196 -0.94 . . . . 0.0 109.807 -179.617 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.455 ' O ' ' O ' ' A' ' 35' ' ' ALA . 18.7 mmtm -93.62 -19.1 21.47 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.189 -0.945 . . . . 0.0 109.395 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.478 ' HB2' HD23 ' A' ' 7' ' ' LEU . . . -55.17 -164.52 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.413 -0.805 . . . . 0.0 109.72 -179.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.7 -63.89 1.37 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.191 -0.943 . . . . 0.0 109.715 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.426 ' O ' HG21 ' A' ' 41' ' ' VAL . 21.4 p -120.02 178.22 4.7 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.166 -0.958 . . . . 0.0 109.444 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.499 HG21 ' ND2' ' A' ' 9' ' ' ASN . 86.6 t -62.33 -43.45 98.11 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.334 -0.854 . . . . 0.0 109.157 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.438 ' O ' ' CB ' ' A' ' 43' ' ' ALA . 0.0 OUTLIER -57.08 -26.33 60.24 Favored 'General case' 0 C--N 1.297 -1.678 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 179.135 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.452 ' HB3' ' HB3' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -80.69 -33.98 34.99 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 178.896 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.536 ' CG2' HD12 ' A' ' 7' ' ' LEU . 14.6 t -65.27 -64.53 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 178.821 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 55.9 m-80 -56.34 -31.96 64.24 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.03 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.438 ' CB ' ' O ' ' A' ' 39' ' ' GLU . . . -59.5 -42.34 91.96 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.25 -0.906 . . . . 0.0 108.722 179.569 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.408 ' HB2' ' O ' ' A' ' 41' ' ' VAL . 2.3 mt -49.8 -54.57 18.37 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.407 -0.808 . . . . 0.0 109.89 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.538 ' CE ' HD21 ' A' ' 18' ' ' LEU . 17.1 tptp -49.61 -34.62 18.46 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.094 -1.004 . . . . 0.0 109.607 -179.599 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.472 ' HA ' HD22 ' A' ' 49' ' ' LEU . 2.8 m-20 -67.53 -48.77 66.03 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.26 -0.9 . . . . 0.0 109.428 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.416 ' O ' ' HB1' ' A' ' 51' ' ' ALA . 0.1 OUTLIER -74.27 -0.95 18.62 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.057 -1.027 . . . . 0.0 109.176 179.333 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.586 HG12 ' CG ' ' A' ' 28' ' ' TYR . 20.4 mt -87.63 -53.3 10.18 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 O-C-N 121.237 -0.914 . . . . 0.0 108.649 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.472 HD22 ' HA ' ' A' ' 46' ' ' ASN . 0.6 OUTLIER -67.03 -18.7 65.49 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.046 -1.033 . . . . 0.0 108.424 179.12 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.9 -41.23 11.91 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 179.246 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.416 ' HB1' ' O ' ' A' ' 47' ' ' GLU . . . -89.56 13.7 13.32 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.536 ' O ' ' CB ' ' A' ' 53' ' ' ALA . 0.0 OUTLIER -166.76 164.68 16.58 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 -179.731 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.536 ' CB ' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.493 1.687 0 CA-C-O 118.005 -0.998 . . . . 0.0 109.287 -179.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 1.6 m . . . . . 0 N--CA 1.49 1.555 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 1.8 mt -131.87 61.66 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.183 -0.948 . . . . 0.0 110.036 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -86.11 15.81 4.8 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.101 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.506 ' O ' ' O ' ' A' ' 5' ' ' TRP . 0.6 OUTLIER -99.75 14.42 30.29 Favored 'General case' 0 N--CA 1.483 1.215 0 O-C-N 121.623 -0.673 . . . . 0.0 109.892 -179.407 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.608 ' CE3' ' HG ' ' A' ' 6' ' ' LEU . 2.4 t90 -53.45 -107.3 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.32 -0.862 . . . . 0.0 109.626 -179.699 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.608 ' HG ' ' CE3' ' A' ' 5' ' ' TRP . 0.5 OUTLIER 158.94 19.11 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.194 0 O-C-N 120.813 -1.179 . . . . 0.0 112.336 178.982 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.547 ' C ' ' O ' ' A' ' 6' ' ' LEU . 0.6 OUTLIER 25.97 -134.77 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.339 -0.851 . . . . 0.0 110.92 178.893 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.522 ' N ' HD21 ' A' ' 7' ' ' LEU . 7.8 mttp 64.69 33.91 10.12 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.776 -1.203 . . . . 0.0 109.866 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.469 ' OD1' HG23 ' A' ' 38' ' ' VAL . 4.5 p30 -129.23 -48.98 1.19 Allowed 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 179.194 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.448 ' O ' ' C ' ' A' ' 11' ' ' LYS . . . -81.77 -7.16 59.57 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.308 -0.87 . . . . 0.0 109.115 178.915 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.526 ' O ' ' CD1' ' A' ' 15' ' ' ILE . 0.2 OUTLIER -37.89 -46.48 0.96 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.555 -0.716 . . . . 0.0 110.512 -179.503 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.465 ' O ' ' HB1' ' A' ' 16' ' ' ALA . 34.2 mm-40 -97.93 -22.18 16.46 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.005 -1.059 . . . . 0.0 110.455 -179.372 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -61.27 -41.93 97.77 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.069 -1.02 . . . . 0.0 110.483 -179.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.539 ' CB ' ' HA ' ' A' ' 42' ' ' ASN . . . -85.41 -40.31 16.59 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.03 -1.044 . . . . 0.0 109.893 -179.631 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.558 HG22 ' CE1' ' A' ' 29' ' ' PHE . 67.2 mt -61.08 -27.04 40.86 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.542 0 CA-C-O 121.566 0.698 . . . . 0.0 109.81 -179.592 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.465 ' HB1' ' O ' ' A' ' 12' ' ' GLU . . . -65.12 -7.1 10.87 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.643 -0.661 . . . . 0.0 110.743 -178.333 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.465 ' OE2' ' OD1' ' A' ' 46' ' ' ASN . 2.9 pt-20 -109.35 -8.55 15.05 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 121.022 -1.049 . . . . 0.0 109.51 -179.515 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.475 ' HB3' ' HE3' ' A' ' 45' ' ' LYS . 0.6 OUTLIER -100.65 -46.81 5.06 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.19 -0.943 . . . . 0.0 110.125 179.946 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 27.8 ttmt -52.75 -39.38 62.13 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.126 -0.984 . . . . 0.0 109.934 -179.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.403 ' HG3' ' N ' ' A' ' 21' ' ' ALA . 0.0 OUTLIER -66.61 -31.27 71.86 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.195 -0.94 . . . . 0.0 109.613 -179.759 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.403 ' N ' ' HG3' ' A' ' 20' ' ' LYS . . . -61.52 -49.07 78.19 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.19 -0.944 . . . . 0.0 109.239 179.705 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 135.46 -8.88 4.34 Favored Glycine 0 N--CA 1.489 2.193 0 N-CA-C 109.661 -1.376 . . . . 0.0 109.661 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.467 ' CD1' ' NE2' ' A' ' 52' ' ' HIS . 48.8 mt -75.08 122.98 29.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.213 -1.169 . . . . 0.0 109.499 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -117.86 19.08 13.88 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.388 -0.82 . . . . 0.0 109.43 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.48 121.58 15.22 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.292 -0.88 . . . . 0.0 109.52 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.409 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 0.3 OUTLIER -74.41 -1.68 22.08 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.238 -0.914 . . . . 0.0 109.598 179.87 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.69 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 4.5 t80 -76.64 -14.99 59.93 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.235 -0.915 . . . . 0.0 109.175 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.69 ' CE1' ' CE2' ' A' ' 27' ' ' PHE . 62.3 m-85 -104.27 -33.37 8.7 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.421 -0.799 . . . . 0.0 109.073 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.587 ' CE1' ' HE2' ' A' ' 45' ' ' LYS . 8.7 m-85 -71.44 -47.37 56.2 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.362 -0.836 . . . . 0.0 108.805 179.082 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.447 ' O ' ' HD2' ' A' ' 34' ' ' LYS . 0.1 OUTLIER -61.33 -29.77 70.1 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.374 -0.829 . . . . 0.0 109.561 179.821 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.6 -22.4 50.91 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.268 -0.895 . . . . 0.0 109.462 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.534 ' CD1' ' O ' ' A' ' 28' ' ' TYR . 1.2 mp -65.18 -42.54 94.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.301 -0.874 . . . . 0.0 108.932 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 31.2 t30 -80.81 8.29 8.52 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.168 -0.957 . . . . 0.0 110.222 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.479 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.2 OUTLIER -122.14 -14.47 7.95 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.027 -1.046 . . . . 0.0 110.034 -179.746 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.549 ' HB3' ' CD1' ' A' ' 44' ' ' LEU . . . -47.65 -102.54 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.36 -0.838 . . . . 0.0 110.599 -179.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -171.05 -68.71 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.803 -1.185 . . . . 0.0 109.565 -179.311 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.453 ' O ' HG21 ' A' ' 41' ' ' VAL . 33.3 p -123.41 -167.72 1.66 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.313 -0.867 . . . . 0.0 109.399 -179.856 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.469 HG23 ' OD1' ' A' ' 9' ' ' ASN . 26.1 t -64.85 -53.9 36.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.152 -0.968 . . . . 0.0 109.372 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.427 ' O ' ' CB ' ' A' ' 43' ' ' ALA . 9.2 pt-20 -52.97 -27.32 18.51 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.273 -0.892 . . . . 0.0 109.469 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.471 ' HB3' ' HB2' ' A' ' 35' ' ' ALA . 2.8 mm-40 -81.08 -33.09 33.63 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.167 -0.958 . . . . 0.0 109.001 179.507 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.467 HG22 HD22 ' A' ' 7' ' ' LEU . 15.6 t -70.61 -62.35 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.391 -0.818 . . . . 0.0 108.959 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.539 ' HA ' ' CB ' ' A' ' 14' ' ' ALA . 69.1 m-80 -57.12 -31.7 65.58 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.467 -0.771 . . . . 0.0 109.61 179.54 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.427 ' CB ' ' O ' ' A' ' 39' ' ' GLU . . . -67.36 -40.47 85.8 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.181 -0.949 . . . . 0.0 109.058 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.549 ' CD1' ' HB3' ' A' ' 35' ' ' ALA . 6.0 mt -61.91 -48.52 80.08 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.313 -0.867 . . . . 0.0 110.704 -179.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.587 ' HE2' ' CE1' ' A' ' 29' ' ' PHE . 0.0 OUTLIER -65.73 -24.94 67.08 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.868 -1.145 . . . . 0.0 110.356 -178.898 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.465 ' OD1' ' OE2' ' A' ' 17' ' ' GLU . 41.1 m-20 -80.94 -25.1 37.66 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.964 -1.085 . . . . 0.0 110.398 -179.513 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.456 ' O ' ' HB1' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -77.69 -18.97 56.08 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.986 -1.072 . . . . 0.0 110.412 -179.365 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.668 ' CG1' ' CD1' ' A' ' 28' ' ' TYR . 1.1 mt -66.14 -29.06 45.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.084 -1.01 . . . . 0.0 108.989 179.528 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.466 ' O ' ' OXT' ' A' ' 53' ' ' ALA . 1.4 mm? -60.34 -25.66 65.99 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.037 -1.039 . . . . 0.0 109.19 179.373 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.59 6.37 5.67 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.062 -1.024 . . . . 0.0 109.87 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.456 ' HB1' ' O ' ' A' ' 47' ' ' GLU . . . -101.0 -19.52 15.8 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.283 -0.886 . . . . 0.0 109.496 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.584 ' CD2' HG21 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -143.36 8.55 1.59 Allowed 'General case' 0 C--N 1.303 -1.454 0 C-N-CA 119.573 -0.851 . . . . 0.0 110.156 -178.398 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.466 ' OXT' ' O ' ' A' ' 49' ' ' LEU . . . . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 117.999 -1.0 . . . . 0.0 109.596 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 14.6 t . . . . . 0 N--CA 1.491 1.575 0 CA-C-O 121.315 0.579 . . . . 0.0 109.633 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.537 ' CG1' ' O ' ' A' ' 2' ' ' ILE . 2.1 tt -170.1 33.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.246 -0.908 . . . . 0.0 109.353 179.735 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.71 -10.83 50.85 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.056 -1.028 . . . . 0.0 108.634 179.266 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -71.88 -23.32 61.48 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.388 -0.82 . . . . 0.0 109.291 179.77 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.491 ' O ' ' N ' ' A' ' 7' ' ' LEU . 1.3 t90 -52.32 -48.5 65.41 Favored 'General case' 0 C--N 1.306 -1.304 0 O-C-N 121.242 -0.911 . . . . 0.0 110.86 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.481 ' O ' ' HB3' ' A' ' 7' ' ' LEU . 44.7 mt -38.68 -28.83 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.325 -0.859 . . . . 0.0 110.247 -178.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.592 ' CD1' ' CG2' ' A' ' 41' ' ' VAL . 20.5 tp 62.38 113.74 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.261 -0.899 . . . . 0.0 109.773 179.365 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.554 ' CG ' ' O ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER 179.26 40.37 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 179.647 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.527 ' OD1' ' CG1' ' A' ' 38' ' ' VAL . 0.2 OUTLIER -110.73 -61.98 1.6 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.366 -0.834 . . . . 0.0 109.799 -178.984 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -81.15 10.98 4.56 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.251 -0.906 . . . . 0.0 109.709 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.503 ' O ' HG13 ' A' ' 15' ' ' ILE . 0.1 OUTLIER -50.98 -78.15 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.028 -1.045 . . . . 0.0 110.505 -179.244 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -88.16 -18.34 28.98 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.011 -1.056 . . . . 0.0 110.94 -178.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -61.08 -39.48 90.06 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.826 -1.171 . . . . 0.0 109.308 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.5 ' O ' HD21 ' A' ' 18' ' ' LEU . . . -85.86 -45.93 11.09 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.27 -0.894 . . . . 0.0 109.254 179.724 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.59 HG12 ' CD1' ' A' ' 29' ' ' PHE . 95.2 mt -50.49 -29.23 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.535 -0.728 . . . . 0.0 110.288 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.3 -39.05 89.04 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.407 -0.808 . . . . 0.0 110.145 -178.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -83.37 -2.02 54.77 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.411 -0.806 . . . . 0.0 110.969 -178.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.5 HD21 ' O ' ' A' ' 14' ' ' ALA . 4.1 mm? -98.1 -38.01 9.51 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.814 -1.179 . . . . 0.0 110.066 -179.685 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.66 -38.92 49.12 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.237 -0.914 . . . . 0.0 109.736 -179.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.9 ttpt -71.51 -32.78 68.59 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.015 -1.053 . . . . 0.0 109.263 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.62 -22.21 32.44 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.259 -0.901 . . . . 0.0 109.582 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.444 ' O ' ' N ' ' A' ' 24' ' ' THR . . . 106.26 -41.14 2.25 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 46.8 mt -52.01 94.2 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.3 -1.118 . . . . 0.0 109.397 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.444 ' N ' ' O ' ' A' ' 22' ' ' GLY . 0.8 OUTLIER -97.27 19.8 12.53 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.22 -0.925 . . . . 0.0 109.848 -179.843 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.98 150.85 32.14 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.119 -0.988 . . . . 0.0 109.752 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -96.77 -8.18 31.86 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.244 -0.91 . . . . 0.0 109.276 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.514 ' CD1' ' O ' ' A' ' 27' ' ' PHE . 8.4 t80 -80.65 -8.8 59.75 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.038 -1.039 . . . . 0.0 109.476 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.635 ' CG ' ' CG1' ' A' ' 48' ' ' ILE . 18.6 m-30 -106.18 -15.33 14.89 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.384 -0.823 . . . . 0.0 109.207 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.59 ' CD1' HG12 ' A' ' 15' ' ' ILE . 10.7 m-30 -104.66 -49.75 3.46 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.577 -0.702 . . . . 0.0 109.376 -179.783 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -64.61 -41.23 96.34 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.244 -0.91 . . . . 0.0 109.35 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.7 1.27 20.45 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.228 -0.92 . . . . 0.0 109.775 -179.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.536 HD11 ' CG1' ' A' ' 15' ' ' ILE . 0.1 OUTLIER -72.96 -41.45 60.13 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.154 -0.966 . . . . 0.0 109.017 179.914 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 23.0 p30 -80.19 -0.78 37.66 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.339 -0.851 . . . . 0.0 109.576 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.497 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -107.03 -16.54 14.41 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.264 -0.898 . . . . 0.0 109.752 -179.563 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.518 ' O ' ' CG ' ' A' ' 36' ' ' LYS . . . -39.61 -98.91 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.641 -0.662 . . . . 0.0 110.624 -179.273 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.518 ' CG ' ' O ' ' A' ' 35' ' ' ALA . 5.3 mttt -171.15 -69.28 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.993 -1.067 . . . . 0.0 109.027 -179.235 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.455 HG21 ' HB2' ' A' ' 40' ' ' GLU . 5.1 t -127.94 -177.65 4.21 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.527 ' CG1' ' OD1' ' A' ' 9' ' ' ASN . 4.6 t -61.53 -48.87 86.79 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 O-C-N 120.909 -1.119 . . . . 0.0 109.661 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.53 ' O ' ' CB ' ' A' ' 43' ' ' ALA . 1.1 tt0 -61.35 -18.47 58.81 Favored 'General case' 0 C--N 1.296 -1.749 0 O-C-N 121.087 -1.008 . . . . 0.0 109.103 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.513 ' OE1' ' CA ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -90.78 -26.15 19.61 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.208 -0.932 . . . . 0.0 109.019 179.657 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.592 ' CG2' ' CD1' ' A' ' 7' ' ' LEU . 20.2 t -76.09 -54.75 12.92 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.398 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 179.007 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -66.68 -28.49 68.49 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.514 -0.741 . . . . 0.0 109.493 179.08 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.53 ' CB ' ' O ' ' A' ' 39' ' ' GLU . . . -76.99 -23.97 52.26 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.201 -0.937 . . . . 0.0 109.678 -179.68 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.536 ' HG ' ' N ' ' A' ' 45' ' ' LYS . 0.3 OUTLIER -78.75 -41.23 31.24 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.162 -0.961 . . . . 0.0 109.86 -179.581 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.536 ' N ' ' HG ' ' A' ' 44' ' ' LEU . 6.4 mmtt -61.58 -35.17 77.05 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.959 -1.088 . . . . 0.0 109.592 -179.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.2 m-20 -70.39 -23.5 62.78 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.083 -1.01 . . . . 0.0 108.457 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.532 ' O ' ' CB ' ' A' ' 51' ' ' ALA . 2.2 tt0 -78.85 1.56 23.0 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.5 -0.75 . . . . 0.0 109.038 179.183 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.635 ' CG1' ' CG ' ' A' ' 28' ' ' TYR . 1.7 mp -79.33 -33.16 15.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 23.1 tp -69.98 -30.86 68.3 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.426 -0.796 . . . . 0.0 109.938 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.6 mttt -102.79 -14.89 16.43 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.025 -1.047 . . . . 0.0 110.01 -179.546 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.532 ' CB ' ' O ' ' A' ' 47' ' ' GLU . . . -100.77 19.69 16.67 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.154 -0.966 . . . . 0.0 109.72 -179.768 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -165.52 -44.26 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.272 -0.892 . . . . 0.0 109.153 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 117.953 -1.023 . . . . 0.0 109.558 -179.998 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 13.9 t . . . . . 0 N--CA 1.491 1.597 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.405 ' C ' ' N ' ' A' ' 4' ' ' GLN . 0.2 OUTLIER -147.37 26.32 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.184 -0.948 . . . . 0.0 110.183 -179.622 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -55.34 -18.71 7.03 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 177.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.405 ' N ' ' C ' ' A' ' 2' ' ' ILE . 24.5 mt-30 -94.04 55.39 2.07 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.517 ' O ' ' N ' ' A' ' 7' ' ' LEU . 5.0 p-90 -79.43 -56.69 4.14 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.884 -1.135 . . . . 0.0 109.829 -179.605 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.598 ' CD1' ' N ' ' A' ' 6' ' ' LEU . 4.6 mp 38.34 25.42 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.595 -0.691 . . . . 0.0 111.02 179.766 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.544 HD12 ' CG2' ' A' ' 41' ' ' VAL . 42.1 tp 67.09 -10.09 0.34 Allowed 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.12 -0.988 . . . . 0.0 112.012 179.547 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -99.48 90.82 4.65 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 120.35 -1.469 . . . . 0.0 109.233 -179.743 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.578 ' ND2' ' N ' ' A' ' 9' ' ' ASN . 0.0 OUTLIER -161.93 -87.82 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.413 -0.804 . . . . 0.0 109.189 -179.572 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.444 ' HB2' ' OD1' ' A' ' 42' ' ' ASN . . . -54.45 -18.3 4.09 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.333 -0.854 . . . . 0.0 109.687 179.782 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.456 ' O ' HG13 ' A' ' 15' ' ' ILE . 0.4 OUTLIER -57.82 -71.46 0.11 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.237 -0.915 . . . . 0.0 110.181 -179.471 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -64.29 -28.54 69.79 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.002 -1.061 . . . . 0.0 110.013 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -61.77 -31.87 72.1 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 120.975 -1.078 . . . . 0.0 109.125 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.28 -58.25 2.83 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.312 -0.868 . . . . 0.0 108.775 179.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.577 HG12 ' CD1' ' A' ' 29' ' ' PHE . 8.3 mt -43.33 -35.22 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 O-C-N 121.531 -0.731 . . . . 0.0 110.413 179.717 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -77.15 29.26 0.14 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.294 -0.879 . . . . 0.0 110.652 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.411 ' H ' ' C ' ' A' ' 15' ' ' ILE . 2.8 tt0 -151.66 -36.62 0.13 Allowed 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.541 ' CD1' ' HE3' ' A' ' 45' ' ' LYS . 14.9 mt -78.72 -31.31 46.34 Favored 'General case' 0 C--N 1.306 -1.287 0 O-C-N 121.64 -0.662 . . . . 0.0 109.558 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.9 tttt -58.95 -21.53 58.5 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.131 -0.981 . . . . 0.0 109.674 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 41.1 mtmt -84.03 -25.91 29.51 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.289 -0.882 . . . . 0.0 109.527 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.32 -4.06 13.11 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.27 -0.894 . . . . 0.0 109.773 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 102.36 -34.73 5.49 Favored Glycine 0 N--CA 1.488 2.149 0 N-CA-C 108.966 -1.654 . . . . 0.0 108.966 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.472 ' CG2' ' O ' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -46.9 117.67 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 O-C-N 121.44 -1.035 . . . . 0.0 108.864 179.735 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.39 6.77 6.36 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.08 -1.013 . . . . 0.0 110.042 -179.661 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -54.01 121.1 7.35 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.237 -0.914 . . . . 0.0 109.222 179.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.48 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 33.3 m-20 -73.51 -1.4 18.4 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.083 -1.01 . . . . 0.0 109.641 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.466 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 3.2 t80 -80.82 -39.79 26.02 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.034 -1.041 . . . . 0.0 109.247 179.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.597 ' CE2' ' CG2' ' A' ' 48' ' ' ILE . 21.7 m-30 -74.83 -25.03 58.72 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.472 -0.768 . . . . 0.0 110.129 -179.467 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.577 ' CD1' HG12 ' A' ' 15' ' ' ILE . 11.7 m-85 -94.97 -49.93 5.33 Favored 'General case' 0 C--N 1.297 -1.677 0 O-C-N 121.271 -0.893 . . . . 0.0 110.205 -178.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.48 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 66.3 m-20 -61.0 -35.77 77.72 Favored 'General case' 0 C--N 1.297 -1.704 0 O-C-N 121.152 -0.968 . . . . 0.0 109.476 179.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.423 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . . . -85.26 -4.39 59.14 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.256 -0.903 . . . . 0.0 110.328 -179.033 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.547 HD11 ' CG1' ' A' ' 15' ' ' ILE . 0.4 OUTLIER -62.59 -44.82 99.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.074 -1.016 . . . . 0.0 109.554 -179.67 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -77.82 -5.63 51.46 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.14 -0.975 . . . . 0.0 109.489 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.452 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -77.99 -22.86 48.72 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.244 -0.91 . . . . 0.0 109.607 -179.92 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.53 ' CB ' ' HB3' ' A' ' 40' ' ' GLU . . . -51.53 -175.47 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.216 -0.928 . . . . 0.0 109.973 -179.683 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.413 ' H ' ' CB ' ' A' ' 40' ' ' GLU . 0.5 OUTLIER -106.58 -54.04 2.53 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.498 -0.751 . . . . 0.0 109.096 179.824 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.498 ' CA ' HD11 ' A' ' 7' ' ' LEU . 51.9 p -123.61 -172.95 2.63 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.312 -0.868 . . . . 0.0 109.24 179.752 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.506 HG23 ' ND2' ' A' ' 9' ' ' ASN . 67.4 t -66.91 -26.17 36.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.111 -0.993 . . . . 0.0 109.474 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.472 ' O ' ' HB3' ' A' ' 43' ' ' ALA . 63.7 mt-10 -73.12 -29.18 62.71 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 179.381 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.53 ' HB3' ' CB ' ' A' ' 35' ' ' ALA . 2.9 mm-40 -79.23 -32.54 43.94 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 178.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.544 ' CG2' HD12 ' A' ' 7' ' ' LEU . 21.1 t -68.61 -68.37 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.444 ' OD1' ' HB2' ' A' ' 10' ' ' ALA . 88.1 m-20 -51.3 -28.27 11.63 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 179.222 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.472 ' HB3' ' O ' ' A' ' 39' ' ' GLU . . . -64.21 -50.34 68.45 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.43 -0.794 . . . . 0.0 109.031 179.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.9 mt -54.98 -44.0 74.05 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.29 -0.882 . . . . 0.0 109.881 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.552 ' NZ ' ' HB3' ' A' ' 28' ' ' TYR . 0.3 OUTLIER -57.64 -40.53 79.45 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.16 -0.963 . . . . 0.0 109.162 179.862 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.5 m-20 -69.65 -21.87 63.5 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.263 -0.898 . . . . 0.0 109.622 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -82.96 10.27 8.27 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.212 -0.93 . . . . 0.0 109.314 179.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.597 ' CG2' ' CE2' ' A' ' 28' ' ' TYR . 62.0 mt -90.03 -45.02 15.1 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 179.154 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 7.4 mp -61.72 -21.48 64.53 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.436 -0.79 . . . . 0.0 109.681 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -106.42 -43.22 4.82 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.902 -1.124 . . . . 0.0 109.906 -179.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.519 ' O ' ' CB ' ' A' ' 52' ' ' HIS . . . -84.71 43.15 0.96 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.163 -0.961 . . . . 0.0 109.134 179.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.526 ' O ' ' CB ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER 163.14 157.03 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 -179.54 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.526 ' CB ' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 118.037 -0.982 . . . . 0.0 109.425 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 7.7 p . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.479 HG12 ' O ' ' A' ' 2' ' ' ILE . 17.4 tt -136.62 36.66 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.203 -0.936 . . . . 0.0 109.69 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -69.57 -6.67 32.56 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.176 -0.953 . . . . 0.0 108.576 178.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -91.56 57.45 3.29 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.466 -0.771 . . . . 0.0 109.917 -179.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.446 ' O ' ' HB2' ' A' ' 6' ' ' LEU . 1.3 t90 -56.32 -87.61 0.0 OUTLIER 'General case' 0 C--N 1.304 -1.395 0 O-C-N 120.977 -1.077 . . . . 0.0 111.123 -179.24 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.446 ' HB2' ' O ' ' A' ' 5' ' ' TRP . 0.7 OUTLIER 179.23 -44.94 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.601 -1.312 . . . . 0.0 109.389 -179.792 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.486 ' HG ' ' ND2' ' A' ' 9' ' ' ASN . 0.7 OUTLIER -139.09 -106.12 0.17 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.362 -0.837 . . . . 0.0 109.108 179.805 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.421 ' C ' ' O ' ' A' ' 7' ' ' LEU . 0.4 OUTLIER 41.97 35.95 0.61 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.073 -1.017 . . . . 0.0 109.867 179.731 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.486 ' ND2' ' HG ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER -87.36 -75.08 0.42 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.249 -0.907 . . . . 0.0 108.714 179.705 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.469 ' HB1' HG12 ' A' ' 38' ' ' VAL . . . -81.87 29.73 0.39 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.184 -0.947 . . . . 0.0 110.396 179.583 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.539 ' O ' ' CD1' ' A' ' 15' ' ' ILE . 0.4 OUTLIER -63.81 -42.86 97.59 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 120.788 -1.195 . . . . 0.0 109.915 -179.715 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.469 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 1.5 tt0 -96.01 -26.04 15.7 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.048 -1.033 . . . . 0.0 110.437 -179.241 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -65.83 -56.43 11.93 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.822 -1.174 . . . . 0.0 110.146 -179.341 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.501 ' O ' ' HE3' ' A' ' 45' ' ' LYS . . . -69.77 -46.78 65.03 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.203 -0.936 . . . . 0.0 110.009 -179.531 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.602 ' CG2' ' CZ ' ' A' ' 29' ' ' PHE . 46.0 mt -57.85 -29.59 35.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 CA-C-O 121.718 0.77 . . . . 0.0 109.652 -179.699 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' A' ' 12' ' ' GLU . . . -61.79 -6.8 2.92 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.51 -0.744 . . . . 0.0 111.284 -178.84 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.465 ' HB3' ' NZ ' ' A' ' 45' ' ' LYS . 28.6 tt0 -105.39 -22.61 12.99 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 120.906 -1.121 . . . . 0.0 109.996 -179.365 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.538 ' CD1' ' HE2' ' A' ' 45' ' ' LYS . 0.7 OUTLIER -76.78 -35.98 57.31 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.924 -1.11 . . . . 0.0 109.449 -179.87 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.7 ttmt -50.34 -35.12 26.35 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.323 -0.861 . . . . 0.0 109.843 -179.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.85 -21.77 21.29 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.141 -0.974 . . . . 0.0 109.746 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . 0.473 ' HB1' ' HA ' ' A' ' 18' ' ' LEU . . . -64.27 -28.13 69.52 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.154 -0.966 . . . . 0.0 109.17 179.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 115.61 -16.93 16.37 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.517 HD12 ' NE2' ' A' ' 52' ' ' HIS . 67.4 mt -84.19 115.13 25.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.198 -1.178 . . . . 0.0 109.798 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.414 ' O ' ' C ' ' A' ' 25' ' ' SER . 0.0 OUTLIER -117.47 0.45 12.15 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.187 -0.946 . . . . 0.0 109.302 179.36 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.414 ' C ' ' O ' ' A' ' 24' ' ' THR . 49.6 m -44.75 157.44 0.07 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.177 -0.952 . . . . 0.0 109.45 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.474 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 4.8 p-10 -104.11 -7.17 20.42 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.22 -0.925 . . . . 0.0 109.866 -179.621 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.563 ' O ' ' CG ' ' A' ' 27' ' ' PHE . 27.0 t80 -80.54 1.3 30.13 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.982 -1.073 . . . . 0.0 109.55 -179.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.582 ' CG ' HG12 ' A' ' 48' ' ' ILE . 15.6 m-85 -117.34 -50.66 2.54 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 179.205 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.602 ' CZ ' ' CG2' ' A' ' 15' ' ' ILE . 1.2 m-30 -66.41 -38.83 88.34 Favored 'General case' 0 C--N 1.302 -1.48 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.121 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.474 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 12.0 m-20 -69.76 -34.33 73.64 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.209 -0.932 . . . . 0.0 108.833 179.435 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.91 -15.42 58.35 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.476 -0.765 . . . . 0.0 109.471 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.522 HG21 ' CG1' ' A' ' 41' ' ' VAL . 1.3 mm -53.12 -27.72 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.251 -0.905 . . . . 0.0 108.968 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.457 ' OD1' ' O ' ' A' ' 30' ' ' ASN . 2.2 p-10 -80.38 -33.32 37.24 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.031 -1.043 . . . . 0.0 109.486 179.784 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.46 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -54.71 -27.98 44.61 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.245 -0.909 . . . . 0.0 109.428 179.986 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.46 ' O ' ' O ' ' A' ' 34' ' ' LYS . . . -44.99 169.27 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.288 -0.883 . . . . 0.0 109.476 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.3 mttp -99.0 -47.0 5.4 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.319 -0.863 . . . . 0.0 109.455 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.433 ' OG1' ' HG2' ' A' ' 40' ' ' GLU . 70.6 p -126.73 -163.08 1.2 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.208 -0.932 . . . . 0.0 109.388 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.469 HG12 ' HB1' ' A' ' 10' ' ' ALA . 87.3 t -70.56 -54.98 15.96 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 O-C-N 121.301 -0.874 . . . . 0.0 109.317 179.818 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.522 ' O ' ' CB ' ' A' ' 43' ' ' ALA . 3.2 tt0 -53.33 -27.94 26.02 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.275 -0.891 . . . . 0.0 109.228 179.755 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.433 ' HG2' ' OG1' ' A' ' 37' ' ' THR . 4.8 mm-40 -79.07 -35.38 42.54 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 179.295 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.522 ' CG1' HG21 ' A' ' 32' ' ' ILE . 55.4 t -65.76 -67.18 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 178.685 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.472 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 7.4 m-20 -53.9 -30.71 47.29 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.674 -0.641 . . . . 0.0 109.537 179.228 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.522 ' CB ' ' O ' ' A' ' 39' ' ' GLU . . . -66.14 -39.89 90.2 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.215 -0.928 . . . . 0.0 109.457 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.0 mt -61.67 -43.11 99.48 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.262 -0.899 . . . . 0.0 110.699 -179.451 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.538 ' HE2' ' CD1' ' A' ' 18' ' ' LEU . 0.0 OUTLIER -67.32 -43.51 81.42 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.846 -1.159 . . . . 0.0 109.883 -179.163 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.475 ' N ' ' CG ' ' A' ' 45' ' ' LYS . 28.0 m-20 -69.35 -21.47 63.81 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.108 -0.995 . . . . 0.0 108.69 179.626 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.469 ' O ' ' HB1' ' A' ' 51' ' ' ALA . 1.3 tm-20 -73.32 -12.71 60.93 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.593 HG23 ' CD2' ' A' ' 52' ' ' HIS . 53.9 mt -65.81 -41.08 89.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 179.082 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.449 HD11 ' N ' ' A' ' 49' ' ' LEU . 2.2 mp -50.76 -29.47 11.56 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.78 -0.575 . . . . 0.0 110.353 -179.728 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.45 ' CD ' ' O ' ' A' ' 50' ' ' LYS . 0.1 OUTLIER -111.99 -13.89 13.54 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.778 -1.201 . . . . 0.0 110.675 -179.228 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.469 ' HB1' ' O ' ' A' ' 47' ' ' GLU . . . -100.9 20.49 15.32 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 179.36 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.593 ' CD2' HG23 ' A' ' 48' ' ' ILE . 0.0 OUTLIER 173.47 155.21 0.11 Allowed 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.84 -1.171 . . . . 0.0 107.84 -179.248 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.552 ' CB ' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.492 1.654 0 CA-C-O 117.943 -1.027 . . . . 0.0 109.252 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 17.8 m . . . . . 0 N--CA 1.49 1.525 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.476 HD11 ' O ' ' A' ' 2' ' ' ILE . 0.0 OUTLIER -109.82 24.02 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.294 -0.879 . . . . 0.0 109.525 -179.833 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.5 p30 -90.36 29.37 1.28 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.095 -1.003 . . . . 0.0 108.661 179.105 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -99.88 53.4 0.92 Allowed 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.508 -0.745 . . . . 0.0 109.946 -179.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.631 ' O ' ' CB ' ' A' ' 6' ' ' LEU . 27.3 p-90 -114.49 -133.25 0.34 Allowed 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 179.286 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.631 ' CB ' ' O ' ' A' ' 5' ' ' TRP . 17.8 tp 101.11 -14.21 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.536 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.61 ' CD1' ' CG2' ' A' ' 41' ' ' VAL . 5.1 tp 74.88 -68.75 0.2 Allowed 'General case' 0 N--CA 1.499 1.981 0 CA-C-O 120.944 0.402 . . . . 0.0 110.459 179.319 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.492 ' O ' ' HB2' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -56.25 -12.84 1.75 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.889 -1.132 . . . . 0.0 110.13 179.806 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -56.97 -41.2 77.93 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 120.991 -1.068 . . . . 0.0 110.032 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.447 ' HB2' ' CG1' ' A' ' 41' ' ' VAL . . . -80.22 -9.54 59.73 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.218 -0.926 . . . . 0.0 110.401 -179.213 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.492 ' HB2' ' O ' ' A' ' 8' ' ' LYS . 36.4 mtpt -45.26 -69.89 0.12 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.118 -0.989 . . . . 0.0 110.152 -179.44 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -90.79 -20.67 22.09 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.05 -1.031 . . . . 0.0 110.322 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.82 -30.86 71.8 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 120.911 -1.118 . . . . 0.0 109.426 -179.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.549 ' O ' ' CD2' ' A' ' 18' ' ' LEU . . . -93.77 -49.04 6.03 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.685 -0.858 . . . . 0.0 108.685 179.458 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.582 HG21 ' CE1' ' A' ' 29' ' ' PHE . 70.0 mt -53.65 -27.32 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 CA-C-O 121.547 0.689 . . . . 0.0 110.65 179.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.4 -3.05 1.21 Allowed 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.444 -0.785 . . . . 0.0 111.351 -178.39 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -122.31 -3.6 8.94 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 120.683 -1.261 . . . . 0.0 110.201 -179.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.549 ' CD2' ' O ' ' A' ' 14' ' ' ALA . 2.5 mm? -99.71 -38.53 8.66 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.036 -1.04 . . . . 0.0 109.562 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.7 tptp -50.91 -45.07 60.24 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.245 -0.909 . . . . 0.0 109.148 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.93 -31.27 72.1 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.232 -0.917 . . . . 0.0 109.548 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.97 -48.86 79.98 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.254 -0.904 . . . . 0.0 109.52 -179.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 136.29 -22.25 3.4 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.294 -1.522 . . . . 0.0 109.294 -179.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.521 HD12 ' CG2' ' A' ' 48' ' ' ILE . 53.9 mt -66.57 122.5 17.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.336 -1.097 . . . . 0.0 109.301 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.421 ' O ' ' C ' ' A' ' 25' ' ' SER . 13.7 p -128.99 1.38 5.29 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.192 -0.942 . . . . 0.0 109.845 -179.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.421 ' C ' ' O ' ' A' ' 24' ' ' THR . 18.3 t -44.22 161.2 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.178 -0.951 . . . . 0.0 108.958 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.528 ' O ' ' CB ' ' A' ' 30' ' ' ASN . 3.6 p30 -99.6 -10.89 21.48 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.129 -0.982 . . . . 0.0 109.573 -179.834 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.608 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 18.4 t80 -81.01 -6.38 58.72 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.029 -1.045 . . . . 0.0 109.611 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.634 ' CG ' ' CG1' ' A' ' 48' ' ' ILE . 23.1 m-85 -110.97 -37.11 5.47 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.205 -0.934 . . . . 0.0 108.494 179.446 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.582 ' CE1' HG21 ' A' ' 15' ' ' ILE . 3.5 m-85 -85.39 -43.53 13.57 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 179.175 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.528 ' CB ' ' O ' ' A' ' 26' ' ' ASP . 48.3 t30 -69.87 -57.87 4.55 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.4 -0.813 . . . . 0.0 108.955 179.636 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.456 ' HB1' ' O ' ' A' ' 27' ' ' PHE . . . -59.5 -16.29 23.35 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.437 -0.79 . . . . 0.0 109.203 179.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.478 HG23 HD13 ' A' ' 15' ' ' ILE . 0.4 OUTLIER -54.15 -39.38 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.34 -0.85 . . . . 0.0 108.814 179.924 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.526 ' ND2' ' N ' ' A' ' 34' ' ' LYS . 0.7 OUTLIER -75.77 -35.03 60.26 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.274 -0.891 . . . . 0.0 109.094 179.618 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.526 ' N ' ' ND2' ' A' ' 33' ' ' ASN . 0.7 OUTLIER -55.41 -25.2 34.51 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.377 -0.827 . . . . 0.0 109.501 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.45 ' HB3' HD11 ' A' ' 44' ' ' LEU . . . -40.12 155.96 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.667 -0.646 . . . . 0.0 109.914 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.531 ' O ' ' CD2' ' A' ' 7' ' ' LEU . 0.0 OUTLIER -86.39 -70.85 0.58 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.318 -0.864 . . . . 0.0 109.535 -179.976 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.439 ' O ' HG21 ' A' ' 41' ' ' VAL . 0.6 OUTLIER -108.55 -179.94 4.02 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.159 -0.963 . . . . 0.0 109.138 179.758 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 27.8 t -59.3 -37.77 70.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.23 -0.918 . . . . 0.0 109.234 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.528 ' O ' ' CB ' ' A' ' 43' ' ' ALA . 43.4 mt-10 -63.51 -28.48 69.98 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 121.281 -0.887 . . . . 0.0 108.747 179.378 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.502 ' OE1' ' N ' ' A' ' 40' ' ' GLU . 1.1 mp0 -79.49 -31.27 42.26 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 179.131 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.61 ' CG2' ' CD1' ' A' ' 7' ' ' LEU . 12.7 t -67.21 -66.67 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.343 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 178.968 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -55.46 -35.29 65.32 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 179.182 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.528 ' CB ' ' O ' ' A' ' 39' ' ' GLU . . . -62.05 -35.82 79.78 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.283 -0.885 . . . . 0.0 109.164 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.465 ' O ' HD11 ' A' ' 48' ' ' ILE . 3.7 mt -59.44 -52.15 66.85 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.433 -0.792 . . . . 0.0 110.314 -179.758 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.467 ' HE3' ' HG ' ' A' ' 18' ' ' LEU . 43.0 mmtt -64.39 -25.67 68.13 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.106 -0.997 . . . . 0.0 109.998 -179.119 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.4 m-20 -76.46 -18.07 58.98 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.054 -1.029 . . . . 0.0 109.621 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.534 ' O ' ' CB ' ' A' ' 51' ' ' ALA . 0.0 OUTLIER -90.18 -12.79 37.1 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.186 -0.946 . . . . 0.0 109.294 179.76 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.634 ' CG1' ' CG ' ' A' ' 28' ' ' TYR . 1.2 mp -73.3 -35.38 46.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 179.529 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 5.7 tp -61.82 -24.03 66.62 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.074 -1.016 . . . . 0.0 110.081 -179.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 26.1 mttt -121.76 -1.72 9.42 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.818 -1.176 . . . . 0.0 110.076 -179.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.534 ' CB ' ' O ' ' A' ' 47' ' ' GLU . . . -101.11 -28.11 12.88 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.111 -0.993 . . . . 0.0 109.886 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.607 ' CD2' HG21 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -131.96 -0.03 3.82 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.094 -1.004 . . . . 0.0 109.87 -179.334 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.656 0 CA-C-O 118.027 -0.987 . . . . 0.0 109.572 179.769 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' THR . . . . . 0.506 ' O ' ' CG2' ' A' ' 2' ' ' ILE . 1.8 t . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 121.247 0.546 . . . . 0.0 109.73 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.53 ' CG1' ' O ' ' A' ' 2' ' ' ILE . 0.3 OUTLIER 39.9 34.4 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 CA-C-O 121.601 0.715 . . . . 0.0 109.787 179.786 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 63.1 m-20 -91.49 21.1 4.79 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 178.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -100.46 76.61 1.86 Allowed 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.744 -0.598 . . . . 0.0 109.517 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.528 ' CE3' ' N ' ' A' ' 6' ' ' LEU . 0.7 OUTLIER -97.27 -38.51 9.65 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.225 -0.922 . . . . 0.0 109.294 179.8 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.528 ' N ' ' CE3' ' A' ' 5' ' ' TRP . 4.6 mp 61.92 86.46 0.11 Allowed 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.35 -0.844 . . . . 0.0 109.805 179.812 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.59 ' CD2' ' CG2' ' A' ' 41' ' ' VAL . 14.0 tp -85.16 47.11 1.36 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.368 -0.832 . . . . 0.0 108.945 179.612 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.614 ' HA ' ' HB2' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -94.66 -15.09 24.25 Favored 'General case' 0 C--N 1.304 -1.388 0 O-C-N 121.217 -0.927 . . . . 0.0 109.66 -179.748 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.58 ' ND2' ' N ' ' A' ' 9' ' ' ASN . 0.1 OUTLIER -38.02 -91.36 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.732 -0.605 . . . . 0.0 110.632 -179.758 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.494 ' HA ' ' HB2' ' A' ' 13' ' ' ASP . . . -69.8 0.2 6.1 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.177 -0.952 . . . . 0.0 110.818 -179.085 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.614 ' HB2' ' HA ' ' A' ' 8' ' ' LYS . 0.1 OUTLIER -44.63 -74.05 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.464 0 O-C-N 120.819 -1.176 . . . . 0.0 110.571 -179.712 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.464 ' HA ' ' HB ' ' A' ' 15' ' ' ILE . 76.0 mt-10 -75.76 -5.77 47.38 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.962 -1.086 . . . . 0.0 110.307 -179.103 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.494 ' HB2' ' HA ' ' A' ' 10' ' ' ALA . 1.0 OUTLIER -70.37 -44.82 67.3 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.208 -0.933 . . . . 0.0 109.333 179.8 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -87.25 -31.7 20.12 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.329 -0.857 . . . . 0.0 109.284 179.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.529 HG12 ' CD1' ' A' ' 29' ' ' PHE . 31.4 mt -62.39 -28.84 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 CA-C-O 121.917 0.865 . . . . 0.0 109.051 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.29 -10.96 12.53 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.808 -0.557 . . . . 0.0 110.145 -179.087 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -101.27 -18.66 16.01 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.299 -0.876 . . . . 0.0 109.526 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.581 ' HG ' ' CE ' ' A' ' 45' ' ' LYS . 4.2 mm? -90.02 -56.07 3.37 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.278 -0.889 . . . . 0.0 109.824 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.6 tttp -49.5 -29.59 6.96 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.4 -0.813 . . . . 0.0 109.908 -179.288 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.0 tttp -86.7 -29.53 22.36 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.1 -1.0 . . . . 0.0 109.715 -179.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.23 -33.99 75.41 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.27 -0.894 . . . . 0.0 109.713 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 131.04 -45.15 1.15 Allowed Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.414 -1.475 . . . . 0.0 109.414 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.417 HD12 ' CG2' ' A' ' 48' ' ' ILE . 66.0 mt -45.62 136.6 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.272 -1.134 . . . . 0.0 109.517 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 64.1 p -137.74 25.22 2.84 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.249 -0.907 . . . . 0.0 109.457 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 9.8 t -65.11 156.63 30.96 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.281 -0.887 . . . . 0.0 109.329 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.462 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 68.7 m-20 -96.45 -6.98 36.03 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.223 -0.923 . . . . 0.0 109.597 -179.871 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.528 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 8.6 t80 -81.83 -19.27 41.43 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 120.971 -1.081 . . . . 0.0 109.013 179.625 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.6 ' CD2' HG12 ' A' ' 48' ' ' ILE . 22.2 m-30 -97.16 -11.82 23.84 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.39 -0.819 . . . . 0.0 109.615 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.529 ' CD1' HG12 ' A' ' 15' ' ' ILE . 9.8 m-85 -112.55 -49.96 2.92 Favored 'General case' 0 C--N 1.297 -1.697 0 O-C-N 121.296 -0.877 . . . . 0.0 109.45 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.462 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 8.5 t30 -62.19 -40.55 96.43 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.581 -0.699 . . . . 0.0 109.285 179.501 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . 0.445 ' HB1' ' O ' ' A' ' 27' ' ' PHE . . . -81.16 -1.2 43.64 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.39 -0.819 . . . . 0.0 109.886 -179.686 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.538 ' CG2' ' HG2' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -76.45 -55.93 9.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.108 -0.995 . . . . 0.0 109.611 -179.659 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.517 ' N ' HG23 ' A' ' 32' ' ' ILE . 6.8 t-20 -69.24 -6.42 29.07 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.136 -0.977 . . . . 0.0 109.193 179.77 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.48 ' O ' ' O ' ' A' ' 35' ' ' ALA . 4.2 mttt -103.38 -20.63 14.01 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.255 -0.903 . . . . 0.0 109.636 -179.838 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.48 ' O ' ' O ' ' A' ' 34' ' ' LYS . . . -40.29 164.09 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.747 0 CA-C-O 121.625 0.726 . . . . 0.0 110.175 -179.568 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.6 mttp -51.4 -78.93 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.336 -0.852 . . . . 0.0 110.165 -179.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.524 ' CG2' ' HG2' ' A' ' 39' ' ' GLU . 4.8 t -128.76 -154.09 0.61 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.186 -0.946 . . . . 0.0 109.724 -179.555 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.446 ' N ' ' CG2' ' A' ' 37' ' ' THR . 12.3 t -75.79 -53.9 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 O-C-N 121.119 -0.988 . . . . 0.0 109.845 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.524 ' HG2' ' CG2' ' A' ' 37' ' ' THR . 1.3 pt-20 -55.36 -22.6 20.21 Favored 'General case' 0 C--N 1.296 -1.732 0 O-C-N 121.007 -1.058 . . . . 0.0 108.575 179.542 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.457 ' O ' ' HB3' ' A' ' 44' ' ' LEU . 20.0 tp10 -84.9 -32.82 22.94 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.881 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.59 ' CG2' ' CD2' ' A' ' 7' ' ' LEU . 53.9 t -66.62 -59.96 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.432 ' O ' ' OD1' ' A' ' 46' ' ' ASN . 35.9 m-80 -58.75 -34.93 71.95 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.474 -0.766 . . . . 0.0 109.735 179.574 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.451 ' HB1' ' O ' ' A' ' 39' ' ' GLU . . . -72.85 -26.64 61.54 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.156 -0.965 . . . . 0.0 109.631 -179.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.478 ' CD2' ' HA ' ' A' ' 32' ' ' ILE . 0.3 OUTLIER -75.83 -30.15 58.86 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.139 -0.976 . . . . 0.0 108.464 179.502 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.581 ' CE ' ' HG ' ' A' ' 18' ' ' LEU . 0.0 OUTLIER -64.62 -26.21 68.3 Favored 'General case' 0 N--CA 1.487 1.408 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.369 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . 0.432 ' OD1' ' O ' ' A' ' 42' ' ' ASN . 23.1 m120 -80.18 -15.86 56.11 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.554 -0.716 . . . . 0.0 109.813 -179.657 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -83.01 -7.61 59.65 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.201 -0.937 . . . . 0.0 109.82 -179.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.6 HG12 ' CD2' ' A' ' 28' ' ' TYR . 2.4 mp -74.82 -46.67 40.46 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 O-C-N 120.966 -1.084 . . . . 0.0 108.586 179.348 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.2 mp -54.09 -40.12 66.97 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.311 -0.868 . . . . 0.0 109.105 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.6 tmtt? -80.4 -73.14 0.38 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.162 -0.962 . . . . 0.0 108.548 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.476 ' O ' ' HB3' ' A' ' 52' ' ' HIS . . . -55.88 161.46 2.23 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.075 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.625 ' CG ' ' O ' ' A' ' 52' ' ' HIS . 0.4 OUTLIER 64.73 10.46 6.04 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 120.911 -1.118 . . . . 0.0 108.964 179.674 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.453 0 O-C-N 120.963 -1.086 . . . . 0.0 109.455 179.722 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.532 ' O ' ' CD1' ' A' ' 2' ' ' ILE . 0.3 OUTLIER -106.7 12.95 8.43 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.26 -0.9 . . . . 0.0 109.343 -179.91 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 19.3 p-10 -60.34 -16.99 40.04 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.16 -0.962 . . . . 0.0 109.054 179.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.493 ' O ' ' C ' ' A' ' 5' ' ' TRP . 0.2 OUTLIER -57.18 -33.63 67.67 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.363 -0.835 . . . . 0.0 109.421 179.997 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.523 ' O ' ' N ' ' A' ' 7' ' ' LEU . 22.2 t90 -32.96 -88.17 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.741 -0.599 . . . . 0.0 110.578 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.469 ' O ' ' HB3' ' A' ' 7' ' ' LEU . 0.5 OUTLIER 36.59 28.53 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.383 -0.823 . . . . 0.0 111.039 179.841 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.523 ' N ' ' O ' ' A' ' 5' ' ' TRP . 0.4 OUTLIER 61.71 99.01 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.009 -1.057 . . . . 0.0 110.079 179.45 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.484 ' HD3' ' CD ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -151.58 58.57 0.88 Allowed 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.5 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.532 ' ND2' HG23 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -126.85 -49.01 1.49 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.399 -0.813 . . . . 0.0 109.619 -178.974 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.437 ' HA ' ' HB2' ' A' ' 13' ' ' ASP . . . -80.78 0.82 33.09 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.262 -0.899 . . . . 0.0 109.617 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.484 ' CD ' ' HD3' ' A' ' 8' ' ' LYS . 5.4 mtpm? -62.52 -88.01 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.171 -0.956 . . . . 0.0 109.969 -179.463 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.453 ' O ' ' HB1' ' A' ' 16' ' ' ALA . 4.7 tt0 -57.83 -17.15 14.32 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.159 -0.963 . . . . 0.0 110.077 -179.3 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.437 ' HB2' ' HA ' ' A' ' 10' ' ' ALA . 61.8 m-20 -59.94 -73.61 0.09 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.097 -1.002 . . . . 0.0 109.475 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.473 ' O ' HD13 ' A' ' 18' ' ' LEU . . . -68.47 -42.36 78.84 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.228 -0.92 . . . . 0.0 109.461 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.594 HG21 ' CE1' ' A' ' 29' ' ' PHE . 10.6 mt -49.86 -30.82 6.33 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.524 0 O-C-N 121.206 -0.934 . . . . 0.0 109.033 179.796 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.453 ' HB1' ' O ' ' A' ' 12' ' ' GLU . . . -66.4 -38.74 88.17 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.633 -0.667 . . . . 0.0 110.582 -178.43 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.3 tp10 -76.21 -25.0 54.67 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.179 -0.951 . . . . 0.0 110.763 -178.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.505 ' CD1' ' HB3' ' A' ' 45' ' ' LYS . 0.9 OUTLIER -88.69 -30.21 19.29 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 120.929 -1.107 . . . . 0.0 110.37 -178.945 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.6 -29.67 68.14 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.305 -0.872 . . . . 0.0 109.504 -179.516 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -86.29 -26.37 24.98 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.335 -0.853 . . . . 0.0 109.211 179.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.31 -30.57 69.59 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.236 -0.915 . . . . 0.0 109.316 179.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 121.19 -28.99 5.88 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.779 -1.328 . . . . 0.0 109.779 179.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.471 HD12 HG22 ' A' ' 23' ' ' ILE . 26.8 mt -48.87 110.51 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.153 -1.204 . . . . 0.0 109.485 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -105.99 -7.12 18.28 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.213 -0.929 . . . . 0.0 109.4 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -48.12 118.62 2.47 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.25 -0.906 . . . . 0.0 109.182 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.485 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 0.3 OUTLIER -80.05 6.45 11.46 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.336 -0.853 . . . . 0.0 109.644 -179.868 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.442 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 20.4 t80 -78.85 -22.58 45.89 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.107 -0.996 . . . . 0.0 109.462 -179.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.58 ' CG ' HG12 ' A' ' 48' ' ' ILE . 22.6 m-85 -94.75 -45.2 7.44 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.179 -0.95 . . . . 0.0 108.821 179.464 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.628 ' CE1' ' HE2' ' A' ' 45' ' ' LYS . 14.4 m-85 -61.03 -50.95 71.26 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 179.08 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.485 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 1.9 t30 -60.34 -31.32 70.2 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.419 -0.801 . . . . 0.0 108.901 179.615 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.04 -22.08 53.52 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.453 -0.779 . . . . 0.0 109.682 -179.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.545 ' CG2' HD13 ' A' ' 15' ' ' ILE . 0.8 OUTLIER -68.28 -34.09 64.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.212 -0.93 . . . . 0.0 108.837 179.914 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -75.91 -4.54 41.49 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.213 -0.929 . . . . 0.0 109.021 179.366 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.448 ' O ' ' C ' ' A' ' 35' ' ' ALA . 6.5 mmmt -108.83 -17.78 13.85 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.212 -0.93 . . . . 0.0 109.531 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.448 ' C ' ' O ' ' A' ' 34' ' ' LYS . . . -38.45 154.82 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.71 -0.619 . . . . 0.0 110.127 -179.711 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.457 ' O ' HD11 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -87.74 -73.09 0.49 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.295 -0.878 . . . . 0.0 109.954 -179.791 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.482 ' HA ' HD11 ' A' ' 7' ' ' LEU . 0.8 OUTLIER -105.89 -177.38 3.35 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.152 -0.968 . . . . 0.0 109.365 -179.741 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.532 HG23 ' ND2' ' A' ' 9' ' ' ASN . 92.4 t -67.44 -30.05 47.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.134 -0.979 . . . . 0.0 109.028 179.649 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.522 ' HG3' ' N ' ' A' ' 40' ' ' GLU . 3.0 pt-20 -71.33 -25.29 62.34 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 178.254 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.522 ' N ' ' HG3' ' A' ' 39' ' ' GLU . 4.5 mm-40 -80.97 -30.74 35.05 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 178.592 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.52 ' CG2' HD23 ' A' ' 7' ' ' LEU . 48.7 t -67.41 -61.16 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 179.038 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 58.1 m-80 -62.05 -29.4 70.27 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.589 -0.695 . . . . 0.0 109.306 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.478 ' CB ' ' O ' ' A' ' 39' ' ' GLU . . . -71.17 -29.4 65.15 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.259 -0.901 . . . . 0.0 109.497 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 7.4 mt -75.1 -47.94 26.23 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.117 -0.989 . . . . 0.0 110.947 -179.228 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.628 ' HE2' ' CE1' ' A' ' 29' ' ' PHE . 0.3 OUTLIER -75.29 -43.45 51.09 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.861 -1.15 . . . . 0.0 110.081 -178.888 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -68.32 -21.08 64.77 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.029 -1.045 . . . . 0.0 109.436 179.782 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.476 ' O ' ' HB1' ' A' ' 51' ' ' ALA . 14.6 tt0 -79.79 -7.11 58.47 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.176 -0.952 . . . . 0.0 109.674 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.598 ' CG2' ' CD2' ' A' ' 52' ' ' HIS . 83.3 mt -68.95 -41.67 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 178.729 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.7 mt -47.32 -32.33 4.66 Favored 'General case' 0 C--N 1.302 -1.472 0 C-N-CA 119.688 -0.805 . . . . 0.0 109.435 179.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.7 mttm -115.66 -3.61 12.28 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.977 -1.077 . . . . 0.0 110.177 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.476 ' HB1' ' O ' ' A' ' 47' ' ' GLU . . . -100.58 -2.55 32.58 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.126 -0.984 . . . . 0.0 109.218 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.604 ' CG ' ' N ' ' A' ' 53' ' ' ALA . 0.0 OUTLIER -160.89 -164.97 1.28 Allowed 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.343 -0.848 . . . . 0.0 108.957 -179.614 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.604 ' N ' ' CG ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.49 1.542 0 O-C-N 121.11 -0.994 . . . . 0.0 109.277 -179.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' THR . . . . . 0.438 ' O ' ' CG2' ' A' ' 1' ' ' THR . 10.6 t . . . . . 0 N--CA 1.492 1.626 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.496 ' O ' HG13 ' A' ' 2' ' ' ILE . 1.1 tp -88.26 50.32 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.317 -0.864 . . . . 0.0 109.499 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -76.61 0.24 20.88 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.082 -1.011 . . . . 0.0 108.822 178.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -81.07 10.15 5.65 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.392 -0.817 . . . . 0.0 109.621 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.516 ' O ' ' N ' ' A' ' 7' ' ' LEU . 1.7 t90 -50.96 -46.38 61.13 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 121.223 -0.923 . . . . 0.0 111.28 -179.668 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.583 ' O ' ' CB ' ' A' ' 7' ' ' LEU . 46.6 mt -38.88 -25.8 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.318 -0.864 . . . . 0.0 110.998 -178.631 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.583 ' CB ' ' O ' ' A' ' 6' ' ' LEU . 1.0 OUTLIER 85.66 -134.72 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.665 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 -179.835 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.52 ' N ' HD21 ' A' ' 7' ' ' LEU . 6.1 mtpt 53.23 17.59 1.04 Allowed 'General case' 0 N--CA 1.488 1.451 0 O-C-N 120.522 -1.361 . . . . 0.0 109.298 -179.103 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.424 ' CG ' ' N ' ' A' ' 10' ' ' ALA . 4.5 p30 -95.85 -48.18 5.84 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 179.153 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.44 ' HB3' ' OD1' ' A' ' 42' ' ' ASN . . . -81.56 -11.82 59.01 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 178.041 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.528 ' HA ' ' CG2' ' A' ' 32' ' ' ILE . 1.3 ttpt -43.82 -64.22 0.7 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.459 -0.776 . . . . 0.0 110.926 -179.424 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -95.95 -22.83 17.16 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.895 -1.128 . . . . 0.0 111.18 -178.428 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -61.28 -28.78 69.43 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.794 -1.191 . . . . 0.0 109.876 -179.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.475 ' O ' HD21 ' A' ' 18' ' ' LEU . . . -96.65 -43.62 7.48 Favored 'General case' 0 C--N 1.301 -1.5 0 O-C-N 121.096 -1.003 . . . . 0.0 108.853 179.549 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.599 HG12 ' CD1' ' A' ' 29' ' ' PHE . 88.0 mt -54.31 -28.72 18.69 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 O-C-N 121.66 -0.65 . . . . 0.0 109.705 179.815 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.473 ' HA ' ' CE ' ' A' ' 19' ' ' LYS . . . -64.06 -37.51 87.71 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.42 -0.8 . . . . 0.0 109.639 -179.03 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -86.86 9.6 18.7 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.386 -0.822 . . . . 0.0 109.913 -179.48 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.555 ' HG ' ' CE ' ' A' ' 45' ' ' LYS . 0.5 OUTLIER -101.04 -47.93 4.59 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.249 -0.907 . . . . 0.0 109.627 -179.766 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.473 ' CE ' ' HA ' ' A' ' 16' ' ' ALA . 2.1 ptpt -59.43 -28.76 67.24 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.457 -0.777 . . . . 0.0 109.345 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.06 -16.79 23.5 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.41 -0.807 . . . . 0.0 108.966 179.664 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -69.09 -29.92 68.11 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.334 -0.854 . . . . 0.0 109.532 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 126.87 -12.76 6.85 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.768 -1.333 . . . . 0.0 109.768 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.58 HG22 ' CE1' ' A' ' 52' ' ' HIS . 0.2 OUTLIER -101.97 123.05 54.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.101 -1.235 . . . . 0.0 109.696 -179.792 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -122.89 28.62 7.16 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.3 -0.875 . . . . 0.0 108.986 179.468 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.98 177.81 2.48 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.363 -0.836 . . . . 0.0 109.64 -179.748 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.465 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 9.0 m-20 -122.22 0.78 9.62 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.26 -0.9 . . . . 0.0 109.659 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.591 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 2.3 t80 -81.15 -40.41 24.02 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.159 -0.963 . . . . 0.0 109.569 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.591 ' CE1' ' CD2' ' A' ' 27' ' ' PHE . 21.5 m-85 -78.34 -31.05 48.42 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.351 -0.843 . . . . 0.0 110.198 -179.008 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.599 ' CD1' HG12 ' A' ' 15' ' ' ILE . 6.7 m-30 -75.53 -49.24 19.27 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.282 -0.886 . . . . 0.0 109.924 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.465 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 0.4 OUTLIER -59.37 -25.65 64.42 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.156 -0.965 . . . . 0.0 110.175 -179.504 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -87.15 -16.18 36.19 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.97 -1.081 . . . . 0.0 110.44 -179.029 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.528 ' CG2' ' HA ' ' A' ' 11' ' ' LYS . 0.6 OUTLIER -64.8 -38.16 82.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.096 -1.002 . . . . 0.0 109.873 -179.596 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 45.9 p-10 -79.74 -8.65 59.37 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.023 -1.048 . . . . 0.0 110.348 -179.238 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.437 ' O ' ' C ' ' A' ' 35' ' ' ALA . 3.5 mtmt -99.64 -17.16 17.93 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.962 -1.086 . . . . 0.0 109.976 -179.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.505 ' CB ' HG21 ' A' ' 41' ' ' VAL . . . -43.14 154.54 0.07 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.23 -0.919 . . . . 0.0 109.554 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.493 ' HB2' ' HG3' ' A' ' 40' ' ' GLU . 0.1 OUTLIER -73.09 -59.49 2.68 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.077 -1.014 . . . . 0.0 109.634 -179.775 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.45 ' OG1' ' HG2' ' A' ' 39' ' ' GLU . 70.2 p -124.01 -167.0 1.57 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.09 -1.006 . . . . 0.0 109.754 -179.834 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.483 ' HA ' HG22 ' A' ' 41' ' ' VAL . 16.0 t -66.63 -52.09 49.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.406 -0.809 . . . . 0.0 109.587 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.531 ' O ' ' CB ' ' A' ' 43' ' ' ALA . 11.7 pt-20 -52.36 -26.51 12.55 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 179.597 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.493 ' HG3' ' HB2' ' A' ' 36' ' ' LYS . 27.6 mm-40 -80.45 -35.6 34.7 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.321 -0.862 . . . . 0.0 108.763 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.534 ' CG2' HD12 ' A' ' 7' ' ' LEU . 7.0 t -67.88 -66.88 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 179.051 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.44 ' OD1' ' HB3' ' A' ' 10' ' ' ALA . 76.1 m-20 -53.85 -28.6 36.9 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.565 -0.709 . . . . 0.0 109.375 179.391 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.531 ' CB ' ' O ' ' A' ' 39' ' ' GLU . . . -66.88 -46.18 75.77 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.287 -0.883 . . . . 0.0 109.605 -179.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.1 mt -57.85 -37.14 73.34 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.244 -0.91 . . . . 0.0 109.985 -179.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.555 ' CE ' ' HG ' ' A' ' 18' ' ' LEU . 0.2 OUTLIER -63.4 -34.01 76.79 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.087 -1.008 . . . . 0.0 109.5 -179.847 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 8.4 m-20 -77.77 -30.23 51.31 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.196 -0.94 . . . . 0.0 109.504 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -57.09 -23.33 46.14 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.338 -0.851 . . . . 0.0 109.165 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.58 HG12 ' CG ' ' A' ' 28' ' ' TYR . 41.4 mt -66.64 -45.7 87.78 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 179.518 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.2 mp -48.17 -36.78 14.22 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.178 -0.951 . . . . 0.0 108.558 179.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.6 mttt -90.53 -80.78 0.32 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.42 -0.8 . . . . 0.0 108.917 179.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.5 ' O ' ' HB3' ' A' ' 52' ' ' HIS . . . -54.81 151.57 8.32 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 178.809 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.587 ' CD2' ' HB1' ' A' ' 53' ' ' ALA . 0.5 OUTLIER 64.95 165.7 0.16 Allowed 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.658 -1.276 . . . . 0.0 107.784 -179.276 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.587 ' HB1' ' CD2' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 118.045 -0.979 . . . . 0.0 109.414 -179.559 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 1.5 t . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . 0.538 ' CG1' ' O ' ' A' ' 2' ' ' ILE . 0.9 OUTLIER -118.24 40.04 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.248 -0.908 . . . . 0.0 109.509 179.921 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -71.24 -5.1 29.49 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.141 -0.974 . . . . 0.0 108.782 179.078 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.49 ' O ' ' O ' ' A' ' 5' ' ' TRP . 2.1 mt-30 -81.08 -31.08 34.55 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.488 -0.758 . . . . 0.0 110.194 -179.661 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.49 ' O ' ' O ' ' A' ' 4' ' ' GLN . 6.3 t90 -46.58 -99.4 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.244 -0.91 . . . . 0.0 110.319 -179.073 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.437 ' C ' ' O ' ' A' ' 5' ' ' TRP . 5.0 mt 43.36 27.53 0.14 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.56 -1.338 . . . . 0.0 109.757 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.535 HD22 ' CG2' ' A' ' 41' ' ' VAL . 0.5 OUTLIER 42.56 59.85 2.6 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.322 -0.861 . . . . 0.0 109.693 -179.917 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -120.59 -3.8 9.82 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.065 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.53 ' ND2' ' N ' ' A' ' 9' ' ' ASN . 0.1 OUTLIER -59.6 -99.1 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.509 -0.744 . . . . 0.0 110.061 179.877 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.527 ' CB ' HG11 ' A' ' 38' ' ' VAL . . . -55.77 -16.82 4.87 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 120.979 -1.076 . . . . 0.0 109.619 -179.883 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.54 ' CG ' ' CG2' ' A' ' 32' ' ' ILE . 2.5 tttp -40.85 -35.47 0.51 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.196 -0.94 . . . . 0.0 110.241 -179.734 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -88.07 -32.6 18.65 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.109 -0.994 . . . . 0.0 110.038 -179.51 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.82 -56.23 21.57 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.154 -0.966 . . . . 0.0 109.399 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -62.68 -55.7 24.47 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.294 -0.879 . . . . 0.0 110.149 -179.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.565 HG22 ' CE1' ' A' ' 29' ' ' PHE . 73.0 mt -53.41 -30.85 18.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.151 -0.968 . . . . 0.0 109.48 -179.819 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.29 -38.73 88.44 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.457 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 2.4 pt-20 -83.57 1.88 39.94 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 109.111 -0.699 . . . . 0.0 109.111 179.634 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.528 ' CG ' ' HE3' ' A' ' 45' ' ' LYS . 1.1 tm? -97.86 -53.64 3.34 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.286 -0.884 . . . . 0.0 109.377 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.416 ' O ' ' HG2' ' A' ' 19' ' ' LYS . 5.7 ttmt -56.71 -18.2 11.6 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.32 -0.863 . . . . 0.0 109.294 -179.857 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.4 ttmt -96.16 -26.15 15.57 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.315 -0.865 . . . . 0.0 109.264 179.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.33 -49.74 75.18 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.257 -0.902 . . . . 0.0 109.557 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 138.86 -3.57 2.86 Favored Glycine 0 N--CA 1.49 2.236 0 C-N-CA 119.665 -1.255 . . . . 0.0 110.133 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.588 ' CG2' ' CE1' ' A' ' 52' ' ' HIS . 0.0 OUTLIER -100.18 149.26 6.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 120.867 -1.372 . . . . 0.0 109.574 179.846 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -133.23 11.58 4.19 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.432 -0.792 . . . . 0.0 109.234 179.755 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.34 139.88 58.53 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.234 -0.916 . . . . 0.0 109.447 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.401 ' N ' ' OD1' ' A' ' 26' ' ' ASP . 1.3 m-20 -87.64 6.07 36.45 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.313 -0.867 . . . . 0.0 109.784 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.688 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 8.3 t80 -80.26 -17.23 52.78 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.119 -0.988 . . . . 0.0 109.321 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.688 ' CE1' ' CD2' ' A' ' 27' ' ' PHE . 18.1 m-85 -101.36 -28.46 12.59 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.226 -0.921 . . . . 0.0 109.12 179.687 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.565 ' CE1' HG22 ' A' ' 15' ' ' ILE . 9.5 m-85 -83.07 -47.05 12.08 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.474 -0.766 . . . . 0.0 109.193 179.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 40.7 m-20 -60.78 -36.63 79.48 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.479 -0.763 . . . . 0.0 109.406 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.6 -13.7 59.84 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.342 -0.849 . . . . 0.0 109.691 -179.55 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.54 ' CG2' ' CG ' ' A' ' 11' ' ' LYS . 4.3 mt -68.01 -48.61 73.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.268 -0.895 . . . . 0.0 109.351 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.526 ' HB2' ' CE ' ' A' ' 11' ' ' LYS . 8.4 t30 -64.92 -22.53 67.01 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.218 -0.926 . . . . 0.0 109.624 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.473 ' O ' ' O ' ' A' ' 35' ' ' ALA . 5.7 mptp? -96.54 -14.71 22.07 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.178 -0.951 . . . . 0.0 109.744 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.473 ' O ' ' O ' ' A' ' 34' ' ' LYS . . . -43.61 168.68 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.315 -0.865 . . . . 0.0 109.795 -179.67 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.7 tttm -77.3 -78.73 0.12 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.211 -0.931 . . . . 0.0 109.582 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.466 ' O ' ' CG2' ' A' ' 41' ' ' VAL . 14.8 t -121.54 -174.34 2.84 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.233 -0.917 . . . . 0.0 108.868 179.787 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.527 HG11 ' CB ' ' A' ' 10' ' ' ALA . 24.9 t -59.79 -57.31 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.105 -0.997 . . . . 0.0 109.436 179.828 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.556 ' O ' ' CB ' ' A' ' 43' ' ' ALA . 73.2 mm-40 -51.37 -19.51 1.36 Allowed 'General case' 0 C--N 1.295 -1.797 0 O-C-N 120.974 -1.079 . . . . 0.0 109.414 -179.639 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.473 ' OE1' ' HA ' ' A' ' 40' ' ' GLU . 4.6 tp10 -90.5 -33.24 16.02 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.924 -1.11 . . . . 0.0 109.181 179.596 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.535 ' CG2' HD22 ' A' ' 7' ' ' LEU . 2.2 t -76.7 -66.27 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.456 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 178.372 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.407 ' OD1' ' C ' ' A' ' 42' ' ' ASN . 0.0 OUTLIER -46.94 -40.73 14.82 Favored 'General case' 0 C--N 1.296 -1.738 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.19 178.317 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.556 ' CB ' ' O ' ' A' ' 39' ' ' GLU . . . -68.49 -37.37 80.05 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.263 -0.898 . . . . 0.0 109.748 179.884 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.494 ' CD1' ' C ' ' A' ' 44' ' ' LEU . 0.3 OUTLIER -65.28 -30.56 71.44 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.152 -0.967 . . . . 0.0 109.051 -179.916 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.534 ' CE ' HD13 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -63.39 -43.94 96.13 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.179 -0.95 . . . . 0.0 109.181 179.641 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -75.76 -13.93 60.31 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.426 -0.796 . . . . 0.0 109.537 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.46 ' O ' ' HB1' ' A' ' 51' ' ' ALA . 4.4 mm-40 -79.7 -28.33 40.64 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.29 -0.881 . . . . 0.0 109.716 -179.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.581 HG12 ' CG ' ' A' ' 28' ' ' TYR . 14.4 mt -56.15 -41.61 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.115 -0.991 . . . . 0.0 108.725 179.429 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 89.7 mt -45.24 -36.1 3.74 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.31 -0.869 . . . . 0.0 109.978 179.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.4 mttt -117.68 2.17 12.27 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.985 -1.072 . . . . 0.0 110.789 -179.361 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.46 ' HB1' ' O ' ' A' ' 47' ' ' GLU . . . -100.83 -7.74 23.29 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.98 -1.075 . . . . 0.0 109.503 179.79 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.588 ' CE1' ' CG2' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -145.13 8.74 1.23 Allowed 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.153 -0.967 . . . . 0.0 110.232 -178.822 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.522 0 CA-C-O 117.95 -1.024 . . . . 0.0 109.449 -179.94 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 14.8 t . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 121.301 0.572 . . . . 0.0 109.548 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -103.64 48.91 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.366 0 O-C-N 121.232 -0.918 . . . . 0.0 109.698 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -67.58 -7.45 26.35 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 178.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.426 ' O ' ' O ' ' A' ' 5' ' ' TRP . 5.7 mp0 -54.6 -16.68 2.59 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.405 -0.809 . . . . 0.0 109.658 179.844 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' TRP . . . . . 0.453 ' O ' ' C ' ' A' ' 6' ' ' LEU . 0.0 OUTLIER -64.11 -123.02 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 179.407 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.463 ' O ' ' C ' ' A' ' 7' ' ' LEU . 93.6 mt 39.08 36.84 0.19 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.933 -1.104 . . . . 0.0 110.104 179.221 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.542 ' O ' ' CG ' ' A' ' 8' ' ' LYS . 4.8 tt -38.42 115.94 0.5 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.579 -0.701 . . . . 0.0 109.87 -179.752 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.542 ' CG ' ' O ' ' A' ' 7' ' ' LEU . 10.6 mttp -168.07 -34.01 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.488 -0.758 . . . . 0.0 109.481 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.57 ' ND2' ' N ' ' A' ' 9' ' ' ASN . 0.1 OUTLIER -36.08 -93.48 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.555 -0.715 . . . . 0.0 110.995 -179.969 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.459 ' O ' ' C ' ' A' ' 11' ' ' LYS . . . -54.93 -13.2 1.01 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.181 -0.949 . . . . 0.0 111.037 -179.076 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.533 ' CB ' ' O ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -36.9 -43.01 0.42 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.231 -0.918 . . . . 0.0 110.982 -179.407 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -100.63 -21.07 15.37 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.888 -1.132 . . . . 0.0 110.28 -179.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -69.21 -15.95 63.5 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.044 -1.035 . . . . 0.0 109.454 -179.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -105.75 -40.61 5.68 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.346 -0.846 . . . . 0.0 108.927 179.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.585 ' CG2' ' CZ ' ' A' ' 29' ' ' PHE . 55.2 mt -62.81 -28.6 45.27 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 O-C-N 121.494 -0.754 . . . . 0.0 109.17 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.5 -22.67 22.1 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.404 -0.81 . . . . 0.0 109.675 -179.466 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -85.26 -28.06 25.6 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.377 -0.827 . . . . 0.0 110.343 -179.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.524 ' CD1' ' HE2' ' A' ' 45' ' ' LYS . 2.2 mt -84.25 -32.33 24.51 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.14 -0.975 . . . . 0.0 110.693 -178.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -56.5 -21.64 27.36 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 120.97 -1.081 . . . . 0.0 109.736 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 6.5 tttm -100.9 -29.46 12.2 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.21 -0.931 . . . . 0.0 110.038 -179.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -69.14 -33.32 73.25 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.136 -0.978 . . . . 0.0 109.741 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 124.81 -26.58 5.62 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.356 -1.497 . . . . 0.0 109.356 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . 0.558 HG12 ' CE1' ' A' ' 52' ' ' HIS . 62.0 mt -66.2 106.44 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.368 -1.077 . . . . 0.0 109.393 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 9.6 p -128.99 17.67 6.15 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.085 -1.009 . . . . 0.0 109.56 -179.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 65.6 m -65.62 152.63 43.69 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.255 -0.903 . . . . 0.0 109.242 179.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.458 ' O ' ' CB ' ' A' ' 30' ' ' ASN . 7.9 m-20 -87.21 -3.08 59.03 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.189 -0.944 . . . . 0.0 109.787 -179.765 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.722 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 18.0 t80 -80.08 -7.5 58.91 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.155 -0.966 . . . . 0.0 109.269 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.722 ' CE1' ' CE2' ' A' ' 27' ' ' PHE . 37.8 m-85 -118.49 -34.78 3.92 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 179.308 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' PHE . . . . . 0.585 ' CZ ' ' CG2' ' A' ' 15' ' ' ILE . 6.1 m-30 -78.58 -40.9 33.37 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 178.838 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.458 ' CB ' ' O ' ' A' ' 26' ' ' ASP . 19.8 t30 -68.62 -49.61 57.87 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.465 -0.772 . . . . 0.0 108.966 179.527 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.06 -12.85 62.06 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.495 -0.753 . . . . 0.0 109.603 -179.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ILE . . . . . 0.478 ' CD1' ' O ' ' A' ' 28' ' ' TYR . 0.7 OUTLIER -73.7 -50.52 29.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.262 -0.899 . . . . 0.0 108.961 179.839 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . 0.489 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 17.2 p30 -79.7 -10.93 59.86 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.242 -0.911 . . . . 0.0 109.366 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.479 ' O ' ' O ' ' A' ' 35' ' ' ALA . 7.8 mmtt -91.29 -14.83 30.13 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.344 -0.848 . . . . 0.0 109.654 -179.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.479 ' O ' ' O ' ' A' ' 34' ' ' LYS . . . -55.09 -160.74 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.527 -0.733 . . . . 0.0 110.198 -179.517 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.42 ' C ' HD11 ' A' ' 7' ' ' LEU . 27.8 mmtp -101.79 -62.87 1.2 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.103 -0.998 . . . . 0.0 110.401 -179.293 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.496 ' O ' HG21 ' A' ' 41' ' ' VAL . 66.6 p -125.86 178.02 5.97 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.945 -1.097 . . . . 0.0 110.082 -179.415 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.411 HG11 ' HB2' ' A' ' 10' ' ' ALA . 88.6 t -61.39 -34.46 61.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.331 -0.856 . . . . 0.0 109.331 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.13 -27.39 69.05 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 178.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -79.58 -31.27 41.83 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.662 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.536 ' CG2' HD23 ' A' ' 7' ' ' LEU . 18.6 t -68.32 -67.53 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 178.796 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -49.56 -39.37 34.61 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.429 -0.794 . . . . 0.0 109.468 179.496 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.9 -38.96 93.01 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.294 -0.879 . . . . 0.0 109.619 -179.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.469 ' O ' HD13 ' A' ' 48' ' ' ILE . 7.6 mt -66.85 -46.61 74.54 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.282 -0.887 . . . . 0.0 110.258 -179.531 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.529 ' HA ' ' CD1' ' A' ' 48' ' ' ILE . 0.2 OUTLIER -65.61 -19.65 66.0 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.037 -1.04 . . . . 0.0 110.23 -179.243 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -79.84 -18.23 51.29 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.054 -1.029 . . . . 0.0 109.566 -179.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.539 ' O ' ' CB ' ' A' ' 51' ' ' ALA . 55.7 tt0 -90.76 -17.74 26.14 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.186 -0.946 . . . . 0.0 109.172 179.669 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.677 ' CG1' ' CD1' ' A' ' 28' ' ' TYR . 1.4 mt -68.6 -35.43 70.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.252 -0.905 . . . . 0.0 108.91 179.478 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 14.5 tp -56.4 -30.05 62.29 Favored 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.162 -0.961 . . . . 0.0 109.324 179.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.412 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -122.28 5.87 9.68 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.197 -0.939 . . . . 0.0 109.889 -179.894 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . 0.539 ' CB ' ' O ' ' A' ' 47' ' ' GLU . . . -101.39 -46.62 4.95 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.092 -1.005 . . . . 0.0 109.466 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.572 ' CD2' HG22 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -112.66 -19.5 12.03 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.447 -0.783 . . . . 0.0 109.661 -178.975 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.486 ' N ' ' CD2' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.489 1.512 0 CA-C-O 118.012 -0.994 . . . . 0.0 109.42 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.8 p30 . . . . . 0 N--CA 1.493 1.686 0 CA-C-O 121.012 0.434 . . . . 0.0 109.87 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.455 ' HB3' HG21 ' A' ' 41' ' ' VAL . . . -80.43 -15.37 56.95 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.1 -1.0 . . . . 0.0 109.501 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.608 ' O ' HD12 ' A' ' 15' ' ' ILE . 0.1 OUTLIER -63.44 -32.6 74.09 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.271 -0.893 . . . . 0.0 109.91 -179.44 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.474 ' HG2' ' CE ' ' A' ' 11' ' ' LYS . 3.8 mm-40 -92.36 -44.12 8.88 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.865 -1.147 . . . . 0.0 109.627 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -65.94 -18.71 65.52 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.132 -0.98 . . . . 0.0 109.696 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.53 ' HB1' HD11 ' A' ' 18' ' ' LEU . . . -99.0 -43.83 6.54 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.313 -0.867 . . . . 0.0 109.262 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.608 HD12 ' O ' ' A' ' 11' ' ' LYS . 58.6 mt -62.83 -29.04 46.14 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.529 0 O-C-N 121.491 -0.756 . . . . 0.0 109.371 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.04 -15.55 63.65 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.499 -0.75 . . . . 0.0 110.342 -178.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.46 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 32.7 tt0 -116.98 -14.41 10.62 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.074 -1.016 . . . . 0.0 109.857 -179.691 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.623 HD22 ' HG2' ' A' ' 45' ' ' LYS . 5.7 mt -90.21 -33.0 16.35 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.111 -0.993 . . . . 0.0 109.459 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.1 ptmm? -56.84 -19.54 17.98 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.14 -0.975 . . . . 0.0 108.702 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -86.95 -31.22 20.76 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.466 -0.771 . . . . 0.0 108.973 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.65 -20.25 7.76 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.387 -0.821 . . . . 0.0 109.389 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 116.14 -39.16 2.8 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.42 -1.472 . . . . 0.0 109.42 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.965 HD13 HG21 ' A' ' 48' ' ' ILE . 13.0 mt -54.03 107.89 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.224 -1.162 . . . . 0.0 109.332 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -115.2 7.51 15.32 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.259 -0.901 . . . . 0.0 109.629 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.3 t -59.95 152.98 22.29 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.15 -0.969 . . . . 0.0 109.265 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.498 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 9.4 p-10 -100.46 -9.13 22.45 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.238 -0.914 . . . . 0.0 109.578 -179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.538 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 15.1 t80 -74.83 -24.45 58.61 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.078 -1.014 . . . . 0.0 109.583 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.639 ' CG ' ' CG1' ' A' ' 48' ' ' ILE . 23.6 m-85 -94.95 -42.39 8.68 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.217 -0.927 . . . . 0.0 109.171 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.579 ' CD1' HG12 ' A' ' 15' ' ' ILE . 5.3 m-85 -62.81 -45.87 90.59 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 121.54 -0.725 . . . . 0.0 109.734 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.498 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 0.4 OUTLIER -65.78 -39.55 91.1 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.13 -0.981 . . . . 0.0 109.626 -179.844 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.6 -10.73 60.21 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.206 -0.934 . . . . 0.0 109.519 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.541 HD11 ' CD ' ' A' ' 45' ' ' LYS . 0.3 OUTLIER -65.94 -24.36 33.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.399 -0.813 . . . . 0.0 109.071 -179.869 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.8 m-20 -80.51 -37.61 31.31 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.315 -0.865 . . . . 0.0 109.764 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -57.88 -20.44 36.8 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.259 -0.901 . . . . 0.0 109.438 -179.824 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.72 ' HB3' HG22 ' A' ' 41' ' ' VAL . . . -47.13 155.93 0.26 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.248 -0.908 . . . . 0.0 109.343 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.494 ' CD ' ' N ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -90.94 -55.3 3.61 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.323 -0.861 . . . . 0.0 109.382 -179.967 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.625 HG23 ' H ' ' A' ' 39' ' ' GLU . 13.7 t -125.02 -175.79 3.39 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.244 -0.91 . . . . 0.0 109.466 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 95.9 t -63.21 -30.32 49.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.049 -1.032 . . . . 0.0 109.267 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.807 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 1.9 tt0 -72.14 -21.7 61.42 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 179.456 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.591 ' HG2' HG22 ' A' ' 37' ' ' THR . 37.6 mm-40 -86.48 -31.09 21.52 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.39 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.72 HG22 ' HB3' ' A' ' 35' ' ' ALA . 24.5 t -72.72 -56.68 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 179.108 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -62.86 -27.93 69.68 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 178.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.807 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -66.87 -46.74 74.01 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.485 -0.76 . . . . 0.0 109.448 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.706 ' O ' HD12 ' A' ' 48' ' ' ILE . 2.1 mt -59.2 -35.15 73.1 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.233 -0.917 . . . . 0.0 108.87 179.748 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.714 ' HA ' HD13 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -62.0 -40.48 95.8 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.321 -0.862 . . . . 0.0 108.973 179.494 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.481 ' O ' ' HB2' ' A' ' 49' ' ' LEU . 75.1 m-20 -65.9 -20.69 66.31 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.315 -0.865 . . . . 0.0 109.04 179.691 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.07 -36.31 61.77 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.298 -0.876 . . . . 0.0 109.659 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.965 HG21 HD13 ' A' ' 23' ' ' ILE . 3.7 mp -58.47 -27.41 33.39 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 O-C-N 120.959 -1.088 . . . . 0.0 108.376 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.481 ' HB2' ' O ' ' A' ' 46' ' ' ASN . 2.5 mm? -56.07 -39.0 71.42 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.435 -0.79 . . . . 0.0 109.072 179.189 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.429 ' O ' ' C ' ' A' ' 51' ' ' ALA . 0.0 OUTLIER -109.63 -62.24 1.53 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.212 -0.93 . . . . 0.0 109.818 -179.401 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.429 ' C ' ' O ' ' A' ' 50' ' ' LYS . . . -41.23 -37.81 1.01 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.295 -0.878 . . . . 0.0 109.966 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.713 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 0.0 OUTLIER -115.62 129.07 56.37 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.349 -0.845 . . . . 0.0 109.083 -179.547 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.713 ' HB3' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 118.068 -0.968 . . . . 0.0 109.307 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.658 ' OD1' HG22 ' A' ' 38' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.51 -6.92 58.92 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 178.163 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.418 ' HE2' ' CG ' ' A' ' 33' ' ' ASN . 13.6 tttm -61.31 -35.71 78.11 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 121.614 -0.678 . . . . 0.0 109.985 -179.666 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -89.25 -51.3 5.64 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.05 -1.031 . . . . 0.0 109.115 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -53.97 -21.72 8.72 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.566 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -89.51 -59.16 2.28 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 121.558 -0.714 . . . . 0.0 109.14 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.497 ' HA ' ' HG ' ' A' ' 18' ' ' LEU . 0.2 OUTLIER -41.09 -36.98 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 O-C-N 121.52 -0.737 . . . . 0.0 109.392 179.978 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.22 -48.68 77.26 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.587 ' C ' HD23 ' A' ' 18' ' ' LEU . 3.7 mm-40 -73.27 -12.68 60.94 Favored 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.834 -0.541 . . . . 0.0 110.79 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.838 HD23 ' N ' ' A' ' 18' ' ' LEU . 1.0 OUTLIER -88.43 -32.56 18.24 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.637 -1.29 . . . . 0.0 109.694 -179.307 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.29 -17.11 62.48 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.185 -0.947 . . . . 0.0 109.339 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.431 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 1.0 OUTLIER -96.55 -22.36 17.12 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.232 -0.918 . . . . 0.0 109.548 -179.873 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.17 -26.68 66.77 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.218 -0.926 . . . . 0.0 109.411 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 112.66 -23.78 14.52 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.48 HD12 ' NZ ' ' A' ' 45' ' ' LYS . 31.7 mt -75.09 92.57 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.288 -1.125 . . . . 0.0 109.735 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.1 p -95.66 5.5 51.28 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.126 -0.984 . . . . 0.0 109.127 179.366 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.7 t -57.18 138.34 54.75 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.318 -0.864 . . . . 0.0 109.025 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.472 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 5.0 m-20 -91.78 -5.77 52.93 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.218 -0.927 . . . . 0.0 109.816 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.653 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 2.1 t80 -74.09 -16.27 61.03 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.129 -0.982 . . . . 0.0 108.591 179.702 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.989 ' CE2' HG23 ' A' ' 48' ' ' ILE . 21.7 m-85 -103.99 -50.15 3.45 Favored 'General case' 0 C--N 1.298 -1.667 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 179.4 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.65 ' CZ ' ' CB ' ' A' ' 18' ' ' LEU . 3.1 m-85 -55.89 -45.35 78.64 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.472 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 8.3 m120 -60.82 -43.97 97.51 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.251 -0.906 . . . . 0.0 109.091 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.67 -13.75 61.04 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.441 -0.787 . . . . 0.0 109.626 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.605 ' HA ' HD13 ' A' ' 44' ' ' LEU . 4.5 mt -71.15 -40.32 74.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.297 -0.877 . . . . 0.0 108.898 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.418 ' CG ' ' HE2' ' A' ' 11' ' ' LYS . 0.9 OUTLIER -76.5 -19.62 57.8 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.205 -0.934 . . . . 0.0 109.317 179.787 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.462 ' O ' ' O ' ' A' ' 35' ' ' ALA . 2.5 mtpt -75.33 -15.66 60.47 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.391 -0.818 . . . . 0.0 109.61 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.851 ' HB1' ' HB3' ' A' ' 40' ' ' GLU . . . -40.39 162.64 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.461 -0.774 . . . . 0.0 109.882 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.402 ' O ' HG23 ' A' ' 37' ' ' THR . 3.4 tttm -101.89 -19.86 15.1 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.424 -0.797 . . . . 0.0 109.021 179.66 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.81 ' O ' HG23 ' A' ' 41' ' ' VAL . 11.2 p -153.2 -179.76 8.0 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.446 -0.784 . . . . 0.0 109.04 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.658 HG22 ' OD1' ' A' ' 9' ' ' ASN . 18.7 t -65.04 -38.48 82.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.1 -1.0 . . . . 0.0 108.912 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.714 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 29.2 mt-10 -64.68 -28.49 69.64 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.254 -0.904 . . . . 0.0 108.782 179.332 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.851 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 0.3 OUTLIER -79.48 -31.18 42.29 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 179.485 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.81 HG23 ' O ' ' A' ' 37' ' ' THR . 12.5 t -70.49 -65.26 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 178.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -55.7 -33.34 64.11 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.596 -0.69 . . . . 0.0 109.34 179.274 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.714 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -61.2 -42.25 98.26 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.321 -0.862 . . . . 0.0 109.242 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.605 HD13 ' HA ' ' A' ' 32' ' ' ILE . 0.4 OUTLIER -57.74 -50.18 74.08 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.225 -0.922 . . . . 0.0 110.04 -179.62 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.736 ' CE ' HD22 ' A' ' 18' ' ' LEU . 10.4 tptp -50.02 -29.67 9.16 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.041 -1.037 . . . . 0.0 110.499 -179.367 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 36.5 m-20 -80.02 -46.79 15.98 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.026 -1.046 . . . . 0.0 110.21 -179.236 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -54.52 -28.4 45.04 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.086 -1.009 . . . . 0.0 110.01 -179.361 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.989 HG23 ' CE2' ' A' ' 28' ' ' TYR . 21.1 mt -60.37 -44.38 95.88 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 O-C-N 121.016 -1.052 . . . . 0.0 109.237 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.908 ' HA ' ' HB3' ' A' ' 53' ' ' ALA . 1.0 OUTLIER -56.23 -19.06 12.27 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.536 -0.727 . . . . 0.0 110.449 -179.411 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.1 -58.41 1.89 Allowed 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.801 -1.187 . . . . 0.0 110.774 -179.102 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.497 ' O ' ' CB ' ' A' ' 52' ' ' HIS . . . -82.67 46.45 1.08 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.315 -0.865 . . . . 0.0 110.293 -179.014 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.543 ' CG ' ' N ' ' A' ' 53' ' ' ALA . 3.7 t-80 170.22 -81.83 0.0 OUTLIER 'General case' 0 C--N 1.302 -1.488 0 O-C-N 120.83 -1.169 . . . . 0.0 109.476 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.908 ' HB3' ' HA ' ' A' ' 49' ' ' LEU . . . . . . . . 0 N--CA 1.489 1.524 0 CA-C-O 118.01 -0.995 . . . . 0.0 109.456 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.547 ' OD1' HG22 ' A' ' 38' ' ' VAL . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.615 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.561 ' HB3' HG11 ' A' ' 41' ' ' VAL . . . -79.67 4.59 15.64 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.302 -0.874 . . . . 0.0 109.212 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.532 ' O ' ' CG1' ' A' ' 15' ' ' ILE . 0.5 OUTLIER -52.44 -91.81 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.252 -0.905 . . . . 0.0 110.546 -179.407 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -67.26 -22.93 65.65 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.999 -1.063 . . . . 0.0 111.06 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -62.07 -63.51 1.23 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.763 -1.21 . . . . 0.0 109.508 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.526 ' HB1' ' HZ2' ' A' ' 45' ' ' LYS . . . -73.25 -47.97 38.69 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.179 -0.95 . . . . 0.0 109.12 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.991 HG23 ' CE1' ' A' ' 29' ' ' PHE . 70.5 mt -47.1 -30.47 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.491 -0.756 . . . . 0.0 109.756 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.47 -52.21 59.09 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.468 -0.77 . . . . 0.0 109.856 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -49.9 -32.15 13.89 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.246 -0.909 . . . . 0.0 110.123 -179.679 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.627 HD12 ' N ' ' A' ' 18' ' ' LEU . 10.0 mp -90.37 -24.94 20.66 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.43 -0.794 . . . . 0.0 110.263 -178.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.2 tttt -64.03 -22.3 66.87 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.339 -0.85 . . . . 0.0 110.02 -179.466 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.42 -13.21 41.03 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.204 -0.935 . . . . 0.0 109.625 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -81.66 -4.12 55.32 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.225 -0.922 . . . . 0.0 109.589 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.06 -41.8 2.2 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.802 -1.319 . . . . 0.0 109.802 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.73 HG21 HG21 ' A' ' 48' ' ' ILE . 59.7 mt -47.04 117.55 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.163 -1.198 . . . . 0.0 109.666 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.73 17.91 5.2 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.306 -0.872 . . . . 0.0 109.508 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.427 ' HB3' ' CD2' ' A' ' 28' ' ' TYR . 3.0 t -54.97 127.67 29.94 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.108 -0.995 . . . . 0.0 109.038 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.558 ' O ' ' CB ' ' A' ' 30' ' ' ASN . 17.4 p-10 -72.15 -13.39 61.54 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.187 -0.946 . . . . 0.0 109.878 -179.394 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.531 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 18.9 t80 -81.44 -3.2 52.24 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 120.479 -1.388 . . . . 0.0 108.901 179.368 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.906 ' CD2' HG23 ' A' ' 48' ' ' ILE . 21.4 m-30 -111.48 -29.88 7.6 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.991 ' CE1' HG23 ' A' ' 15' ' ' ILE . 3.9 m-30 -103.23 -43.75 5.37 Favored 'General case' 0 C--N 1.295 -1.763 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.558 ' CB ' ' O ' ' A' ' 26' ' ' ASP . 3.1 t-20 -68.33 -26.94 65.86 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 108.45 -0.945 . . . . 0.0 108.45 179.127 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -88.55 4.43 46.85 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.53 -0.731 . . . . 0.0 109.68 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.919 HD12 HG13 ' A' ' 41' ' ' VAL . 0.7 OUTLIER -84.73 -20.79 8.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.169 -0.957 . . . . 0.0 109.104 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.513 ' HB2' ' CE ' ' A' ' 11' ' ' LYS . 0.7 OUTLIER -76.5 -23.48 53.74 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.127 -0.983 . . . . 0.0 109.004 179.387 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.453 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.4 OUTLIER -80.21 -18.44 49.53 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.396 -0.815 . . . . 0.0 109.313 179.716 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.453 ' O ' ' O ' ' A' ' 34' ' ' LYS . . . -44.54 168.99 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.342 -0.849 . . . . 0.0 109.807 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 45.0 mttp -106.27 -69.85 0.81 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.425 -0.797 . . . . 0.0 109.248 179.856 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 8.8 t -108.38 179.0 4.33 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.277 -0.889 . . . . 0.0 108.877 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.547 HG22 ' OD1' ' A' ' 9' ' ' ASN . 25.5 t -59.35 -44.92 93.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 O-C-N 120.956 -1.09 . . . . 0.0 108.942 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.705 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 0.5 OUTLIER -56.32 -27.01 54.32 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 179.449 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -78.89 -33.74 45.38 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 179.069 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.919 HG13 HD12 ' A' ' 32' ' ' ILE . 90.7 t -71.09 -73.4 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.389 0 N-CA-C 107.937 -1.135 . . . . 0.0 107.937 178.706 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.518 ' OD1' HG12 ' A' ' 38' ' ' VAL . 18.5 m120 -44.26 -28.19 0.5 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.553 -0.717 . . . . 0.0 109.328 179.15 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.705 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -68.55 -52.78 28.18 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.155 -0.966 . . . . 0.0 109.291 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.1 mt -60.12 -34.79 74.0 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.369 -0.832 . . . . 0.0 110.295 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.625 ' HE3' ' CA ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -77.17 -27.25 53.68 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.063 -1.023 . . . . 0.0 109.271 -179.777 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -80.47 -22.42 41.06 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.266 -0.897 . . . . 0.0 108.84 179.342 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.734 ' O ' ' HB3' ' A' ' 51' ' ' ALA . 0.6 OUTLIER -78.18 1.31 21.8 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.466 -0.771 . . . . 0.0 109.037 179.456 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.906 HG23 ' CD2' ' A' ' 28' ' ' TYR . 42.2 mt -80.6 -46.66 21.24 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 O-C-N 121.176 -0.953 . . . . 0.0 108.783 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.54 -30.18 68.43 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.652 -0.655 . . . . 0.0 109.944 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.7 mmtt -100.06 -62.61 1.22 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.108 -0.995 . . . . 0.0 109.751 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.734 ' HB3' ' O ' ' A' ' 47' ' ' GLU . . . -51.05 -21.68 1.97 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.214 -0.929 . . . . 0.0 109.031 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.684 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 1.4 t-80 -148.72 170.94 17.05 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 -179.739 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.684 ' HB3' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 118.044 -0.979 . . . . 0.0 109.445 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.501 ' O ' ' CB ' ' A' ' 13' ' ' ASP . 5.9 p-10 . . . . . 0 N--CA 1.486 1.336 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.852 ' O ' ' HB3' ' A' ' 14' ' ' ALA . . . -81.02 -14.19 58.14 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.422 -0.799 . . . . 0.0 108.949 179.099 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.898 ' HA ' HG21 ' A' ' 32' ' ' ILE . 0.7 OUTLIER -48.36 -68.22 0.2 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.045 -1.034 . . . . 0.0 109.863 -179.823 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -98.9 -23.12 15.46 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.993 -1.067 . . . . 0.0 109.804 -179.733 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.501 ' CB ' ' O ' ' A' ' 9' ' ' ASN . 4.1 t0 -75.7 -19.21 59.28 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.162 -0.961 . . . . 0.0 109.02 179.768 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.852 ' HB3' ' O ' ' A' ' 10' ' ' ALA . . . -102.27 -44.31 5.45 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.64 HD12 ' O ' ' A' ' 11' ' ' LYS . 59.6 mt -54.99 -29.08 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 121.381 -0.824 . . . . 0.0 109.066 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.64 -37.09 84.98 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.502 -0.749 . . . . 0.0 109.364 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -88.22 -16.18 33.95 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.459 -0.776 . . . . 0.0 110.291 -179.41 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.731 HD22 ' CD ' ' A' ' 45' ' ' LYS . 47.6 mt -83.66 -32.32 25.69 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.041 -1.037 . . . . 0.0 109.745 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.4 mtmt -65.06 -35.58 81.6 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.056 -1.027 . . . . 0.0 109.319 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.08 -10.51 56.79 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.419 -0.8 . . . . 0.0 109.248 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.14 -42.49 98.64 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.254 -0.904 . . . . 0.0 109.261 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 141.74 -13.58 2.67 Favored Glycine 0 N--CA 1.491 2.353 0 N-CA-C 109.67 -1.372 . . . . 0.0 109.67 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.824 HD13 HG21 ' A' ' 48' ' ' ILE . 3.5 mt -105.53 146.39 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.108 -1.23 . . . . 0.0 109.85 -179.713 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.1 p -135.38 15.49 3.45 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 179.221 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.5 m -59.43 -168.51 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.424 -0.797 . . . . 0.0 109.475 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.518 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 0.3 OUTLIER -126.37 -16.05 5.5 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.222 -0.924 . . . . 0.0 109.862 -179.932 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.638 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 4.2 t80 -80.26 -9.07 59.72 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 120.635 -1.291 . . . . 0.0 109.038 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.696 ' CG ' HG12 ' A' ' 48' ' ' ILE . 17.8 m-85 -102.67 -23.97 13.79 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.342 -0.849 . . . . 0.0 108.837 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.486 ' CE2' ' HB2' ' A' ' 18' ' ' LEU . 80.3 m-85 -96.47 -51.95 4.15 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-O 121.149 0.5 . . . . 0.0 109.759 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.518 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 1.6 m-80 -63.66 -19.3 64.78 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.196 -0.94 . . . . 0.0 109.618 179.857 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -87.82 16.3 5.99 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.239 -0.913 . . . . 0.0 109.086 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.898 HG21 ' HA ' ' A' ' 11' ' ' LYS . 8.6 mm -76.21 -65.77 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 121.547 -0.721 . . . . 0.0 109.373 -179.826 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -51.28 -26.17 6.91 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.223 -0.923 . . . . 0.0 109.083 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.435 ' O ' ' C ' ' A' ' 35' ' ' ALA . 0.4 OUTLIER -62.3 -44.71 95.89 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.4 -0.812 . . . . 0.0 109.467 179.924 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.697 ' HB3' HG22 ' A' ' 41' ' ' VAL . . . -42.65 146.73 0.34 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.344 -0.847 . . . . 0.0 109.587 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.422 ' HG3' ' OE2' ' A' ' 40' ' ' GLU . 26.8 mttm -69.44 -64.65 0.84 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.272 -0.893 . . . . 0.0 109.825 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.812 ' O ' HG23 ' A' ' 41' ' ' VAL . 1.2 p -118.82 -163.56 0.97 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.121 -0.987 . . . . 0.0 109.48 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.429 HG13 HD22 ' A' ' 9' ' ' ASN . 18.0 t -68.61 -55.36 16.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.251 -0.905 . . . . 0.0 109.741 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.779 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 14.2 pt-20 -50.48 -23.16 2.28 Favored 'General case' 0 C--N 1.295 -1.778 0 O-C-N 121.058 -1.027 . . . . 0.0 108.542 179.592 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.422 ' OE2' ' HG3' ' A' ' 36' ' ' LYS . 1.4 mm-40 -83.1 -38.34 22.6 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.434 -0.791 . . . . 0.0 109.02 179.159 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.812 HG23 ' O ' ' A' ' 37' ' ' THR . 11.7 t -63.54 -58.87 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 179.263 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -62.52 -29.78 70.81 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.362 -0.836 . . . . 0.0 108.893 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.779 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -65.72 -33.41 75.81 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.413 -0.804 . . . . 0.0 109.642 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.72 HD12 ' C ' ' A' ' 44' ' ' LEU . 0.3 OUTLIER -61.07 -39.44 89.87 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.174 -0.954 . . . . 0.0 109.519 -179.752 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.786 ' HE3' HD12 ' A' ' 23' ' ' ILE . 30.5 tptt -66.61 -18.59 65.45 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.127 -0.983 . . . . 0.0 109.475 -179.874 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.464 ' HB2' ' O ' ' A' ' 43' ' ' ALA . 7.9 m120 -73.41 -40.02 64.6 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.203 -0.936 . . . . 0.0 109.232 179.846 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.536 ' O ' ' CB ' ' A' ' 51' ' ' ALA . 39.1 mt-10 -62.65 -27.07 68.97 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.273 -0.892 . . . . 0.0 109.308 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.824 HG21 HD13 ' A' ' 23' ' ' ILE . 2.5 mp -70.73 -29.81 39.44 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 179.35 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.427 ' HB2' ' O ' ' A' ' 46' ' ' ASN . 4.5 mp -59.31 -30.39 68.3 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 179.238 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -122.41 5.5 9.63 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.209 -0.932 . . . . 0.0 109.722 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.536 ' CB ' ' O ' ' A' ' 47' ' ' GLU . . . -101.54 -49.54 3.99 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.248 -0.907 . . . . 0.0 109.907 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.498 ' HB3' ' OH ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -106.91 -6.82 17.35 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.314 -0.866 . . . . 0.0 110.161 -178.987 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 118.112 -0.947 . . . . 0.0 109.539 -179.935 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.416 ' CG ' ' N ' ' A' ' 10' ' ' ALA . 5.5 p-10 . . . . . 0 N--CA 1.489 1.499 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.613 ' HB3' HG11 ' A' ' 41' ' ' VAL . . . -80.99 -4.51 55.34 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.322 -0.861 . . . . 0.0 109.014 179.199 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.401 ' O ' HG13 ' A' ' 15' ' ' ILE . 0.1 OUTLIER -50.43 -75.99 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.363 -0.836 . . . . 0.0 110.201 -179.572 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -76.92 -18.42 58.3 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.144 -0.972 . . . . 0.0 110.369 -179.2 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.6 -18.28 62.23 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.947 -1.096 . . . . 0.0 109.441 -179.767 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.598 ' HB1' ' HG3' ' A' ' 45' ' ' LYS . . . -106.75 -38.79 6.0 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 179.58 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.755 HG23 ' CE1' ' A' ' 29' ' ' PHE . 35.8 mt -61.9 -28.36 44.14 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 CA-C-O 121.752 0.787 . . . . 0.0 109.263 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.06 -3.06 4.75 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.651 -0.655 . . . . 0.0 110.941 -178.75 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.526 ' CG ' ' O ' ' A' ' 17' ' ' GLU . 17.0 tt0 -117.56 1.94 12.32 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 120.847 -1.158 . . . . 0.0 109.933 -179.531 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.685 HD12 HD12 ' A' ' 23' ' ' ILE . 3.7 mm? -100.44 -39.68 7.84 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.001 -1.062 . . . . 0.0 110.511 -179.47 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.63 -19.71 64.06 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.018 -1.051 . . . . 0.0 109.942 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.468 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -96.94 -14.8 21.49 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.144 -0.972 . . . . 0.0 109.381 179.892 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -79.81 -39.33 31.02 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.156 -0.965 . . . . 0.0 109.587 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 125.25 14.07 3.39 Favored Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.954 -1.259 . . . . 0.0 109.954 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.685 HD12 HD12 ' A' ' 18' ' ' LEU . 34.1 mt -105.03 117.99 51.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.078 -1.248 . . . . 0.0 109.257 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.2 p -113.44 -4.74 13.55 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.233 -0.917 . . . . 0.0 109.938 -179.701 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -45.97 133.58 8.66 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.101 -0.999 . . . . 0.0 109.149 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.458 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 7.4 p-10 -88.47 -2.84 58.82 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.282 -0.886 . . . . 0.0 109.732 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.472 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 26.1 t80 -76.21 -13.94 60.16 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.166 -0.959 . . . . 0.0 109.243 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.823 ' HB3' HD11 ' A' ' 48' ' ' ILE . 22.3 m-85 -100.6 -45.21 5.59 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.428 -0.795 . . . . 0.0 108.973 179.734 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.755 ' CE1' HG23 ' A' ' 15' ' ' ILE . 5.5 m-85 -66.84 -44.62 80.58 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.473 -0.767 . . . . 0.0 109.559 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.458 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 14.4 m120 -68.74 -24.66 64.48 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.322 -0.861 . . . . 0.0 110.055 -179.799 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -92.49 -17.27 24.74 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.123 -0.986 . . . . 0.0 110.565 -178.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.511 HD11 ' HG2' ' A' ' 45' ' ' LYS . 0.6 OUTLIER -53.69 -39.05 36.81 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 120.981 -1.074 . . . . 0.0 109.242 -179.853 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -71.17 -38.82 72.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.184 -0.947 . . . . 0.0 109.442 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.418 ' O ' ' C ' ' A' ' 35' ' ' ALA . 16.7 mmtt -52.7 -25.65 11.62 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.287 -0.883 . . . . 0.0 109.408 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.626 ' HB3' HG22 ' A' ' 41' ' ' VAL . . . -41.69 137.12 1.73 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.457 -0.777 . . . . 0.0 109.764 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.5 mtpt -75.85 -64.85 0.99 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.213 -0.93 . . . . 0.0 109.275 179.792 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.492 HG22 ' OE1' ' A' ' 40' ' ' GLU . 9.0 t -109.71 -178.4 3.53 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.213 -0.929 . . . . 0.0 108.901 179.541 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 12.1 t -61.25 -46.33 96.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 O-C-N 120.896 -1.127 . . . . 0.0 108.942 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.718 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 5.8 mt-10 -53.34 -25.72 16.26 Favored 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 179.07 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.556 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -79.68 -37.14 36.48 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 179.071 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.626 HG22 ' HB3' ' A' ' 35' ' ' ALA . 38.4 t -65.53 -66.12 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.434 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -55.68 -29.41 59.32 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.48 -0.762 . . . . 0.0 109.579 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.718 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -67.52 -39.87 85.1 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.216 -0.927 . . . . 0.0 109.622 -179.821 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.447 HD12 ' HB2' ' A' ' 35' ' ' ALA . 3.6 mt -61.39 -45.51 94.06 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.207 -0.933 . . . . 0.0 109.791 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.598 ' HG3' ' HB1' ' A' ' 14' ' ' ALA . 14.1 mmtm -63.14 -25.86 68.55 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.125 -0.984 . . . . 0.0 109.319 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -80.43 -19.83 45.27 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.283 -0.886 . . . . 0.0 109.743 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -79.51 -16.57 55.79 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.158 -0.964 . . . . 0.0 109.744 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.823 HD11 ' HB3' ' A' ' 28' ' ' TYR . 64.0 mt -71.46 -42.05 73.01 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 O-C-N 120.877 -1.139 . . . . 0.0 108.548 179.525 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 87.4 mt -51.89 -26.41 10.13 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.417 -0.802 . . . . 0.0 109.338 179.442 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.42 ' O ' ' N ' ' A' ' 52' ' ' HIS . 0.1 OUTLIER -112.31 -71.15 0.77 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.186 -0.946 . . . . 0.0 109.965 -179.89 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -43.58 -25.44 0.16 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.311 -0.868 . . . . 0.0 109.844 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.646 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 0.0 OUTLIER -130.32 152.04 50.17 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 121.22 -0.925 . . . . 0.0 108.707 -179.644 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.646 ' HB3' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 118.009 -0.996 . . . . 0.0 109.247 -179.165 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.487 1.404 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.534 ' HB2' HG13 ' A' ' 38' ' ' VAL . . . -80.95 -18.97 45.25 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 121.291 -0.88 . . . . 0.0 108.863 179.545 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.602 ' O ' HD12 ' A' ' 15' ' ' ILE . 4.7 ptmt -74.88 -14.8 60.71 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.354 -0.842 . . . . 0.0 109.615 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -100.97 -37.84 8.46 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.055 -1.028 . . . . 0.0 109.513 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -74.85 -26.53 59.76 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.247 -0.908 . . . . 0.0 109.684 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.521 ' O ' HD23 ' A' ' 18' ' ' LEU . . . -92.97 -42.58 9.38 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.089 -1.007 . . . . 0.0 109.626 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.602 HD12 ' O ' ' A' ' 11' ' ' LYS . 20.4 mt -63.28 -31.0 51.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 CA-C-O 121.776 0.798 . . . . 0.0 108.999 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.507 ' HA ' ' HD2' ' A' ' 19' ' ' LYS . . . -67.24 -7.0 20.64 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.641 -0.662 . . . . 0.0 110.132 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.444 ' O ' ' CG ' ' A' ' 17' ' ' GLU . 9.4 tp10 -109.27 -5.97 15.69 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.231 -0.918 . . . . 0.0 109.522 -179.745 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.834 HD12 HD12 ' A' ' 23' ' ' ILE . 4.0 mm? -93.49 -41.01 10.02 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.113 -0.992 . . . . 0.0 109.031 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.507 ' HD2' ' HA ' ' A' ' 16' ' ' ALA . 0.1 OUTLIER -56.42 -23.31 37.59 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.504 -0.747 . . . . 0.0 109.524 -179.942 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.497 ' N ' ' HG2' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -97.64 -20.09 17.87 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.293 -0.879 . . . . 0.0 109.142 179.551 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -75.41 -28.67 59.51 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.259 -0.901 . . . . 0.0 109.575 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 128.36 -45.86 1.12 Allowed Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.26 -1.536 . . . . 0.0 109.26 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.867 HD13 HG21 ' A' ' 48' ' ' ILE . 5.5 mt -45.24 122.83 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.205 -1.173 . . . . 0.0 109.008 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -128.93 10.51 5.95 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.162 -0.961 . . . . 0.0 109.842 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.7 t -66.09 156.41 33.96 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.197 -0.939 . . . . 0.0 109.198 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.49 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 2.7 t70 -103.38 -4.11 24.58 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.103 -0.998 . . . . 0.0 109.825 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.472 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 5.9 t80 -77.57 -18.07 57.27 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.11 -0.993 . . . . 0.0 109.232 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.647 ' CG ' ' CG1' ' A' ' 48' ' ' ILE . 22.5 m-85 -95.46 -41.12 9.13 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.263 -0.898 . . . . 0.0 108.926 179.558 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.594 ' CE1' HG23 ' A' ' 15' ' ' ILE . 9.6 m-30 -71.03 -49.88 40.08 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.434 -0.791 . . . . 0.0 109.465 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.49 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 3.5 t-20 -59.12 -52.37 66.03 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.24 -0.912 . . . . 0.0 109.671 -179.746 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.16 -22.07 65.58 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.27 -0.894 . . . . 0.0 109.645 -179.708 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.61 HG23 HG13 ' A' ' 41' ' ' VAL . 1.4 mm -67.64 -53.94 27.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.205 -0.935 . . . . 0.0 109.399 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.524 ' CB ' ' HD2' ' A' ' 11' ' ' LYS . 1.6 p-10 -73.53 -1.96 20.74 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.149 -0.969 . . . . 0.0 109.461 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.483 ' O ' ' O ' ' A' ' 35' ' ' ALA . 7.2 mttt -105.3 -8.86 17.99 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.27 -0.894 . . . . 0.0 109.817 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.735 ' HB1' ' HB3' ' A' ' 40' ' ' GLU . . . -55.2 -158.89 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.531 -0.731 . . . . 0.0 110.088 -179.712 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.7 mttt -110.02 -67.47 0.99 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.128 -0.983 . . . . 0.0 110.087 -179.702 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.952 ' O ' HG23 ' A' ' 41' ' ' VAL . 0.7 OUTLIER -118.79 -168.5 1.56 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.979 -1.075 . . . . 0.0 109.645 -179.565 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.534 HG13 ' HB2' ' A' ' 10' ' ' ALA . 65.3 t -70.41 -31.6 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.201 -0.937 . . . . 0.0 109.931 -179.683 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.748 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 1.7 mm-40 -71.01 -26.75 63.26 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 120.945 -1.097 . . . . 0.0 108.139 179.319 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.735 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 0.1 OUTLIER -84.51 -26.7 27.92 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 178.736 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.952 HG23 ' O ' ' A' ' 37' ' ' THR . 53.9 t -73.8 -70.04 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 178.72 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -50.14 -29.08 8.4 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 178.873 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.748 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -64.48 -50.66 66.57 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.389 -0.819 . . . . 0.0 108.923 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.786 ' O ' HD12 ' A' ' 48' ' ' ILE . 5.9 mt -61.09 -46.58 90.05 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.314 -0.867 . . . . 0.0 109.922 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.577 ' HA ' HD13 ' A' ' 48' ' ' ILE . 0.2 OUTLIER -56.09 -40.9 74.37 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.118 -0.989 . . . . 0.0 109.805 -179.596 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.1 m-20 -76.43 -18.74 58.67 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.149 -0.97 . . . . 0.0 109.388 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.404 ' O ' ' CB ' ' A' ' 51' ' ' ALA . 8.6 tp10 -73.17 -19.89 61.02 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.259 -0.901 . . . . 0.0 109.407 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.867 HG21 HD13 ' A' ' 23' ' ' ILE . 2.9 mp -68.62 -27.76 37.47 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 179.075 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.503 ' HB2' ' HE2' ' A' ' 50' ' ' LYS . 2.3 mm? -58.24 -38.3 76.59 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.612 -0.68 . . . . 0.0 109.951 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.503 ' HE2' ' HB2' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -114.69 0.16 13.79 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.929 -1.107 . . . . 0.0 110.201 -179.432 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.404 ' CB ' ' O ' ' A' ' 47' ' ' GLU . . . -100.62 -12.17 19.43 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 121.182 -0.949 . . . . 0.0 109.172 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.724 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 0.0 OUTLIER -154.47 -171.61 3.92 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.429 -0.794 . . . . 0.0 108.886 -179.723 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.724 ' HB3' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 117.945 -1.026 . . . . 0.0 109.585 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.431 HD21 HG22 ' A' ' 38' ' ' VAL . 7.4 p30 . . . . . 0 N--CA 1.488 1.427 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.693 ' HB3' HG11 ' A' ' 41' ' ' VAL . . . -80.44 0.11 34.85 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.487 -0.758 . . . . 0.0 109.255 179.397 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.481 ' HG2' HG22 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -51.31 -88.38 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.961 -1.087 . . . . 0.0 109.49 -179.686 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' A' ' 16' ' ' ALA . 19.9 tt0 -67.08 -10.73 53.08 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.064 -1.022 . . . . 0.0 109.907 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.56 -72.31 0.19 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.083 -1.011 . . . . 0.0 109.259 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.563 ' O ' HD23 ' A' ' 18' ' ' LEU . . . -64.16 -35.72 81.72 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.409 -0.807 . . . . 0.0 109.858 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 1.054 HG23 ' CE1' ' A' ' 29' ' ' PHE . 33.8 mt -61.2 -28.55 44.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 CA-C-O 121.774 0.797 . . . . 0.0 109.389 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.435 ' HB2' ' O ' ' A' ' 12' ' ' GLU . . . -66.77 -4.15 8.41 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.823 -0.548 . . . . 0.0 110.893 -178.654 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.561 ' C ' HD22 ' A' ' 18' ' ' LEU . 12.1 tt0 -116.12 -2.8 12.14 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 120.938 -1.101 . . . . 0.0 109.874 -179.609 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.613 ' N ' HD22 ' A' ' 18' ' ' LEU . 3.6 mm? -99.59 -40.14 7.95 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.945 -1.097 . . . . 0.0 109.707 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.8 ttpp -53.76 -23.81 13.07 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.225 -0.922 . . . . 0.0 109.601 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.77 -22.39 16.43 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.224 -0.922 . . . . 0.0 109.712 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.02 -7.41 28.88 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.179 -0.951 . . . . 0.0 109.534 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.72 -9.3 58.52 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.256 -1.537 . . . . 0.0 109.256 -179.622 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.612 ' CD1' ' CE1' ' A' ' 52' ' ' HIS . 4.9 mm -69.15 149.05 11.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.302 -1.117 . . . . 0.0 109.583 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.513 HG23 ' O ' ' A' ' 23' ' ' ILE . 1.4 p -155.88 20.13 0.38 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.315 -0.866 . . . . 0.0 109.346 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.0 m -80.17 142.17 34.99 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.361 -0.837 . . . . 0.0 109.428 179.741 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.489 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 1.8 p30 -88.96 -11.77 43.46 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.309 -0.869 . . . . 0.0 109.561 -179.748 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.511 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 5.8 t80 -75.7 -12.56 60.22 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.208 -0.933 . . . . 0.0 109.121 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.64 ' CG ' ' CG1' ' A' ' 48' ' ' ILE . 24.0 m-85 -100.77 -43.2 6.19 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.33 -0.857 . . . . 0.0 109.204 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 1.054 ' CE1' HG23 ' A' ' 15' ' ' ILE . 5.2 m-85 -71.87 -45.17 62.27 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.503 -0.748 . . . . 0.0 109.765 -179.849 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.489 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 0.1 OUTLIER -65.27 -33.57 76.3 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.117 -0.989 . . . . 0.0 109.141 179.96 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -75.32 -11.72 60.12 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.38 -0.825 . . . . 0.0 109.184 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.825 HD11 ' HD2' ' A' ' 45' ' ' LYS . 4.3 mm -74.4 -25.2 19.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.343 -0.848 . . . . 0.0 109.367 179.876 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -80.32 -31.19 38.16 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.185 -0.947 . . . . 0.0 109.252 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.466 ' O ' ' C ' ' A' ' 35' ' ' ALA . 15.6 mtpp -77.12 -17.2 58.82 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.22 -0.925 . . . . 0.0 109.57 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.855 ' CB ' HG22 ' A' ' 41' ' ' VAL . . . -36.97 155.17 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 121.513 0.673 . . . . 0.0 110.497 -179.332 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.8 mmtm -95.6 -66.63 0.9 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.433 -0.792 . . . . 0.0 109.682 -179.812 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.802 ' O ' HG23 ' A' ' 41' ' ' VAL . 38.2 p -116.44 178.22 4.41 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.149 -0.969 . . . . 0.0 109.198 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.431 HG22 HD21 ' A' ' 9' ' ' ASN . 26.3 t -63.29 -42.96 98.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.192 -0.942 . . . . 0.0 109.46 179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.569 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 4.4 mm-40 -62.51 -23.07 66.75 Favored 'General case' 0 C--N 1.298 -1.661 0 O-C-N 121.219 -0.926 . . . . 0.0 109.035 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.498 ' HB2' ' H ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -85.71 -30.24 23.3 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.32 -0.862 . . . . 0.0 108.992 179.651 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.855 HG22 ' CB ' ' A' ' 35' ' ' ALA . 12.8 t -71.78 -61.58 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.434 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 179.005 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -57.72 -33.14 68.11 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.727 -0.608 . . . . 0.0 109.448 179.371 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.569 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -69.9 -31.74 69.69 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.323 -0.861 . . . . 0.0 109.753 -179.692 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.885 ' O ' HD12 ' A' ' 44' ' ' LEU . 0.2 OUTLIER -78.46 -24.75 45.87 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 121.105 -0.997 . . . . 0.0 109.346 -179.828 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.825 ' HD2' HD11 ' A' ' 32' ' ' ILE . 0.2 OUTLIER -80.5 -30.8 37.29 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.115 -0.991 . . . . 0.0 110.242 -179.314 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -79.87 -15.9 56.45 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 120.992 -1.067 . . . . 0.0 109.982 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 5.8 pt-20 -82.83 -6.98 59.68 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.058 -1.026 . . . . 0.0 109.521 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.64 ' CG1' ' CG ' ' A' ' 28' ' ' TYR . 1.6 mp -71.74 -48.42 51.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.473 0 N-CA-C 107.81 -1.182 . . . . 0.0 107.81 178.531 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.437 ' O ' ' C ' ' A' ' 53' ' ' ALA . 1.2 tp -50.2 -20.74 1.1 Allowed 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.297 -0.877 . . . . 0.0 109.793 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.421 ' O ' ' N ' ' A' ' 52' ' ' HIS . 0.0 OUTLIER -105.84 -74.49 0.65 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.991 -1.068 . . . . 0.0 109.877 -179.704 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -43.75 -22.62 0.05 Allowed 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.526 -0.734 . . . . 0.0 111.081 -179.482 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.612 ' CE1' ' CD1' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -126.91 -8.48 6.05 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.935 -1.103 . . . . 0.0 110.578 -178.397 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.437 ' C ' ' O ' ' A' ' 49' ' ' LEU . . . . . . . . 0 N--CA 1.491 1.587 0 O-C-N 120.943 -1.098 . . . . 0.0 109.643 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -81.03 -13.55 58.72 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.096 -1.003 . . . . 0.0 109.194 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.498 ' HE3' ' CG ' ' A' ' 12' ' ' GLU . 0.0 OUTLIER -53.73 -92.26 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.365 -0.834 . . . . 0.0 110.163 -179.289 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.539 ' HA ' ' HB ' ' A' ' 15' ' ' ILE . 26.0 mt-10 -47.04 -23.57 0.5 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.294 -0.879 . . . . 0.0 110.342 -179.109 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -56.35 -52.1 65.83 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.17 -0.956 . . . . 0.0 108.958 179.678 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 1.03 ' O ' HD13 ' A' ' 18' ' ' LEU . . . -78.14 -47.92 17.1 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.281 -0.887 . . . . 0.0 109.238 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.939 ' HA ' HD22 ' A' ' 18' ' ' LEU . 55.0 mt -46.34 -30.15 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 O-C-N 121.324 -0.86 . . . . 0.0 109.481 -179.801 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.4 -47.25 70.84 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.411 ' O ' ' HB2' ' A' ' 21' ' ' ALA . 11.4 mt-10 -79.32 4.75 14.29 Favored 'General case' 0 C--N 1.296 -1.755 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.271 178.898 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 1.03 HD13 ' O ' ' A' ' 14' ' ' ALA . 5.2 mp -91.57 -46.78 7.77 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.181 -0.95 . . . . 0.0 110.197 -178.191 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.8 ttpt -58.77 -27.62 65.16 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.054 -1.029 . . . . 0.0 109.179 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.0 tttt -95.01 -14.49 24.29 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.398 -0.813 . . . . 0.0 109.116 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.411 ' HB2' ' O ' ' A' ' 17' ' ' GLU . . . -63.58 -54.73 31.47 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.312 -0.868 . . . . 0.0 109.627 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 151.01 -14.16 0.86 Allowed Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.924 -1.271 . . . . 0.0 109.924 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.74 HD13 HG21 ' A' ' 48' ' ' ILE . 1.2 mt -103.65 161.24 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 120.988 -1.301 . . . . 0.0 109.482 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.4 p -147.81 15.97 1.09 Allowed 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 179.269 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.72 174.03 0.07 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.366 -0.834 . . . . 0.0 109.429 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.51 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 1.1 m-20 -112.13 -16.02 13.12 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.346 -0.846 . . . . 0.0 109.353 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.582 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 2.8 t80 -81.27 -20.78 40.17 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 120.869 -1.144 . . . . 0.0 108.864 179.556 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 1.048 ' CE2' HG23 ' A' ' 48' ' ' ILE . 18.8 m-30 -93.16 -4.75 51.58 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.372 -0.83 . . . . 0.0 109.351 179.482 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.687 ' CE2' ' HB3' ' A' ' 18' ' ' LEU . 23.5 m-85 -115.71 -55.64 2.41 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.475 -0.765 . . . . 0.0 109.57 -179.553 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.51 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 1.0 OUTLIER -64.12 -36.34 83.7 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.548 -0.72 . . . . 0.0 109.749 179.74 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.582 ' HB3' ' O ' ' A' ' 27' ' ' PHE . . . -80.88 -0.11 37.63 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.256 -0.903 . . . . 0.0 109.354 -179.8 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.495 ' CG2' ' HA ' ' A' ' 11' ' ' LYS . 15.6 mm -62.41 -55.55 23.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.445 -0.784 . . . . 0.0 109.606 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.5 p30 -64.26 -23.41 67.29 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.257 -0.902 . . . . 0.0 109.269 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.453 ' HB2' ' O ' ' A' ' 31' ' ' ALA . 0.4 OUTLIER -61.63 -28.28 69.26 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.165 -0.959 . . . . 0.0 109.191 179.615 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.625 ' HB3' HG22 ' A' ' 41' ' ' VAL . . . -41.54 159.04 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.424 -0.798 . . . . 0.0 109.917 -179.713 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 9.8 mtpt -92.04 -61.84 1.54 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.433 -0.792 . . . . 0.0 109.413 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.469 ' OG1' ' N ' ' A' ' 38' ' ' VAL . 0.4 OUTLIER -117.06 178.47 4.34 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.575 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.469 ' N ' ' OG1' ' A' ' 37' ' ' THR . 96.4 t -56.78 -52.98 47.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.094 -1.004 . . . . 0.0 109.143 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.744 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 10.6 pt-20 -48.42 -27.98 2.97 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.352 -0.843 . . . . 0.0 108.934 179.521 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.422 ' HB2' ' O ' ' A' ' 37' ' ' THR . 19.7 mm-40 -79.1 -39.17 34.41 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.329 -0.857 . . . . 0.0 108.852 179.582 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.625 HG22 ' HB3' ' A' ' 35' ' ' ALA . 21.6 t -64.27 -64.62 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 178.845 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -55.16 -36.19 65.57 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.432 -0.793 . . . . 0.0 109.204 179.417 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.744 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -59.03 -39.73 82.83 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.381 -0.824 . . . . 0.0 109.08 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.448 HD23 ' HA ' ' A' ' 44' ' ' LEU . 8.5 mt -53.07 -44.55 67.57 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.337 -0.852 . . . . 0.0 109.831 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.846 ' HD3' HD11 ' A' ' 18' ' ' LEU . 4.7 tptp -62.74 -45.34 93.17 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.043 -1.036 . . . . 0.0 109.752 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.452 ' OD1' ' HA ' ' A' ' 43' ' ' ALA . 1.9 m120 -66.49 -19.96 65.92 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.421 -0.799 . . . . 0.0 109.755 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.901 ' O ' ' HB3' ' A' ' 51' ' ' ALA . 0.0 OUTLIER -86.67 11.93 11.81 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.163 -0.961 . . . . 0.0 109.326 179.797 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 1.048 HG23 ' CE2' ' A' ' 28' ' ' TYR . 11.8 mm -96.55 -51.99 9.88 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.566 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 178.532 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.429 ' N ' HD23 ' A' ' 49' ' ' LEU . 7.8 mt -52.96 -22.97 6.29 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 121.357 -0.839 . . . . 0.0 108.883 178.601 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.4 mmpt? -107.68 -45.83 3.94 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.132 -0.98 . . . . 0.0 109.532 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.901 ' HB3' ' O ' ' A' ' 47' ' ' GLU . . . -92.02 44.22 1.16 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.223 -0.923 . . . . 0.0 109.429 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.72 ' CG ' HG22 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -178.2 -27.86 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.191 -0.943 . . . . 0.0 109.979 179.865 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.596 ' HB2' ' CE1' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.49 1.569 0 O-C-N 120.999 -1.063 . . . . 0.0 109.505 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.464 ' CG ' ' N ' ' A' ' 10' ' ' ALA . 6.3 p-10 . . . . . 0 N--CA 1.493 1.724 0 CA-C-O 120.93 0.395 . . . . 0.0 110.257 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.485 ' O ' ' C ' ' A' ' 11' ' ' LYS . . . -80.83 -31.64 35.46 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.878 -1.139 . . . . 0.0 110.115 -179.571 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.693 ' O ' HD12 ' A' ' 15' ' ' ILE . 0.0 OUTLIER -33.29 -55.88 0.41 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.533 -0.73 . . . . 0.0 111.609 -179.138 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -74.67 -50.97 15.67 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 120.868 -1.145 . . . . 0.0 111.893 -177.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -47.76 -56.97 6.18 Favored 'General case' 0 C--N 1.299 -1.626 0 O-C-N 120.555 -1.341 . . . . 0.0 110.142 -178.794 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.432 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . -69.62 -58.28 4.13 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.147 -0.971 . . . . 0.0 110.621 -179.358 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.693 HD12 ' O ' ' A' ' 11' ' ' LYS . 65.5 mt -42.02 -30.64 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.041 -1.037 . . . . 0.0 109.607 -179.448 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.7 -51.56 40.34 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.419 -0.801 . . . . 0.0 109.438 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.44 ' O ' ' CG ' ' A' ' 17' ' ' GLU . 19.9 tt0 -70.24 -5.52 28.2 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.393 -0.817 . . . . 0.0 109.405 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.768 HD13 ' O ' ' A' ' 18' ' ' LEU . 1.3 tm? -93.68 -39.8 10.59 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.39 -0.819 . . . . 0.0 109.751 -179.56 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.5 ' HD3' HG22 ' A' ' 24' ' ' THR . 0.4 OUTLIER -67.59 -23.07 65.34 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.298 -0.877 . . . . 0.0 109.733 -179.463 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.19 -26.07 16.13 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.142 -0.974 . . . . 0.0 109.381 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.26 -37.2 54.71 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.271 -0.893 . . . . 0.0 109.297 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 130.2 11.11 2.59 Favored Glycine 0 N--CA 1.491 2.305 0 C-N-CA 119.939 -1.124 . . . . 0.0 110.393 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.767 HG21 ' NE2' ' A' ' 52' ' ' HIS . 0.0 OUTLIER -127.18 154.71 37.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 120.928 -1.337 . . . . 0.0 109.708 179.813 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.5 HG22 ' HD3' ' A' ' 19' ' ' LYS . 18.0 p -140.42 19.63 2.39 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.381 -0.824 . . . . 0.0 109.021 179.663 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.1 t -58.01 124.28 18.78 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.377 -0.827 . . . . 0.0 109.717 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -80.06 -1.87 41.85 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.239 -0.913 . . . . 0.0 109.405 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -73.69 -33.61 64.49 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.37 -0.831 . . . . 0.0 109.275 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.959 ' CE2' HG23 ' A' ' 48' ' ' ILE . 21.9 m-85 -80.59 -44.98 18.09 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.328 -0.857 . . . . 0.0 109.414 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.627 ' CD1' HG12 ' A' ' 15' ' ' ILE . 18.3 m-30 -62.8 -53.34 55.8 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.315 -0.866 . . . . 0.0 109.859 -179.894 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.428 ' O ' ' OD1' ' A' ' 33' ' ' ASN . 12.0 t-20 -54.54 -41.83 70.2 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.153 -0.967 . . . . 0.0 109.044 179.835 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.73 -25.22 63.74 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.498 -0.751 . . . . 0.0 109.451 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.853 HG23 HG13 ' A' ' 41' ' ' VAL . 5.3 mt -64.43 -46.2 93.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.268 -0.895 . . . . 0.0 109.344 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.428 ' OD1' ' O ' ' A' ' 30' ' ' ASN . 1.2 p-10 -71.87 -10.47 59.81 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.03 -1.044 . . . . 0.0 109.066 179.71 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.405 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -96.97 -20.7 17.9 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.294 -0.879 . . . . 0.0 109.363 179.938 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.958 ' HB1' ' HB3' ' A' ' 40' ' ' GLU . . . -46.75 169.66 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.28 -0.887 . . . . 0.0 109.458 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.7 mtmt -84.82 -58.91 2.52 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.218 -0.926 . . . . 0.0 109.281 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.652 HG22 ' OE2' ' A' ' 40' ' ' GLU . 15.1 t -131.2 -174.16 3.31 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.254 -0.904 . . . . 0.0 109.297 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 54.9 t -60.71 -39.99 83.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.064 -1.022 . . . . 0.0 109.256 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.564 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 3.5 mt-10 -56.2 -28.76 59.46 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 179.159 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.958 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 0.4 OUTLIER -79.62 -31.41 41.64 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 179.037 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.853 HG13 HG23 ' A' ' 32' ' ' ILE . 16.3 t -66.73 -68.05 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 178.839 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 45.7 m-20 -53.16 -33.92 54.63 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.616 -0.678 . . . . 0.0 109.635 179.28 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.564 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -67.39 -34.95 78.33 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.339 -0.851 . . . . 0.0 110.31 -179.267 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 12.4 mt -76.95 -38.81 52.59 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.029 -1.044 . . . . 0.0 110.065 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.81 ' HG3' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -61.28 -29.57 69.94 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.169 -0.957 . . . . 0.0 109.943 -179.521 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 24.1 m-20 -71.24 -25.56 62.53 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.188 -0.945 . . . . 0.0 109.287 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.588 ' O ' ' HB3' ' A' ' 51' ' ' ALA . 2.8 tt0 -83.43 9.04 12.03 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.233 -0.917 . . . . 0.0 109.04 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.959 HG23 ' CE2' ' A' ' 28' ' ' TYR . 43.9 mt -88.34 -43.18 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 179.366 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.404 ' HA ' HD23 ' A' ' 49' ' ' LEU . 0.8 OUTLIER -69.94 -10.93 60.29 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.594 -0.692 . . . . 0.0 110.401 -179.89 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -120.38 -31.55 4.32 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.695 -1.253 . . . . 0.0 110.835 -179.253 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.588 ' HB3' ' O ' ' A' ' 47' ' ' GLU . . . -79.56 -20.07 47.91 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.881 -1.137 . . . . 0.0 110.617 -179.058 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.767 ' NE2' HG21 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -125.83 -16.79 5.58 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.955 -1.091 . . . . 0.0 109.9 -179.474 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.533 0 O-C-N 121.037 -1.039 . . . . 0.0 109.371 179.595 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.689 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.57 ' O ' ' HB3' ' A' ' 14' ' ' ALA . . . -70.68 -3.65 19.57 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.252 -0.905 . . . . 0.0 109.405 179.426 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.75 ' HD2' HG22 ' A' ' 32' ' ' ILE . 0.7 OUTLIER -54.47 -53.28 56.43 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.064 -1.022 . . . . 0.0 109.94 -179.823 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -88.83 -42.1 12.08 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.049 -1.032 . . . . 0.0 109.626 -179.648 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.91 -16.26 28.21 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.018 -1.051 . . . . 0.0 108.747 179.44 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.57 ' HB3' ' O ' ' A' ' 10' ' ' ALA . . . -102.99 -41.46 6.11 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.355 -0.84 . . . . 0.0 108.866 179.455 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.575 ' CG1' ' CD1' ' A' ' 32' ' ' ILE . 22.7 mt -52.88 -33.61 19.31 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 179.147 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.87 -38.88 79.99 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 179.055 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.534 ' CG ' ' O ' ' A' ' 17' ' ' GLU . 15.6 tt0 -90.22 4.22 51.22 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 179.228 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.602 HD23 ' HE3' ' A' ' 45' ' ' LYS . 20.1 mt -96.11 -55.33 3.0 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.262 -0.899 . . . . 0.0 108.725 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 25.5 ttpt -59.05 -40.9 86.54 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.81 -26.53 68.67 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.355 -0.841 . . . . 0.0 108.948 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.464 ' HB3' ' O ' ' A' ' 18' ' ' LEU . . . -53.92 -39.34 65.75 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.328 -0.857 . . . . 0.0 109.141 179.654 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 134.8 -1.72 3.94 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.742 -1.343 . . . . 0.0 109.742 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.47 HG22 ' H ' ' A' ' 25' ' ' SER . 9.4 mt -106.74 158.99 6.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.096 -1.237 . . . . 0.0 109.63 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 5.8 p -151.17 18.4 0.76 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.414 -0.804 . . . . 0.0 108.926 179.584 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.47 ' H ' HG22 ' A' ' 23' ' ' ILE . 0.6 OUTLIER -62.69 -177.44 0.15 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.395 -0.816 . . . . 0.0 109.447 -179.895 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.481 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 3.4 t0 -116.18 -21.0 9.59 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.42 -0.8 . . . . 0.0 109.009 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.54 ' CD1' ' O ' ' A' ' 27' ' ' PHE . 5.7 t80 -81.04 -3.92 53.44 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 120.991 -1.068 . . . . 0.0 108.443 179.001 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.89 ' CE2' HG23 ' A' ' 48' ' ' ILE . 16.9 m-30 -109.42 -6.9 15.29 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.527 -0.733 . . . . 0.0 109.614 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.547 ' CE1' ' HB3' ' A' ' 18' ' ' LEU . 61.6 m-85 -119.38 -43.93 2.59 Favored 'General case' 0 C--N 1.298 -1.672 0 CA-C-O 121.728 0.775 . . . . 0.0 109.381 -178.945 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.481 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 0.8 OUTLIER -65.5 -21.06 66.58 Favored 'General case' 0 C--N 1.295 -1.765 0 O-C-N 121.738 -0.601 . . . . 0.0 109.38 179.301 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.28 -3.1 58.71 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.224 -0.922 . . . . 0.0 109.823 -179.334 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.75 HG22 ' HD2' ' A' ' 11' ' ' LYS . 18.1 mt -65.27 -61.6 1.62 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.394 -0.816 . . . . 0.0 109.759 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.539 ' HA ' ' CD ' ' A' ' 11' ' ' LYS . 2.3 p30 -65.29 -9.46 24.42 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.196 -0.94 . . . . 0.0 109.807 -179.617 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.455 ' O ' ' O ' ' A' ' 35' ' ' ALA . 18.7 mmtm -93.62 -19.1 21.47 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.189 -0.945 . . . . 0.0 109.395 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.564 ' HB1' ' HB3' ' A' ' 40' ' ' GLU . . . -55.17 -164.52 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.413 -0.805 . . . . 0.0 109.72 -179.88 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.7 -63.89 1.37 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.191 -0.943 . . . . 0.0 109.715 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.596 ' O ' HG23 ' A' ' 41' ' ' VAL . 21.4 p -120.02 178.22 4.7 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.166 -0.958 . . . . 0.0 109.444 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 86.6 t -62.33 -43.45 98.11 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.334 -0.854 . . . . 0.0 109.157 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.706 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 0.0 OUTLIER -57.08 -26.33 60.24 Favored 'General case' 0 C--N 1.297 -1.678 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 179.135 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.564 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -80.69 -33.98 34.99 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 178.896 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.615 HG13 HG23 ' A' ' 32' ' ' ILE . 14.6 t -65.27 -64.53 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 178.821 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 55.9 m-80 -56.34 -31.96 64.24 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.03 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.706 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -59.5 -42.34 91.96 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.25 -0.906 . . . . 0.0 108.722 179.569 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.411 ' HB2' ' O ' ' A' ' 41' ' ' VAL . 2.3 mt -49.8 -54.57 18.37 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.407 -0.808 . . . . 0.0 109.89 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.84 ' HA ' HD12 ' A' ' 48' ' ' ILE . 17.1 tptp -49.61 -34.62 18.46 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.094 -1.004 . . . . 0.0 109.607 -179.599 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.407 ' HA ' HD21 ' A' ' 49' ' ' LEU . 2.8 m-20 -67.53 -48.77 66.03 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.26 -0.9 . . . . 0.0 109.428 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.45 ' O ' ' HB3' ' A' ' 51' ' ' ALA . 0.1 OUTLIER -74.27 -0.95 18.62 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.057 -1.027 . . . . 0.0 109.176 179.333 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.89 HG23 ' CE2' ' A' ' 28' ' ' TYR . 20.4 mt -87.63 -53.3 10.18 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 O-C-N 121.237 -0.914 . . . . 0.0 108.649 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.565 HD23 ' O ' ' A' ' 45' ' ' LYS . 0.6 OUTLIER -67.03 -18.7 65.49 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.046 -1.033 . . . . 0.0 108.424 179.12 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.9 -41.23 11.91 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 179.246 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.45 ' HB3' ' O ' ' A' ' 47' ' ' GLU . . . -89.56 13.7 13.32 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.982 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.706 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 0.0 OUTLIER -166.76 164.68 16.58 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 -179.731 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.706 ' HB3' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.493 1.687 0 CA-C-O 118.005 -0.998 . . . . 0.0 109.287 -179.594 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.581 ' OD1' HG22 ' A' ' 38' ' ' VAL . 4.5 p30 . . . . . 0 N--CA 1.486 1.367 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.77 ' HB2' HG13 ' A' ' 38' ' ' VAL . . . -81.77 -7.16 59.57 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.308 -0.87 . . . . 0.0 109.115 178.915 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.749 ' O ' HD12 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -37.89 -46.48 0.96 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.555 -0.716 . . . . 0.0 110.512 -179.503 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -97.93 -22.18 16.46 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.005 -1.059 . . . . 0.0 110.455 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -61.27 -41.93 97.77 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.069 -1.02 . . . . 0.0 110.483 -179.194 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.548 ' CB ' ' HA ' ' A' ' 42' ' ' ASN . . . -85.41 -40.31 16.59 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.03 -1.044 . . . . 0.0 109.893 -179.631 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 1.001 HG23 ' CE1' ' A' ' 29' ' ' PHE . 67.2 mt -61.08 -27.04 40.86 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.542 0 CA-C-O 121.566 0.698 . . . . 0.0 109.81 -179.592 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.12 -7.1 10.87 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.643 -0.661 . . . . 0.0 110.743 -178.333 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.465 ' OE2' ' OD1' ' A' ' 46' ' ' ASN . 2.9 pt-20 -109.35 -8.55 15.05 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 121.022 -1.049 . . . . 0.0 109.51 -179.515 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.637 HD11 HG21 ' A' ' 48' ' ' ILE . 0.6 OUTLIER -100.65 -46.81 5.06 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.19 -0.943 . . . . 0.0 110.125 179.946 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 27.8 ttmt -52.75 -39.38 62.13 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.126 -0.984 . . . . 0.0 109.934 -179.555 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -31.27 71.86 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.195 -0.94 . . . . 0.0 109.613 -179.759 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.52 -49.07 78.19 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.19 -0.944 . . . . 0.0 109.239 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 135.46 -8.88 4.34 Favored Glycine 0 N--CA 1.489 2.193 0 N-CA-C 109.661 -1.376 . . . . 0.0 109.661 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.825 HD13 ' CE1' ' A' ' 52' ' ' HIS . 48.8 mt -75.08 122.98 29.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.213 -1.169 . . . . 0.0 109.499 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -117.86 19.08 13.88 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.388 -0.82 . . . . 0.0 109.43 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.48 121.58 15.22 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.292 -0.88 . . . . 0.0 109.52 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.42 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 0.3 OUTLIER -74.41 -1.68 22.08 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.238 -0.914 . . . . 0.0 109.598 179.87 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.69 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 4.5 t80 -76.64 -14.99 59.93 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.235 -0.915 . . . . 0.0 109.175 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.714 ' HB3' HD11 ' A' ' 48' ' ' ILE . 62.3 m-85 -104.27 -33.37 8.7 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.421 -0.799 . . . . 0.0 109.073 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 1.001 ' CE1' HG23 ' A' ' 15' ' ' ILE . 8.7 m-85 -71.44 -47.37 56.2 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.362 -0.836 . . . . 0.0 108.805 179.082 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.461 ' O ' ' HD2' ' A' ' 34' ' ' LYS . 0.1 OUTLIER -61.33 -29.77 70.1 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.374 -0.829 . . . . 0.0 109.561 179.821 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.6 -22.4 50.91 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.268 -0.895 . . . . 0.0 109.462 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.71 HD13 ' O ' ' A' ' 28' ' ' TYR . 1.2 mp -65.18 -42.54 94.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.301 -0.874 . . . . 0.0 108.932 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 31.2 t30 -80.81 8.29 8.52 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.168 -0.957 . . . . 0.0 110.222 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.479 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.2 OUTLIER -122.14 -14.47 7.95 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.027 -1.046 . . . . 0.0 110.034 -179.746 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.803 ' HB2' HD12 ' A' ' 44' ' ' LEU . . . -47.65 -102.54 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.36 -0.838 . . . . 0.0 110.599 -179.487 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -171.05 -68.71 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.803 -1.185 . . . . 0.0 109.565 -179.311 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.938 ' O ' HG23 ' A' ' 41' ' ' VAL . 33.3 p -123.41 -167.72 1.66 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.313 -0.867 . . . . 0.0 109.399 -179.856 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.77 HG13 ' HB2' ' A' ' 10' ' ' ALA . 26.1 t -64.85 -53.9 36.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.152 -0.968 . . . . 0.0 109.372 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.56 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 9.2 pt-20 -52.97 -27.32 18.51 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.273 -0.892 . . . . 0.0 109.469 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.615 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 2.8 mm-40 -81.08 -33.09 33.63 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.167 -0.958 . . . . 0.0 109.001 179.507 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.938 HG23 ' O ' ' A' ' 37' ' ' THR . 15.6 t -70.61 -62.35 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.391 -0.818 . . . . 0.0 108.959 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.548 ' HA ' ' CB ' ' A' ' 14' ' ' ALA . 27.9 m120 -57.12 -31.7 65.58 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.467 -0.771 . . . . 0.0 109.61 179.54 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.56 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -67.36 -40.47 85.8 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.181 -0.949 . . . . 0.0 109.058 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.803 HD12 ' HB2' ' A' ' 35' ' ' ALA . 6.0 mt -61.91 -48.52 80.08 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.313 -0.867 . . . . 0.0 110.704 -179.793 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.645 ' HD2' HD11 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -65.73 -24.94 67.08 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.868 -1.145 . . . . 0.0 110.356 -178.898 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.465 ' OD1' ' OE2' ' A' ' 17' ' ' GLU . 41.1 m-20 -80.94 -25.1 37.66 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.964 -1.085 . . . . 0.0 110.398 -179.513 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.434 ' O ' ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -77.69 -18.97 56.08 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.986 -1.072 . . . . 0.0 110.412 -179.365 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.714 HD11 ' HB3' ' A' ' 28' ' ' TYR . 1.1 mt -66.14 -29.06 45.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.084 -1.01 . . . . 0.0 108.989 179.528 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.466 ' O ' ' OXT' ' A' ' 53' ' ' ALA . 1.4 mm? -60.34 -25.66 65.99 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.037 -1.039 . . . . 0.0 109.19 179.373 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.59 6.37 5.67 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.062 -1.024 . . . . 0.0 109.87 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.445 ' HB3' ' HA ' ' A' ' 48' ' ' ILE . . . -101.0 -19.52 15.8 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.283 -0.886 . . . . 0.0 109.496 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.825 ' CE1' HD13 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -143.36 8.55 1.59 Allowed 'General case' 0 C--N 1.303 -1.454 0 C-N-CA 119.573 -0.851 . . . . 0.0 110.156 -178.398 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.466 ' OXT' ' O ' ' A' ' 49' ' ' LEU . . . . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 117.999 -1.0 . . . . 0.0 109.596 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.827 ' OD1' HG22 ' A' ' 38' ' ' VAL . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 121.278 0.561 . . . . 0.0 109.799 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -81.15 10.98 4.56 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.251 -0.906 . . . . 0.0 109.709 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.488 ' O ' HG13 ' A' ' 15' ' ' ILE . 0.1 OUTLIER -50.98 -78.15 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.028 -1.045 . . . . 0.0 110.505 -179.244 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -88.16 -18.34 28.98 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.011 -1.056 . . . . 0.0 110.94 -178.743 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -61.08 -39.48 90.06 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.826 -1.171 . . . . 0.0 109.308 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.522 ' O ' HD23 ' A' ' 18' ' ' LEU . . . -85.86 -45.93 11.09 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.27 -0.894 . . . . 0.0 109.254 179.724 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.808 HG23 ' CE1' ' A' ' 29' ' ' PHE . 95.2 mt -50.49 -29.23 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.535 -0.728 . . . . 0.0 110.288 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.3 -39.05 89.04 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.407 -0.808 . . . . 0.0 110.145 -178.629 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.416 ' C ' HD22 ' A' ' 18' ' ' LEU . 12.8 tt0 -83.37 -2.02 54.77 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.411 -0.806 . . . . 0.0 110.969 -178.83 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.522 HD23 ' O ' ' A' ' 14' ' ' ALA . 4.1 mm? -98.1 -38.01 9.51 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.814 -1.179 . . . . 0.0 110.066 -179.685 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.66 -38.92 49.12 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.237 -0.914 . . . . 0.0 109.736 -179.598 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.9 ttpt -71.51 -32.78 68.59 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.015 -1.053 . . . . 0.0 109.263 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.62 -22.21 32.44 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.259 -0.901 . . . . 0.0 109.582 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.444 ' O ' ' N ' ' A' ' 24' ' ' THR . . . 106.26 -41.14 2.25 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.536 HD13 ' CG2' ' A' ' 48' ' ' ILE . 46.8 mt -52.01 94.2 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.3 -1.118 . . . . 0.0 109.397 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.444 ' N ' ' O ' ' A' ' 22' ' ' GLY . 0.8 OUTLIER -97.27 19.8 12.53 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.22 -0.925 . . . . 0.0 109.848 -179.843 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.98 150.85 32.14 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.119 -0.988 . . . . 0.0 109.752 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -96.77 -8.18 31.86 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.244 -0.91 . . . . 0.0 109.276 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.514 ' CD1' ' O ' ' A' ' 27' ' ' PHE . 8.4 t80 -80.65 -8.8 59.75 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.038 -1.039 . . . . 0.0 109.476 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.656 ' CE2' HG23 ' A' ' 48' ' ' ILE . 18.6 m-30 -106.18 -15.33 14.89 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.384 -0.823 . . . . 0.0 109.207 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.808 ' CE1' HG23 ' A' ' 15' ' ' ILE . 10.7 m-30 -104.66 -49.75 3.46 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.577 -0.702 . . . . 0.0 109.376 -179.783 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -64.61 -41.23 96.34 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.244 -0.91 . . . . 0.0 109.35 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.7 1.27 20.45 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.228 -0.92 . . . . 0.0 109.775 -179.609 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.613 ' HA ' HD21 ' A' ' 44' ' ' LEU . 0.1 OUTLIER -72.96 -41.45 60.13 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.154 -0.966 . . . . 0.0 109.017 179.914 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 23.0 p30 -80.19 -0.78 37.66 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.339 -0.851 . . . . 0.0 109.576 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.497 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -107.03 -16.54 14.41 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.264 -0.898 . . . . 0.0 109.752 -179.563 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.634 ' HB1' ' OE1' ' A' ' 40' ' ' GLU . . . -39.61 -98.91 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.641 -0.662 . . . . 0.0 110.624 -179.273 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.518 ' CG ' ' O ' ' A' ' 35' ' ' ALA . 5.3 mttt -171.15 -69.28 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.993 -1.067 . . . . 0.0 109.027 -179.235 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.855 ' O ' HG23 ' A' ' 41' ' ' VAL . 5.1 t -127.94 -177.65 4.21 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.827 HG22 ' OD1' ' A' ' 9' ' ' ASN . 4.6 t -61.53 -48.87 86.79 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 O-C-N 120.909 -1.119 . . . . 0.0 109.661 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.554 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 1.1 tt0 -61.35 -18.47 58.81 Favored 'General case' 0 C--N 1.296 -1.749 0 O-C-N 121.087 -1.008 . . . . 0.0 109.103 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.634 ' OE1' ' HB1' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -90.78 -26.15 19.61 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.208 -0.932 . . . . 0.0 109.019 179.657 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.855 HG23 ' O ' ' A' ' 37' ' ' THR . 20.2 t -76.09 -54.75 12.92 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.398 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 179.007 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -66.68 -28.49 68.49 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.514 -0.741 . . . . 0.0 109.493 179.08 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.554 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -76.99 -23.97 52.26 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.201 -0.937 . . . . 0.0 109.678 -179.68 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.681 HD12 ' C ' ' A' ' 44' ' ' LEU . 0.3 OUTLIER -78.75 -41.23 31.24 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.162 -0.961 . . . . 0.0 109.86 -179.581 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.83 ' HA ' HD13 ' A' ' 48' ' ' ILE . 6.4 mmtt -61.58 -35.17 77.05 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.959 -1.088 . . . . 0.0 109.592 -179.787 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.2 m-20 -70.39 -23.5 62.78 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.083 -1.01 . . . . 0.0 108.457 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.552 ' O ' ' HB3' ' A' ' 51' ' ' ALA . 2.2 tt0 -78.85 1.56 23.0 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.5 -0.75 . . . . 0.0 109.038 179.183 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.83 HD13 ' HA ' ' A' ' 45' ' ' LYS . 1.7 mp -79.33 -33.16 15.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.545 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 23.1 tp -69.98 -30.86 68.3 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.426 -0.796 . . . . 0.0 109.938 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.6 mttt -102.79 -14.89 16.43 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.025 -1.047 . . . . 0.0 110.01 -179.546 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.552 ' HB3' ' O ' ' A' ' 47' ' ' GLU . . . -100.77 19.69 16.67 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.154 -0.966 . . . . 0.0 109.72 -179.768 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -165.52 -44.26 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.272 -0.892 . . . . 0.0 109.153 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.545 ' HB3' ' O ' ' A' ' 49' ' ' LEU . . . . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 117.953 -1.023 . . . . 0.0 109.558 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.463 ' OD1' HG22 ' A' ' 38' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.425 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.43 ' HB3' HG13 ' A' ' 38' ' ' VAL . . . -54.45 -18.3 4.09 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.333 -0.854 . . . . 0.0 109.687 179.782 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.462 ' O ' HG13 ' A' ' 15' ' ' ILE . 0.4 OUTLIER -57.82 -71.46 0.11 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.237 -0.915 . . . . 0.0 110.181 -179.471 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -64.29 -28.54 69.79 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.002 -1.061 . . . . 0.0 110.013 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -61.77 -31.87 72.1 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 120.975 -1.078 . . . . 0.0 109.125 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.28 -58.25 2.83 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.312 -0.868 . . . . 0.0 108.775 179.323 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.597 HG23 ' CE1' ' A' ' 29' ' ' PHE . 8.3 mt -43.33 -35.22 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 O-C-N 121.531 -0.731 . . . . 0.0 110.413 179.717 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -77.15 29.26 0.14 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.294 -0.879 . . . . 0.0 110.652 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -151.66 -36.62 0.13 Allowed 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 179.862 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.619 HD12 ' HE3' ' A' ' 45' ' ' LYS . 14.9 mt -78.72 -31.31 46.34 Favored 'General case' 0 C--N 1.306 -1.287 0 O-C-N 121.64 -0.662 . . . . 0.0 109.558 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.9 tttt -58.95 -21.53 58.5 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.131 -0.981 . . . . 0.0 109.674 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 41.1 mtmt -84.03 -25.91 29.51 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.289 -0.882 . . . . 0.0 109.527 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.32 -4.06 13.11 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.27 -0.894 . . . . 0.0 109.773 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 102.36 -34.73 5.49 Favored Glycine 0 N--CA 1.488 2.149 0 N-CA-C 108.966 -1.654 . . . . 0.0 108.966 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.472 ' O ' ' CG2' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -46.9 117.67 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 O-C-N 121.44 -1.035 . . . . 0.0 108.864 179.735 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.39 6.77 6.36 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.08 -1.013 . . . . 0.0 110.042 -179.661 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -54.01 121.1 7.35 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.237 -0.914 . . . . 0.0 109.222 179.67 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.471 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 33.3 m-20 -73.51 -1.4 18.4 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.083 -1.01 . . . . 0.0 109.641 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.466 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 3.2 t80 -80.82 -39.79 26.02 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.034 -1.041 . . . . 0.0 109.247 179.884 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 1.079 ' CE2' HG23 ' A' ' 48' ' ' ILE . 21.7 m-30 -74.83 -25.03 58.72 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.472 -0.768 . . . . 0.0 110.129 -179.467 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.597 ' CE1' HG23 ' A' ' 15' ' ' ILE . 11.7 m-85 -94.97 -49.93 5.33 Favored 'General case' 0 C--N 1.297 -1.677 0 O-C-N 121.271 -0.893 . . . . 0.0 110.205 -178.838 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.471 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 66.3 m-20 -61.0 -35.77 77.72 Favored 'General case' 0 C--N 1.297 -1.704 0 O-C-N 121.152 -0.968 . . . . 0.0 109.476 179.67 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.432 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . . . -85.26 -4.39 59.14 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.256 -0.903 . . . . 0.0 110.328 -179.033 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.551 ' CD1' ' HE2' ' A' ' 45' ' ' LYS . 0.4 OUTLIER -62.59 -44.82 99.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.074 -1.016 . . . . 0.0 109.554 -179.67 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -77.82 -5.63 51.46 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.14 -0.975 . . . . 0.0 109.489 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.452 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -77.99 -22.86 48.72 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.244 -0.91 . . . . 0.0 109.607 -179.92 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.901 ' HB1' ' HB3' ' A' ' 40' ' ' GLU . . . -51.53 -175.47 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.216 -0.928 . . . . 0.0 109.973 -179.683 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.446 ' H ' ' CB ' ' A' ' 40' ' ' GLU . 0.5 OUTLIER -106.58 -54.04 2.53 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.498 -0.751 . . . . 0.0 109.096 179.824 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.686 ' O ' HG23 ' A' ' 41' ' ' VAL . 51.9 p -123.61 -172.95 2.63 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.312 -0.868 . . . . 0.0 109.24 179.752 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.463 HG22 ' OD1' ' A' ' 9' ' ' ASN . 67.4 t -66.91 -26.17 36.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.111 -0.993 . . . . 0.0 109.474 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.722 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 63.7 mt-10 -73.12 -29.18 62.71 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 179.381 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.901 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 2.9 mm-40 -79.23 -32.54 43.94 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 178.831 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.686 HG23 ' O ' ' A' ' 37' ' ' THR . 21.1 t -68.61 -68.37 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.891 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -51.3 -28.27 11.63 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 179.222 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.722 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -64.21 -50.34 68.45 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.43 -0.794 . . . . 0.0 109.031 179.563 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.9 mt -54.98 -44.0 74.05 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.29 -0.882 . . . . 0.0 109.881 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.655 ' NZ ' HD11 ' A' ' 48' ' ' ILE . 0.3 OUTLIER -57.64 -40.53 79.45 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.16 -0.963 . . . . 0.0 109.162 179.862 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.5 m-20 -69.65 -21.87 63.5 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.263 -0.898 . . . . 0.0 109.622 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.67 ' O ' ' HB3' ' A' ' 51' ' ' ALA . 1.4 mt-10 -82.96 10.27 8.27 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.212 -0.93 . . . . 0.0 109.314 179.488 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 1.079 HG23 ' CE2' ' A' ' 28' ' ' TYR . 62.0 mt -90.03 -45.02 15.1 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 179.154 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 7.4 mp -61.72 -21.48 64.53 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.436 -0.79 . . . . 0.0 109.681 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -106.42 -43.22 4.82 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.902 -1.124 . . . . 0.0 109.906 -179.736 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.67 ' HB3' ' O ' ' A' ' 47' ' ' GLU . . . -84.71 43.15 0.96 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.163 -0.961 . . . . 0.0 109.134 179.517 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.725 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 0.4 OUTLIER 163.14 157.03 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 -179.54 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.725 ' HB3' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 118.037 -0.982 . . . . 0.0 109.425 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -81.87 29.73 0.39 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.184 -0.947 . . . . 0.0 110.396 179.583 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.768 ' O ' HD12 ' A' ' 15' ' ' ILE . 0.4 OUTLIER -63.81 -42.86 97.59 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 120.788 -1.195 . . . . 0.0 109.915 -179.715 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.519 ' O ' ' HB2' ' A' ' 16' ' ' ALA . 1.5 tt0 -96.01 -26.04 15.7 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.048 -1.033 . . . . 0.0 110.437 -179.241 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -65.83 -56.43 11.93 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.822 -1.174 . . . . 0.0 110.146 -179.341 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.64 ' HB1' ' HD2' ' A' ' 45' ' ' LYS . . . -69.77 -46.78 65.03 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.203 -0.936 . . . . 0.0 110.009 -179.531 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 1.052 HG23 ' CZ ' ' A' ' 29' ' ' PHE . 46.0 mt -57.85 -29.59 35.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 CA-C-O 121.718 0.77 . . . . 0.0 109.652 -179.699 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.519 ' HB2' ' O ' ' A' ' 12' ' ' GLU . . . -61.79 -6.8 2.92 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.51 -0.744 . . . . 0.0 111.284 -178.84 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.589 ' HB3' ' HZ2' ' A' ' 45' ' ' LYS . 28.6 tt0 -105.39 -22.61 12.99 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 120.906 -1.121 . . . . 0.0 109.996 -179.365 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.987 HD21 HD12 ' A' ' 48' ' ' ILE . 0.7 OUTLIER -76.78 -35.98 57.31 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.924 -1.11 . . . . 0.0 109.449 -179.87 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.7 ttmt -50.34 -35.12 26.35 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.323 -0.861 . . . . 0.0 109.843 -179.848 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.85 -21.77 21.29 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.141 -0.974 . . . . 0.0 109.746 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.27 -28.13 69.52 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.154 -0.966 . . . . 0.0 109.17 179.753 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 115.61 -16.93 16.37 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.668 HD13 HG21 ' A' ' 48' ' ' ILE . 67.4 mt -84.19 115.13 25.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.198 -1.178 . . . . 0.0 109.798 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.414 ' O ' ' C ' ' A' ' 25' ' ' SER . 0.0 OUTLIER -117.47 0.45 12.15 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.187 -0.946 . . . . 0.0 109.302 179.36 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.414 ' C ' ' O ' ' A' ' 24' ' ' THR . 49.6 m -44.75 157.44 0.07 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.177 -0.952 . . . . 0.0 109.45 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.463 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 4.8 p-10 -104.11 -7.17 20.42 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.22 -0.925 . . . . 0.0 109.866 -179.621 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.563 ' O ' ' CG ' ' A' ' 27' ' ' PHE . 27.0 t80 -80.54 1.3 30.13 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.982 -1.073 . . . . 0.0 109.55 -179.881 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.961 ' CE2' HG23 ' A' ' 48' ' ' ILE . 15.6 m-85 -117.34 -50.66 2.54 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 179.205 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 1.052 ' CZ ' HG23 ' A' ' 15' ' ' ILE . 1.2 m-30 -66.41 -38.83 88.34 Favored 'General case' 0 C--N 1.302 -1.48 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.121 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.463 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 12.0 m-20 -69.76 -34.33 73.64 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.209 -0.932 . . . . 0.0 108.833 179.435 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.91 -15.42 58.35 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.476 -0.765 . . . . 0.0 109.471 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 1.111 HG23 HG13 ' A' ' 41' ' ' VAL . 1.3 mm -53.12 -27.72 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.251 -0.905 . . . . 0.0 108.968 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.457 ' OD1' ' O ' ' A' ' 30' ' ' ASN . 2.2 p-10 -80.38 -33.32 37.24 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.031 -1.043 . . . . 0.0 109.486 179.784 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.46 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -54.71 -27.98 44.61 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.245 -0.909 . . . . 0.0 109.428 179.986 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.716 ' HB2' HD12 ' A' ' 44' ' ' LEU . . . -44.99 169.27 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.288 -0.883 . . . . 0.0 109.476 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.3 mttp -99.0 -47.0 5.4 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.319 -0.863 . . . . 0.0 109.455 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.627 ' O ' HG23 ' A' ' 41' ' ' VAL . 70.6 p -126.73 -163.08 1.2 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.208 -0.932 . . . . 0.0 109.388 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 87.3 t -70.56 -54.98 15.96 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 O-C-N 121.301 -0.874 . . . . 0.0 109.317 179.818 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.685 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 3.2 tt0 -53.33 -27.94 26.02 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.275 -0.891 . . . . 0.0 109.228 179.755 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.596 ' HB2' ' HB1' ' A' ' 35' ' ' ALA . 4.8 mm-40 -79.07 -35.38 42.54 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 179.295 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 1.111 HG13 HG23 ' A' ' 32' ' ' ILE . 55.4 t -65.76 -67.18 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 178.685 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.484 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 7.4 m-20 -53.9 -30.71 47.29 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.674 -0.641 . . . . 0.0 109.537 179.228 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.685 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -66.14 -39.89 90.2 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.215 -0.928 . . . . 0.0 109.457 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.716 HD12 ' HB2' ' A' ' 35' ' ' ALA . 4.0 mt -61.67 -43.11 99.48 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.262 -0.899 . . . . 0.0 110.699 -179.451 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.942 ' HE2' HD13 ' A' ' 18' ' ' LEU . 0.0 OUTLIER -67.32 -43.51 81.42 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.846 -1.159 . . . . 0.0 109.883 -179.163 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.475 ' N ' ' CG ' ' A' ' 45' ' ' LYS . 28.0 m-20 -69.35 -21.47 63.81 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.108 -0.995 . . . . 0.0 108.69 179.626 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.426 ' HB2' ' O ' ' A' ' 43' ' ' ALA . 1.3 tm-20 -73.32 -12.71 60.93 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.987 HD12 HD21 ' A' ' 18' ' ' LEU . 53.9 mt -65.81 -41.08 89.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 179.082 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.2 mp -50.76 -29.47 11.56 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.78 -0.575 . . . . 0.0 110.353 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.45 ' CD ' ' O ' ' A' ' 50' ' ' LYS . 0.1 OUTLIER -111.99 -13.89 13.54 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.778 -1.201 . . . . 0.0 110.675 -179.228 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -100.9 20.49 15.32 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 179.36 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.715 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 0.0 OUTLIER 173.47 155.21 0.11 Allowed 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.84 -1.171 . . . . 0.0 107.84 -179.248 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.715 ' HB3' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.492 1.654 0 CA-C-O 117.943 -1.027 . . . . 0.0 109.252 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.9 p-10 . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 121.143 0.497 . . . . 0.0 110.032 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.76 ' HB3' HG11 ' A' ' 41' ' ' VAL . . . -80.22 -9.54 59.73 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.218 -0.926 . . . . 0.0 110.401 -179.213 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.468 ' O ' HG13 ' A' ' 15' ' ' ILE . 36.4 mtpt -45.26 -69.89 0.12 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.118 -0.989 . . . . 0.0 110.152 -179.44 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -90.79 -20.67 22.09 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.05 -1.031 . . . . 0.0 110.322 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.82 -30.86 71.8 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 120.911 -1.118 . . . . 0.0 109.426 -179.836 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.549 ' O ' ' CD2' ' A' ' 18' ' ' LEU . . . -93.77 -49.04 6.03 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.685 -0.858 . . . . 0.0 108.685 179.458 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.863 HG23 ' CE1' ' A' ' 29' ' ' PHE . 70.0 mt -53.65 -27.32 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 CA-C-O 121.547 0.689 . . . . 0.0 110.65 179.929 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.4 -3.05 1.21 Allowed 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.444 -0.785 . . . . 0.0 111.351 -178.39 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -122.31 -3.6 8.94 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 120.683 -1.261 . . . . 0.0 110.201 -179.514 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.808 ' N ' HD22 ' A' ' 18' ' ' LEU . 2.5 mm? -99.71 -38.53 8.66 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.036 -1.04 . . . . 0.0 109.562 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.7 tptp -50.91 -45.07 60.24 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.245 -0.909 . . . . 0.0 109.148 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.93 -31.27 72.1 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.232 -0.917 . . . . 0.0 109.548 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.97 -48.86 79.98 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.254 -0.904 . . . . 0.0 109.52 -179.858 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.532 ' O ' HG23 ' A' ' 24' ' ' THR . . . 136.29 -22.25 3.4 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.294 -1.522 . . . . 0.0 109.294 -179.81 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.582 HD13 HG21 ' A' ' 48' ' ' ILE . 53.9 mt -66.57 122.5 17.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.336 -1.097 . . . . 0.0 109.301 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.532 HG23 ' O ' ' A' ' 22' ' ' GLY . 13.7 p -128.99 1.38 5.29 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.192 -0.942 . . . . 0.0 109.845 -179.686 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.421 ' C ' ' O ' ' A' ' 24' ' ' THR . 18.3 t -44.22 161.2 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.178 -0.951 . . . . 0.0 108.958 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.528 ' O ' ' CB ' ' A' ' 30' ' ' ASN . 3.6 p30 -99.6 -10.89 21.48 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.129 -0.982 . . . . 0.0 109.573 -179.834 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.608 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 18.4 t80 -81.01 -6.38 58.72 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.029 -1.045 . . . . 0.0 109.611 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.832 ' CD1' HD11 ' A' ' 48' ' ' ILE . 23.1 m-85 -110.97 -37.11 5.47 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.205 -0.934 . . . . 0.0 108.494 179.446 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.863 ' CE1' HG23 ' A' ' 15' ' ' ILE . 3.5 m-85 -85.39 -43.53 13.57 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 179.175 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.61 ' O ' ' ND2' ' A' ' 33' ' ' ASN . 48.3 t30 -69.87 -57.87 4.55 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.4 -0.813 . . . . 0.0 108.955 179.636 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.5 -16.29 23.35 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.437 -0.79 . . . . 0.0 109.203 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.539 HG21 HD11 ' A' ' 15' ' ' ILE . 0.4 OUTLIER -54.15 -39.38 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.34 -0.85 . . . . 0.0 108.814 179.924 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.61 ' ND2' ' O ' ' A' ' 30' ' ' ASN . 14.4 p30 -75.77 -35.03 60.26 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.274 -0.891 . . . . 0.0 109.094 179.618 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.448 ' O ' ' C ' ' A' ' 35' ' ' ALA . 0.7 OUTLIER -55.41 -25.2 34.51 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.377 -0.827 . . . . 0.0 109.501 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.706 ' HB2' HD12 ' A' ' 44' ' ' LEU . . . -40.12 155.96 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.667 -0.646 . . . . 0.0 109.914 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.39 -70.85 0.58 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.318 -0.864 . . . . 0.0 109.535 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.654 ' O ' HG23 ' A' ' 41' ' ' VAL . 0.6 OUTLIER -108.55 -179.94 4.02 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.159 -0.963 . . . . 0.0 109.138 179.758 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 27.8 t -59.3 -37.77 70.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.23 -0.918 . . . . 0.0 109.234 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.655 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 43.4 mt-10 -63.51 -28.48 69.98 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 121.281 -0.887 . . . . 0.0 108.747 179.378 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.502 ' OE1' ' N ' ' A' ' 40' ' ' GLU . 1.1 mp0 -79.49 -31.27 42.26 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 179.131 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.76 HG11 ' HB3' ' A' ' 10' ' ' ALA . 12.7 t -67.21 -66.67 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.343 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 178.968 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 32.4 m120 -55.46 -35.29 65.32 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 179.182 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.655 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -62.05 -35.82 79.78 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.283 -0.885 . . . . 0.0 109.164 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.706 HD12 ' HB2' ' A' ' 35' ' ' ALA . 3.7 mt -59.44 -52.15 66.85 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.433 -0.792 . . . . 0.0 110.314 -179.758 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.524 ' HA ' HD13 ' A' ' 48' ' ' ILE . 43.0 mmtt -64.39 -25.67 68.13 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.106 -0.997 . . . . 0.0 109.998 -179.119 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.4 m-20 -76.46 -18.07 58.98 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.054 -1.029 . . . . 0.0 109.621 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.534 ' O ' ' CB ' ' A' ' 51' ' ' ALA . 0.0 OUTLIER -90.18 -12.79 37.1 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.186 -0.946 . . . . 0.0 109.294 179.76 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.832 HD11 ' CD1' ' A' ' 28' ' ' TYR . 1.2 mp -73.3 -35.38 46.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 179.529 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 5.7 tp -61.82 -24.03 66.62 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.074 -1.016 . . . . 0.0 110.081 -179.793 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 26.1 mttt -121.76 -1.72 9.42 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.818 -1.176 . . . . 0.0 110.076 -179.822 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.534 ' CB ' ' O ' ' A' ' 47' ' ' GLU . . . -101.11 -28.11 12.88 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.111 -0.993 . . . . 0.0 109.886 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.549 ' CE1' ' CD1' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -131.96 -0.03 3.82 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.094 -1.004 . . . . 0.0 109.87 -179.334 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.656 0 CA-C-O 118.027 -0.987 . . . . 0.0 109.572 179.769 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.423 ' OD1' ' N ' ' A' ' 9' ' ' ASN . 0.4 OUTLIER . . . . . 0 N--CA 1.494 1.771 0 CA-C-O 121.179 0.514 . . . . 0.0 110.632 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.54 ' HA ' ' HB2' ' A' ' 13' ' ' ASP . . . -69.8 0.2 6.1 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.177 -0.952 . . . . 0.0 110.818 -179.085 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.547 ' HG2' ' CG2' ' A' ' 32' ' ' ILE . 0.1 OUTLIER -44.63 -74.05 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.464 0 O-C-N 120.819 -1.176 . . . . 0.0 110.571 -179.712 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.49 ' HA ' ' HB ' ' A' ' 15' ' ' ILE . 76.0 mt-10 -75.76 -5.77 47.38 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.962 -1.086 . . . . 0.0 110.307 -179.103 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.54 ' HB2' ' HA ' ' A' ' 10' ' ' ALA . 1.0 OUTLIER -70.37 -44.82 67.3 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.208 -0.933 . . . . 0.0 109.333 179.8 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.408 ' CB ' ' HD3' ' A' ' 45' ' ' LYS . . . -87.25 -31.7 20.12 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.329 -0.857 . . . . 0.0 109.284 179.686 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.922 HG23 ' CE1' ' A' ' 29' ' ' PHE . 31.4 mt -62.39 -28.84 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 CA-C-O 121.917 0.865 . . . . 0.0 109.051 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.29 -10.96 12.53 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.808 -0.557 . . . . 0.0 110.145 -179.087 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -101.27 -18.66 16.01 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.299 -0.876 . . . . 0.0 109.526 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.59 ' HG ' ' CE ' ' A' ' 45' ' ' LYS . 4.2 mm? -90.02 -56.07 3.37 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.278 -0.889 . . . . 0.0 109.824 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.6 tttp -49.5 -29.59 6.96 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.4 -0.813 . . . . 0.0 109.908 -179.288 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.0 tttp -86.7 -29.53 22.36 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.1 -1.0 . . . . 0.0 109.715 -179.801 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.23 -33.99 75.41 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.27 -0.894 . . . . 0.0 109.713 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.721 ' O ' HG23 ' A' ' 24' ' ' THR . . . 131.04 -45.15 1.15 Allowed Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.414 -1.475 . . . . 0.0 109.414 -179.854 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.476 HD13 ' CG2' ' A' ' 48' ' ' ILE . 66.0 mt -45.62 136.6 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.272 -1.134 . . . . 0.0 109.517 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.721 HG23 ' O ' ' A' ' 22' ' ' GLY . 64.1 p -137.74 25.22 2.84 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.249 -0.907 . . . . 0.0 109.457 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 9.8 t -65.11 156.63 30.96 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.281 -0.887 . . . . 0.0 109.329 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.48 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 68.7 m-20 -96.45 -6.98 36.03 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.223 -0.923 . . . . 0.0 109.597 -179.871 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.528 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 8.6 t80 -81.83 -19.27 41.43 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 120.971 -1.081 . . . . 0.0 109.013 179.625 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.629 ' CD2' HG12 ' A' ' 48' ' ' ILE . 22.2 m-30 -97.16 -11.82 23.84 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.39 -0.819 . . . . 0.0 109.615 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.922 ' CE1' HG23 ' A' ' 15' ' ' ILE . 9.8 m-85 -112.55 -49.96 2.92 Favored 'General case' 0 C--N 1.297 -1.697 0 O-C-N 121.296 -0.877 . . . . 0.0 109.45 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.48 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 8.5 t30 -62.19 -40.55 96.43 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.581 -0.699 . . . . 0.0 109.285 179.501 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.16 -1.2 43.64 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.39 -0.819 . . . . 0.0 109.886 -179.686 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.646 ' HA ' HD21 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -76.45 -55.93 9.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.108 -0.995 . . . . 0.0 109.611 -179.659 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.597 ' N ' HG22 ' A' ' 32' ' ' ILE . 6.8 t-20 -69.24 -6.42 29.07 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.136 -0.977 . . . . 0.0 109.193 179.77 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.48 ' O ' ' O ' ' A' ' 35' ' ' ALA . 4.2 mttt -103.38 -20.63 14.01 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.255 -0.903 . . . . 0.0 109.636 -179.838 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.515 ' HB3' HG22 ' A' ' 41' ' ' VAL . . . -40.29 164.09 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.747 0 CA-C-O 121.625 0.726 . . . . 0.0 110.175 -179.568 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.6 mttp -51.4 -78.93 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.336 -0.852 . . . . 0.0 110.165 -179.629 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.873 HG21 ' OE2' ' A' ' 39' ' ' GLU . 4.8 t -128.76 -154.09 0.61 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.186 -0.946 . . . . 0.0 109.724 -179.555 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.665 ' N ' HG23 ' A' ' 37' ' ' THR . 12.3 t -75.79 -53.9 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 O-C-N 121.119 -0.988 . . . . 0.0 109.845 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.873 ' OE2' HG21 ' A' ' 37' ' ' THR . 1.3 pt-20 -55.36 -22.6 20.21 Favored 'General case' 0 C--N 1.296 -1.732 0 O-C-N 121.007 -1.058 . . . . 0.0 108.575 179.542 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.459 ' O ' ' HB3' ' A' ' 44' ' ' LEU . 20.0 tp10 -84.9 -32.82 22.94 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.881 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.796 HG23 ' O ' ' A' ' 37' ' ' THR . 53.9 t -66.62 -59.96 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.982 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.432 ' O ' ' OD1' ' A' ' 46' ' ' ASN . 10.3 m120 -58.75 -34.93 71.95 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.474 -0.766 . . . . 0.0 109.735 179.574 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.85 -26.64 61.54 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.156 -0.965 . . . . 0.0 109.631 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.712 ' O ' HD12 ' A' ' 44' ' ' LEU . 0.3 OUTLIER -75.83 -30.15 58.86 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.139 -0.976 . . . . 0.0 108.464 179.502 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.59 ' CE ' ' HG ' ' A' ' 18' ' ' LEU . 0.0 OUTLIER -64.62 -26.21 68.3 Favored 'General case' 0 N--CA 1.487 1.408 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.369 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASN . . . . . 0.432 ' OD1' ' O ' ' A' ' 42' ' ' ASN . 23.1 m120 -80.18 -15.86 56.11 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.554 -0.716 . . . . 0.0 109.813 -179.657 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -83.01 -7.61 59.65 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.201 -0.937 . . . . 0.0 109.82 -179.837 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.629 HG12 ' CD2' ' A' ' 28' ' ' TYR . 2.4 mp -74.82 -46.67 40.46 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 O-C-N 120.966 -1.084 . . . . 0.0 108.586 179.348 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.2 mp -54.09 -40.12 66.97 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.311 -0.868 . . . . 0.0 109.105 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.6 tmtt? -80.4 -73.14 0.38 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.162 -0.962 . . . . 0.0 108.548 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.463 ' O ' ' HB3' ' A' ' 52' ' ' HIS . . . -55.88 161.46 2.23 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.075 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.625 ' CG ' ' O ' ' A' ' 52' ' ' HIS . 1.0 OUTLIER 64.73 10.46 6.04 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 120.911 -1.118 . . . . 0.0 108.964 179.674 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.453 0 O-C-N 120.963 -1.086 . . . . 0.0 109.455 179.722 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.666 ' OD1' HG22 ' A' ' 38' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.591 0 CA-C-O 121.353 0.597 . . . . 0.0 109.619 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.654 ' HB3' HG11 ' A' ' 41' ' ' VAL . . . -80.78 0.82 33.09 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.262 -0.899 . . . . 0.0 109.617 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.4 mtpm? -62.52 -88.01 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.171 -0.956 . . . . 0.0 109.969 -179.463 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.431 ' O ' ' HB2' ' A' ' 16' ' ' ALA . 4.7 tt0 -57.83 -17.15 14.32 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.159 -0.963 . . . . 0.0 110.077 -179.3 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.457 ' HB2' ' HA ' ' A' ' 10' ' ' ALA . 61.8 m-20 -59.94 -73.61 0.09 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.097 -1.002 . . . . 0.0 109.475 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.545 ' O ' HD12 ' A' ' 18' ' ' LEU . . . -68.47 -42.36 78.84 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.228 -0.92 . . . . 0.0 109.461 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.748 HG23 ' CE1' ' A' ' 29' ' ' PHE . 10.6 mt -49.86 -30.82 6.33 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.524 0 O-C-N 121.206 -0.934 . . . . 0.0 109.033 179.796 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.431 ' HB2' ' O ' ' A' ' 12' ' ' GLU . . . -66.4 -38.74 88.17 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.633 -0.667 . . . . 0.0 110.582 -178.43 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.3 tp10 -76.21 -25.0 54.67 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.179 -0.951 . . . . 0.0 110.763 -178.994 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.581 HD13 ' HB3' ' A' ' 45' ' ' LYS . 0.9 OUTLIER -88.69 -30.21 19.29 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 120.929 -1.107 . . . . 0.0 110.37 -178.945 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.6 -29.67 68.14 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.305 -0.872 . . . . 0.0 109.504 -179.516 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -86.29 -26.37 24.98 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.335 -0.853 . . . . 0.0 109.211 179.844 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.31 -30.57 69.59 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.236 -0.915 . . . . 0.0 109.316 179.786 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 121.19 -28.99 5.88 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.779 -1.328 . . . . 0.0 109.779 179.781 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.596 ' CD1' ' CE1' ' A' ' 52' ' ' HIS . 26.8 mt -48.87 110.51 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.153 -1.204 . . . . 0.0 109.485 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -105.99 -7.12 18.28 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.213 -0.929 . . . . 0.0 109.4 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -48.12 118.62 2.47 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.25 -0.906 . . . . 0.0 109.182 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.505 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 0.3 OUTLIER -80.05 6.45 11.46 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.336 -0.853 . . . . 0.0 109.644 -179.868 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.442 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 20.4 t80 -78.85 -22.58 45.89 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.107 -0.996 . . . . 0.0 109.462 -179.802 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.863 ' CE2' HG23 ' A' ' 48' ' ' ILE . 22.6 m-85 -94.75 -45.2 7.44 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.179 -0.95 . . . . 0.0 108.821 179.464 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.748 ' CE1' HG23 ' A' ' 15' ' ' ILE . 14.4 m-85 -61.03 -50.95 71.26 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 179.08 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.505 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 1.9 t30 -60.34 -31.32 70.2 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.419 -0.801 . . . . 0.0 108.901 179.615 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.04 -22.08 53.52 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.453 -0.779 . . . . 0.0 109.682 -179.751 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.714 HD11 ' HG2' ' A' ' 45' ' ' LYS . 0.8 OUTLIER -68.28 -34.09 64.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.212 -0.93 . . . . 0.0 108.837 179.914 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -75.91 -4.54 41.49 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.213 -0.929 . . . . 0.0 109.021 179.366 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.448 ' O ' ' C ' ' A' ' 35' ' ' ALA . 6.5 mmmt -108.83 -17.78 13.85 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.212 -0.93 . . . . 0.0 109.531 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.538 ' HB2' HD12 ' A' ' 44' ' ' LEU . . . -38.45 154.82 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.71 -0.619 . . . . 0.0 110.127 -179.711 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.408 ' CE ' ' HA ' ' A' ' 36' ' ' LYS . 0.5 OUTLIER -87.74 -73.09 0.49 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.295 -0.878 . . . . 0.0 109.954 -179.791 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.668 ' O ' HG23 ' A' ' 41' ' ' VAL . 0.8 OUTLIER -105.89 -177.38 3.35 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.152 -0.968 . . . . 0.0 109.365 -179.741 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.666 HG22 ' OD1' ' A' ' 9' ' ' ASN . 92.4 t -67.44 -30.05 47.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.134 -0.979 . . . . 0.0 109.028 179.649 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.56 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 3.0 pt-20 -71.33 -25.29 62.34 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 178.254 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.532 ' N ' ' HG3' ' A' ' 39' ' ' GLU . 4.5 mm-40 -80.97 -30.74 35.05 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 178.592 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.668 HG23 ' O ' ' A' ' 37' ' ' THR . 48.7 t -67.41 -61.16 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 179.038 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 58.1 m-80 -62.05 -29.4 70.27 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.589 -0.695 . . . . 0.0 109.306 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.56 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -71.17 -29.4 65.15 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.259 -0.901 . . . . 0.0 109.497 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.538 HD12 ' HB2' ' A' ' 35' ' ' ALA . 7.4 mt -75.1 -47.94 26.23 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.117 -0.989 . . . . 0.0 110.947 -179.228 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.714 ' HG2' HD11 ' A' ' 32' ' ' ILE . 0.3 OUTLIER -75.29 -43.45 51.09 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.861 -1.15 . . . . 0.0 110.081 -178.888 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -68.32 -21.08 64.77 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.029 -1.045 . . . . 0.0 109.436 179.782 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.481 ' HG2' ' HB2' ' A' ' 51' ' ' ALA . 14.6 tt0 -79.79 -7.11 58.47 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.176 -0.952 . . . . 0.0 109.674 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.863 HG23 ' CE2' ' A' ' 28' ' ' TYR . 83.3 mt -68.95 -41.67 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 178.729 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.414 ' HA ' HD23 ' A' ' 49' ' ' LEU . 12.7 mt -47.32 -32.33 4.66 Favored 'General case' 0 C--N 1.302 -1.472 0 C-N-CA 119.688 -0.805 . . . . 0.0 109.435 179.613 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.7 mttm -115.66 -3.61 12.28 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.977 -1.077 . . . . 0.0 110.177 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.481 ' HB2' ' HG2' ' A' ' 47' ' ' GLU . . . -100.58 -2.55 32.58 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.126 -0.984 . . . . 0.0 109.218 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.708 ' ND1' HG22 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -160.89 -164.97 1.28 Allowed 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.343 -0.848 . . . . 0.0 108.957 -179.614 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.604 ' N ' ' CG ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.49 1.542 0 O-C-N 121.11 -0.994 . . . . 0.0 109.277 -179.731 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.848 HD21 HG22 ' A' ' 38' ' ' VAL . 4.5 p30 . . . . . 0 N--CA 1.486 1.358 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.424 ' N ' ' CG ' ' A' ' 9' ' ' ASN . . . -81.56 -11.82 59.01 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 178.041 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.547 ' O ' HD12 ' A' ' 15' ' ' ILE . 1.3 ttpt -43.82 -64.22 0.7 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.459 -0.776 . . . . 0.0 110.926 -179.424 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -95.95 -22.83 17.16 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.895 -1.128 . . . . 0.0 111.18 -178.428 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -61.28 -28.78 69.43 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.794 -1.191 . . . . 0.0 109.876 -179.469 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.615 ' O ' HD23 ' A' ' 18' ' ' LEU . . . -96.65 -43.62 7.48 Favored 'General case' 0 C--N 1.301 -1.5 0 O-C-N 121.096 -1.003 . . . . 0.0 108.853 179.549 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.641 HG23 ' CE1' ' A' ' 29' ' ' PHE . 88.0 mt -54.31 -28.72 18.69 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 O-C-N 121.66 -0.65 . . . . 0.0 109.705 179.815 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.483 ' HA ' ' CE ' ' A' ' 19' ' ' LYS . . . -64.06 -37.51 87.71 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.42 -0.8 . . . . 0.0 109.639 -179.03 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.574 ' O ' ' HB2' ' A' ' 21' ' ' ALA . 0.5 OUTLIER -86.86 9.6 18.7 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.386 -0.822 . . . . 0.0 109.913 -179.48 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.615 HD23 ' O ' ' A' ' 14' ' ' ALA . 0.5 OUTLIER -101.04 -47.93 4.59 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.249 -0.907 . . . . 0.0 109.627 -179.766 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.483 ' CE ' ' HA ' ' A' ' 16' ' ' ALA . 2.1 ptpt -59.43 -28.76 67.24 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.457 -0.777 . . . . 0.0 109.345 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.06 -16.79 23.5 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.41 -0.807 . . . . 0.0 108.966 179.664 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ALA . . . . . 0.574 ' HB2' ' O ' ' A' ' 17' ' ' GLU . . . -69.09 -29.92 68.11 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.334 -0.854 . . . . 0.0 109.532 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 126.87 -12.76 6.85 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.768 -1.333 . . . . 0.0 109.768 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.651 HD12 HG21 ' A' ' 48' ' ' ILE . 0.2 OUTLIER -101.97 123.05 54.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.101 -1.235 . . . . 0.0 109.696 -179.792 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -122.89 28.62 7.16 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.3 -0.875 . . . . 0.0 108.986 179.468 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.98 177.81 2.48 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.363 -0.836 . . . . 0.0 109.64 -179.748 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.476 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 9.0 m-20 -122.22 0.78 9.62 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.26 -0.9 . . . . 0.0 109.659 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.591 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 2.3 t80 -81.15 -40.41 24.02 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.159 -0.963 . . . . 0.0 109.569 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.605 ' CE2' HG23 ' A' ' 48' ' ' ILE . 21.5 m-85 -78.34 -31.05 48.42 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.351 -0.843 . . . . 0.0 110.198 -179.008 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.641 ' CE1' HG23 ' A' ' 15' ' ' ILE . 6.7 m-30 -75.53 -49.24 19.27 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.282 -0.886 . . . . 0.0 109.924 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.476 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 0.4 OUTLIER -59.37 -25.65 64.42 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.156 -0.965 . . . . 0.0 110.175 -179.504 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -87.15 -16.18 36.19 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.97 -1.081 . . . . 0.0 110.44 -179.029 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 1.036 HD11 ' HD2' ' A' ' 45' ' ' LYS . 0.6 OUTLIER -64.8 -38.16 82.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.096 -1.002 . . . . 0.0 109.873 -179.596 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 45.9 p-10 -79.74 -8.65 59.37 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.023 -1.048 . . . . 0.0 110.348 -179.238 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.437 ' O ' ' C ' ' A' ' 35' ' ' ALA . 3.5 mtmt -99.64 -17.16 17.93 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.962 -1.086 . . . . 0.0 109.976 -179.821 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.737 ' HB3' HG22 ' A' ' 41' ' ' VAL . . . -43.14 154.54 0.07 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.23 -0.919 . . . . 0.0 109.554 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.502 ' HB2' ' HG3' ' A' ' 40' ' ' GLU . 0.1 OUTLIER -73.09 -59.49 2.68 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.077 -1.014 . . . . 0.0 109.634 -179.775 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.859 ' O ' HG23 ' A' ' 41' ' ' VAL . 70.2 p -124.01 -167.0 1.57 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.09 -1.006 . . . . 0.0 109.754 -179.834 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.848 HG22 HD21 ' A' ' 9' ' ' ASN . 16.0 t -66.63 -52.09 49.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.406 -0.809 . . . . 0.0 109.587 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.765 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 11.7 pt-20 -52.36 -26.51 12.55 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 179.597 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.502 ' HG3' ' HB2' ' A' ' 36' ' ' LYS . 27.6 mm-40 -80.45 -35.6 34.7 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.321 -0.862 . . . . 0.0 108.763 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.859 HG23 ' O ' ' A' ' 37' ' ' THR . 7.0 t -67.88 -66.88 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 179.051 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -53.85 -28.6 36.9 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.565 -0.709 . . . . 0.0 109.375 179.391 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.765 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -66.88 -46.18 75.77 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.287 -0.883 . . . . 0.0 109.605 -179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.1 mt -57.85 -37.14 73.34 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.244 -0.91 . . . . 0.0 109.985 -179.642 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 1.036 ' HD2' HD11 ' A' ' 32' ' ' ILE . 0.2 OUTLIER -63.4 -34.01 76.79 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.087 -1.008 . . . . 0.0 109.5 -179.847 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 8.4 m-20 -77.77 -30.23 51.31 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.196 -0.94 . . . . 0.0 109.504 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -57.09 -23.33 46.14 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.338 -0.851 . . . . 0.0 109.165 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.651 HG21 HD12 ' A' ' 23' ' ' ILE . 41.4 mt -66.64 -45.7 87.78 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 179.518 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.443 HD12 ' HA ' ' A' ' 49' ' ' LEU . 1.2 mp -48.17 -36.78 14.22 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.178 -0.951 . . . . 0.0 108.558 179.046 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.6 mttt -90.53 -80.78 0.32 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.42 -0.8 . . . . 0.0 108.917 179.396 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.499 ' O ' ' HB3' ' A' ' 52' ' ' HIS . . . -54.81 151.57 8.32 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 178.809 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.557 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 0.2 OUTLIER 64.95 165.7 0.16 Allowed 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.658 -1.276 . . . . 0.0 107.784 -179.276 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.557 ' HB3' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 118.045 -0.979 . . . . 0.0 109.414 -179.559 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.435 ' ND2' ' CG2' ' A' ' 38' ' ' VAL . 1.6 p30 . . . . . 0 N--CA 1.492 1.664 0 CA-C-O 121.017 0.436 . . . . 0.0 110.061 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.604 ' CB ' HG13 ' A' ' 38' ' ' VAL . . . -55.77 -16.82 4.87 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 120.979 -1.076 . . . . 0.0 109.619 -179.883 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.543 ' HG2' HG21 ' A' ' 32' ' ' ILE . 2.5 tttp -40.85 -35.47 0.51 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.196 -0.94 . . . . 0.0 110.241 -179.734 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -88.07 -32.6 18.65 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.109 -0.994 . . . . 0.0 110.038 -179.51 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.82 -56.23 21.57 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.154 -0.966 . . . . 0.0 109.399 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.461 ' HB1' ' HG2' ' A' ' 45' ' ' LYS . . . -62.68 -55.7 24.47 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.294 -0.879 . . . . 0.0 110.149 -179.774 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.777 ' CG1' HD13 ' A' ' 32' ' ' ILE . 73.0 mt -53.41 -30.85 18.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.151 -0.968 . . . . 0.0 109.48 -179.819 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.29 -38.73 88.44 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.462 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 2.4 pt-20 -83.57 1.88 39.94 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 109.111 -0.699 . . . . 0.0 109.111 179.634 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.702 HD13 ' O ' ' A' ' 18' ' ' LEU . 1.1 tm? -97.86 -53.64 3.34 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.286 -0.884 . . . . 0.0 109.377 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.425 ' O ' ' HG2' ' A' ' 19' ' ' LYS . 5.7 ttmt -56.71 -18.2 11.6 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.32 -0.863 . . . . 0.0 109.294 -179.857 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.4 ttmt -96.16 -26.15 15.57 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.315 -0.865 . . . . 0.0 109.264 179.743 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.33 -49.74 75.18 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.257 -0.902 . . . . 0.0 109.557 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 138.86 -3.57 2.86 Favored Glycine 0 N--CA 1.49 2.236 0 C-N-CA 119.665 -1.255 . . . . 0.0 110.133 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.489 ' CD1' HG21 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -100.18 149.26 6.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 120.867 -1.372 . . . . 0.0 109.574 179.846 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -133.23 11.58 4.19 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.432 -0.792 . . . . 0.0 109.234 179.755 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.34 139.88 58.53 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.234 -0.916 . . . . 0.0 109.447 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.401 ' N ' ' OD1' ' A' ' 26' ' ' ASP . 1.3 m-20 -87.64 6.07 36.45 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.313 -0.867 . . . . 0.0 109.784 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.688 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 8.3 t80 -80.26 -17.23 52.78 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.119 -0.988 . . . . 0.0 109.321 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.826 ' HB3' HD11 ' A' ' 48' ' ' ILE . 18.1 m-85 -101.36 -28.46 12.59 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.226 -0.921 . . . . 0.0 109.12 179.687 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 0.844 ' HA ' HD12 ' A' ' 32' ' ' ILE . 9.5 m-85 -83.07 -47.05 12.08 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.474 -0.766 . . . . 0.0 109.193 179.536 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 40.7 m-20 -60.78 -36.63 79.48 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.479 -0.763 . . . . 0.0 109.406 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.6 -13.7 59.84 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.342 -0.849 . . . . 0.0 109.691 -179.55 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.844 HD12 ' HA ' ' A' ' 29' ' ' PHE . 4.3 mt -68.01 -48.61 73.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.268 -0.895 . . . . 0.0 109.351 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.52 ' HB2' ' CE ' ' A' ' 11' ' ' LYS . 8.4 t30 -64.92 -22.53 67.01 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.218 -0.926 . . . . 0.0 109.624 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.473 ' O ' ' O ' ' A' ' 35' ' ' ALA . 5.7 mptp? -96.54 -14.71 22.07 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.178 -0.951 . . . . 0.0 109.744 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.907 ' HB3' HG22 ' A' ' 41' ' ' VAL . . . -43.61 168.68 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.315 -0.865 . . . . 0.0 109.795 -179.67 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.4 ' HB2' ' HG2' ' A' ' 40' ' ' GLU . 1.7 tttm -77.3 -78.73 0.12 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.211 -0.931 . . . . 0.0 109.582 -179.965 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.961 ' O ' HG23 ' A' ' 41' ' ' VAL . 14.8 t -121.54 -174.34 2.84 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.233 -0.917 . . . . 0.0 108.868 179.787 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.604 HG13 ' CB ' ' A' ' 10' ' ' ALA . 24.9 t -59.79 -57.31 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.105 -0.997 . . . . 0.0 109.436 179.828 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.556 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 73.2 mm-40 -51.37 -19.51 1.36 Allowed 'General case' 0 C--N 1.295 -1.797 0 O-C-N 120.974 -1.079 . . . . 0.0 109.414 -179.639 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.495 ' OE1' ' HA ' ' A' ' 40' ' ' GLU . 4.6 tp10 -90.5 -33.24 16.02 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.924 -1.11 . . . . 0.0 109.181 179.596 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.961 HG23 ' O ' ' A' ' 37' ' ' THR . 2.2 t -76.7 -66.27 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.456 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 178.372 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.407 ' OD1' ' C ' ' A' ' 42' ' ' ASN . 0.0 OUTLIER -46.94 -40.73 14.82 Favored 'General case' 0 C--N 1.296 -1.738 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.19 178.317 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.556 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -68.49 -37.37 80.05 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.263 -0.898 . . . . 0.0 109.748 179.884 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.726 ' O ' HD12 ' A' ' 44' ' ' LEU . 0.3 OUTLIER -65.28 -30.56 71.44 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.152 -0.967 . . . . 0.0 109.051 -179.916 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.794 ' CE ' HD11 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -63.39 -43.94 96.13 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.179 -0.95 . . . . 0.0 109.181 179.641 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -75.76 -13.93 60.31 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.426 -0.796 . . . . 0.0 109.537 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -79.7 -28.33 40.64 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.29 -0.881 . . . . 0.0 109.716 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.826 HD11 ' HB3' ' A' ' 28' ' ' TYR . 14.4 mt -56.15 -41.61 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.115 -0.991 . . . . 0.0 108.725 179.429 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.416 ' HA ' HD23 ' A' ' 49' ' ' LEU . 89.7 mt -45.24 -36.1 3.74 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.31 -0.869 . . . . 0.0 109.978 179.722 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.4 mttt -117.68 2.17 12.27 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.985 -1.072 . . . . 0.0 110.789 -179.361 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -100.83 -7.74 23.29 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.98 -1.075 . . . . 0.0 109.503 179.79 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.555 ' HB3' ' OH ' ' A' ' 28' ' ' TYR . 0.5 OUTLIER -145.13 8.74 1.23 Allowed 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.153 -0.967 . . . . 0.0 110.232 -178.822 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.522 0 CA-C-O 117.95 -1.024 . . . . 0.0 109.449 -179.94 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.432 ' OD1' HG22 ' A' ' 38' ' ' VAL . 0.7 OUTLIER . . . . . 0 N--CA 1.494 1.735 0 CA-C-O 121.284 0.564 . . . . 0.0 110.995 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.459 ' O ' ' C ' ' A' ' 11' ' ' LYS . . . -54.93 -13.2 1.01 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.181 -0.949 . . . . 0.0 111.037 -179.076 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.743 ' O ' HD12 ' A' ' 15' ' ' ILE . 0.0 OUTLIER -36.9 -43.01 0.42 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.231 -0.918 . . . . 0.0 110.982 -179.407 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -100.63 -21.07 15.37 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.888 -1.132 . . . . 0.0 110.28 -179.407 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -69.21 -15.95 63.5 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.044 -1.035 . . . . 0.0 109.454 -179.705 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -105.75 -40.61 5.68 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.346 -0.846 . . . . 0.0 108.927 179.575 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 1.125 HG23 ' CZ ' ' A' ' 29' ' ' PHE . 55.2 mt -62.81 -28.6 45.27 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 O-C-N 121.494 -0.754 . . . . 0.0 109.17 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.5 -22.67 22.1 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.404 -0.81 . . . . 0.0 109.675 -179.466 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -85.26 -28.06 25.6 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.377 -0.827 . . . . 0.0 110.343 -179.617 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.524 ' CD1' ' HE2' ' A' ' 45' ' ' LYS . 2.2 mt -84.25 -32.33 24.51 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.14 -0.975 . . . . 0.0 110.693 -178.964 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -56.5 -21.64 27.36 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 120.97 -1.081 . . . . 0.0 109.736 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 6.5 tttm -100.9 -29.46 12.2 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.21 -0.931 . . . . 0.0 110.038 -179.715 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -69.14 -33.32 73.25 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.136 -0.978 . . . . 0.0 109.741 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 124.81 -26.58 5.62 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.356 -1.497 . . . . 0.0 109.356 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ILE . . . . . 0.552 HG12 ' CE1' ' A' ' 52' ' ' HIS . 62.0 mt -66.2 106.44 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.368 -1.077 . . . . 0.0 109.393 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 9.6 p -128.99 17.67 6.15 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.085 -1.009 . . . . 0.0 109.56 -179.83 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 65.6 m -65.62 152.63 43.69 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.255 -0.903 . . . . 0.0 109.242 179.807 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.458 ' O ' ' CB ' ' A' ' 30' ' ' ASN . 7.9 m-20 -87.21 -3.08 59.03 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.189 -0.944 . . . . 0.0 109.787 -179.765 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.722 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 18.0 t80 -80.08 -7.5 58.91 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.155 -0.966 . . . . 0.0 109.269 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.915 ' O ' HD13 ' A' ' 32' ' ' ILE . 37.8 m-85 -118.49 -34.78 3.92 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 179.308 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' PHE . . . . . 1.125 ' CZ ' HG23 ' A' ' 15' ' ' ILE . 6.1 m-30 -78.58 -40.9 33.37 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 178.838 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.458 ' CB ' ' O ' ' A' ' 26' ' ' ASP . 19.8 t30 -68.62 -49.61 57.87 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.465 -0.772 . . . . 0.0 108.966 179.527 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ALA . . . . . 0.407 ' HA ' ' HB2' ' A' ' 34' ' ' LYS . . . -69.06 -12.85 62.06 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.495 -0.753 . . . . 0.0 109.603 -179.702 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ILE . . . . . 0.915 HD13 ' O ' ' A' ' 28' ' ' TYR . 0.7 OUTLIER -73.7 -50.52 29.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.262 -0.899 . . . . 0.0 108.961 179.839 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASN . . . . . 0.53 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 17.2 p30 -79.7 -10.93 59.86 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.242 -0.911 . . . . 0.0 109.366 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.479 ' O ' ' O ' ' A' ' 35' ' ' ALA . 7.8 mmtt -91.29 -14.83 30.13 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.344 -0.848 . . . . 0.0 109.654 -179.686 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.479 ' O ' ' O ' ' A' ' 34' ' ' LYS . . . -55.09 -160.74 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.527 -0.733 . . . . 0.0 110.198 -179.517 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 27.8 mmtp -101.79 -62.87 1.2 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.103 -0.998 . . . . 0.0 110.401 -179.293 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.508 ' O ' HG23 ' A' ' 41' ' ' VAL . 66.6 p -125.86 178.02 5.97 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.945 -1.097 . . . . 0.0 110.082 -179.415 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.446 HG13 ' HB3' ' A' ' 10' ' ' ALA . 88.6 t -61.39 -34.46 61.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.331 -0.856 . . . . 0.0 109.331 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.13 -27.39 69.05 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 178.891 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.441 ' HG2' ' HB1' ' A' ' 35' ' ' ALA . 0.9 OUTLIER -79.58 -31.27 41.83 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.662 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 37' ' ' THR . 18.6 t -68.32 -67.53 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 178.796 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -49.56 -39.37 34.61 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.429 -0.794 . . . . 0.0 109.468 179.496 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.9 -38.96 93.01 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.294 -0.879 . . . . 0.0 109.619 -179.671 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.424 ' O ' HD12 ' A' ' 48' ' ' ILE . 7.6 mt -66.85 -46.61 74.54 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.282 -0.887 . . . . 0.0 110.258 -179.531 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.652 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.2 OUTLIER -65.61 -19.65 66.0 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.037 -1.04 . . . . 0.0 110.23 -179.243 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -79.84 -18.23 51.29 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.054 -1.029 . . . . 0.0 109.566 -179.757 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.539 ' O ' ' CB ' ' A' ' 51' ' ' ALA . 55.7 tt0 -90.76 -17.74 26.14 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.186 -0.946 . . . . 0.0 109.172 179.669 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.677 ' CG1' ' CD1' ' A' ' 28' ' ' TYR . 1.4 mt -68.6 -35.43 70.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.252 -0.905 . . . . 0.0 108.91 179.478 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 49' ' ' LEU . 14.5 tp -56.4 -30.05 62.29 Favored 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.162 -0.961 . . . . 0.0 109.324 179.646 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.419 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -122.28 5.87 9.68 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.197 -0.939 . . . . 0.0 109.889 -179.894 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ALA . . . . . 0.539 ' CB ' ' O ' ' A' ' 47' ' ' GLU . . . -101.39 -46.62 4.95 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.092 -1.005 . . . . 0.0 109.466 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.6 ' HB3' ' OH ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -112.66 -19.5 12.03 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.447 -0.783 . . . . 0.0 109.661 -178.975 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.486 ' N ' ' CD2' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.489 1.512 0 CA-C-O 118.012 -0.994 . . . . 0.0 109.42 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.592 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.404 ' O ' HG22 ' A' ' 2' ' ' ILE . 25.5 mt -137.1 46.27 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 O-C-N 121.213 -0.929 . . . . 0.0 109.47 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.73 -26.48 68.39 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.155 -0.966 . . . . 0.0 108.43 179.512 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -50.71 -23.94 3.03 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.557 -0.715 . . . . 0.0 109.229 179.271 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.511 ' O ' ' N ' ' A' ' 7' ' ' LEU . 1.7 t90 -44.52 -62.94 1.01 Allowed 'General case' 0 C--N 1.305 -1.34 0 O-C-N 121.503 -0.748 . . . . 0.0 111.091 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.873 HD13 ' O ' ' A' ' 6' ' ' LEU . 3.4 tm? -30.47 -38.51 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.932 -0.48 . . . . 0.0 110.541 -178.637 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.8 HD21 ' CG2' ' A' ' 41' ' ' VAL . 4.5 tp 69.94 -122.78 0.12 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.281 -0.887 . . . . 0.0 109.755 179.22 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.513 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 0.6 OUTLIER 66.4 36.13 5.36 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.802 -1.186 . . . . 0.0 109.6 -179.814 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.468 ' ND2' ' HG ' ' A' ' 7' ' ' LEU . 1.8 p30 -131.28 -49.2 1.0 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.273 -0.892 . . . . 0.0 109.87 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.455 ' HB3' HG21 ' A' ' 41' ' ' VAL . . . -80.43 -15.37 56.95 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.1 -1.0 . . . . 0.0 109.501 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.608 ' O ' HD12 ' A' ' 15' ' ' ILE . 0.1 OUTLIER -63.44 -32.6 74.09 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.271 -0.893 . . . . 0.0 109.91 -179.44 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.474 ' HG2' ' CE ' ' A' ' 11' ' ' LYS . 3.8 mm-40 -92.36 -44.12 8.88 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.865 -1.147 . . . . 0.0 109.627 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -65.94 -18.71 65.52 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.132 -0.98 . . . . 0.0 109.696 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.53 ' HB1' HD11 ' A' ' 18' ' ' LEU . . . -99.0 -43.83 6.54 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.313 -0.867 . . . . 0.0 109.262 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.608 HD12 ' O ' ' A' ' 11' ' ' LYS . 58.6 mt -62.83 -29.04 46.14 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.529 0 O-C-N 121.491 -0.756 . . . . 0.0 109.371 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.04 -15.55 63.65 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.499 -0.75 . . . . 0.0 110.342 -178.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.46 ' O ' ' HG2' ' A' ' 17' ' ' GLU . 32.7 tt0 -116.98 -14.41 10.62 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.074 -1.016 . . . . 0.0 109.857 -179.691 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.623 HD22 ' HG2' ' A' ' 45' ' ' LYS . 5.7 mt -90.21 -33.0 16.35 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.111 -0.993 . . . . 0.0 109.459 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.1 ptmm? -56.84 -19.54 17.98 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.14 -0.975 . . . . 0.0 108.702 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -86.95 -31.22 20.76 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.466 -0.771 . . . . 0.0 108.973 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.65 -20.25 7.76 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.387 -0.821 . . . . 0.0 109.389 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 116.14 -39.16 2.8 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.42 -1.472 . . . . 0.0 109.42 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.965 HD13 HG21 ' A' ' 48' ' ' ILE . 13.0 mt -54.03 107.89 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.224 -1.162 . . . . 0.0 109.332 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -115.2 7.51 15.32 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.259 -0.901 . . . . 0.0 109.629 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.3 t -59.95 152.98 22.29 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.15 -0.969 . . . . 0.0 109.265 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.498 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 9.4 p-10 -100.46 -9.13 22.45 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.238 -0.914 . . . . 0.0 109.578 -179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.538 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 15.1 t80 -74.83 -24.45 58.61 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.078 -1.014 . . . . 0.0 109.583 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.639 ' CG ' ' CG1' ' A' ' 48' ' ' ILE . 23.6 m-85 -94.95 -42.39 8.68 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.217 -0.927 . . . . 0.0 109.171 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.579 ' CD1' HG12 ' A' ' 15' ' ' ILE . 5.3 m-85 -62.81 -45.87 90.59 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 121.54 -0.725 . . . . 0.0 109.734 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.498 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 0.4 OUTLIER -65.78 -39.55 91.1 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.13 -0.981 . . . . 0.0 109.626 -179.844 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.6 -10.73 60.21 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.206 -0.934 . . . . 0.0 109.519 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.541 HD11 ' CD ' ' A' ' 45' ' ' LYS . 0.3 OUTLIER -65.94 -24.36 33.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.399 -0.813 . . . . 0.0 109.071 -179.869 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.8 m-20 -80.51 -37.61 31.31 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.315 -0.865 . . . . 0.0 109.764 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -57.88 -20.44 36.8 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.259 -0.901 . . . . 0.0 109.438 -179.824 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.72 ' HB3' HG22 ' A' ' 41' ' ' VAL . . . -47.13 155.93 0.26 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.248 -0.908 . . . . 0.0 109.343 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.494 ' CD ' ' N ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -90.94 -55.3 3.61 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.323 -0.861 . . . . 0.0 109.382 -179.967 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.625 HG23 ' H ' ' A' ' 39' ' ' GLU . 13.7 t -125.02 -175.79 3.39 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.244 -0.91 . . . . 0.0 109.466 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 95.9 t -63.21 -30.32 49.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.049 -1.032 . . . . 0.0 109.267 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.807 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 1.9 tt0 -72.14 -21.7 61.42 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 179.456 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.591 ' HG2' HG22 ' A' ' 37' ' ' THR . 37.6 mm-40 -86.48 -31.09 21.52 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.39 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.8 ' CG2' HD21 ' A' ' 7' ' ' LEU . 24.5 t -72.72 -56.68 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 179.108 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 17.4 m120 -62.86 -27.93 69.68 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 178.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.807 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -66.87 -46.74 74.01 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.485 -0.76 . . . . 0.0 109.448 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.706 ' O ' HD12 ' A' ' 48' ' ' ILE . 2.1 mt -59.2 -35.15 73.1 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.233 -0.917 . . . . 0.0 108.87 179.748 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.714 ' HA ' HD13 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -62.0 -40.48 95.8 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.321 -0.862 . . . . 0.0 108.973 179.494 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.481 ' O ' ' HB2' ' A' ' 49' ' ' LEU . 75.1 m-20 -65.9 -20.69 66.31 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.315 -0.865 . . . . 0.0 109.04 179.691 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.07 -36.31 61.77 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.298 -0.876 . . . . 0.0 109.659 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.965 HG21 HD13 ' A' ' 23' ' ' ILE . 3.7 mp -58.47 -27.41 33.39 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 O-C-N 120.959 -1.088 . . . . 0.0 108.376 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.481 ' HB2' ' O ' ' A' ' 46' ' ' ASN . 2.5 mm? -56.07 -39.0 71.42 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.435 -0.79 . . . . 0.0 109.072 179.189 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.429 ' O ' ' C ' ' A' ' 51' ' ' ALA . 0.0 OUTLIER -109.63 -62.24 1.53 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.212 -0.93 . . . . 0.0 109.818 -179.401 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.429 ' C ' ' O ' ' A' ' 50' ' ' LYS . . . -41.23 -37.81 1.01 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.295 -0.878 . . . . 0.0 109.966 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.713 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 0.0 OUTLIER -115.62 129.07 56.37 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.349 -0.845 . . . . 0.0 109.083 -179.547 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.713 ' HB3' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 118.068 -0.968 . . . . 0.0 109.307 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 17.7 p . . . . . 0 N--CA 1.49 1.551 0 CA-C-O 121.367 0.603 . . . . 0.0 109.462 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -114.84 49.46 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.332 -0.855 . . . . 0.0 109.339 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -72.11 -4.5 29.38 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.231 -0.918 . . . . 0.0 109.072 179.302 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.471 ' O ' ' O ' ' A' ' 5' ' ' TRP . 0.4 OUTLIER -63.66 -9.45 13.94 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.397 -0.814 . . . . 0.0 109.842 -179.978 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.482 ' O ' ' N ' ' A' ' 7' ' ' LEU . 1.7 t90 -52.67 -105.45 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.226 -0.921 . . . . 0.0 109.879 -179.806 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.516 HD23 ' HA ' ' A' ' 6' ' ' LEU . 4.0 mt 41.04 23.92 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.666 -1.272 . . . . 0.0 110.869 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.903 HD11 HG21 ' A' ' 41' ' ' VAL . 0.1 OUTLIER 72.9 -16.11 0.48 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 120.879 -1.138 . . . . 0.0 110.921 179.463 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.41 ' CD ' ' HD2' ' A' ' 11' ' ' LYS . 0.3 OUTLIER -61.21 88.96 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.509 0 O-C-N 120.569 -1.332 . . . . 0.0 109.679 -179.58 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.809 ' ND2' HG22 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -143.0 -65.12 0.4 Allowed 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 179.431 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.51 -6.92 58.92 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 178.163 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.418 ' HE2' ' CG ' ' A' ' 33' ' ' ASN . 13.6 tttm -61.31 -35.71 78.11 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 121.614 -0.678 . . . . 0.0 109.985 -179.666 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -89.25 -51.3 5.64 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.05 -1.031 . . . . 0.0 109.115 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -53.97 -21.72 8.72 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.566 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -89.51 -59.16 2.28 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 121.558 -0.714 . . . . 0.0 109.14 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.497 ' HA ' ' HG ' ' A' ' 18' ' ' LEU . 0.2 OUTLIER -41.09 -36.98 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 O-C-N 121.52 -0.737 . . . . 0.0 109.392 179.978 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.22 -48.68 77.26 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.587 ' C ' HD23 ' A' ' 18' ' ' LEU . 3.7 mm-40 -73.27 -12.68 60.94 Favored 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.834 -0.541 . . . . 0.0 110.79 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.838 HD23 ' N ' ' A' ' 18' ' ' LEU . 1.0 OUTLIER -88.43 -32.56 18.24 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.637 -1.29 . . . . 0.0 109.694 -179.307 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.29 -17.11 62.48 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.185 -0.947 . . . . 0.0 109.339 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.431 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 1.0 OUTLIER -96.55 -22.36 17.12 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.232 -0.918 . . . . 0.0 109.548 -179.873 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.17 -26.68 66.77 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.218 -0.926 . . . . 0.0 109.411 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 112.66 -23.78 14.52 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.48 HD12 ' NZ ' ' A' ' 45' ' ' LYS . 31.7 mt -75.09 92.57 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.288 -1.125 . . . . 0.0 109.735 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.1 p -95.66 5.5 51.28 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.126 -0.984 . . . . 0.0 109.127 179.366 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.7 t -57.18 138.34 54.75 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.318 -0.864 . . . . 0.0 109.025 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.472 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 5.0 m-20 -91.78 -5.77 52.93 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.218 -0.927 . . . . 0.0 109.816 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.653 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 2.1 t80 -74.09 -16.27 61.03 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.129 -0.982 . . . . 0.0 108.591 179.702 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.989 ' CE2' HG23 ' A' ' 48' ' ' ILE . 21.7 m-85 -103.99 -50.15 3.45 Favored 'General case' 0 C--N 1.298 -1.667 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 179.4 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.65 ' CZ ' ' CB ' ' A' ' 18' ' ' LEU . 3.1 m-85 -55.89 -45.35 78.64 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.472 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 8.3 m120 -60.82 -43.97 97.51 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.251 -0.906 . . . . 0.0 109.091 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.67 -13.75 61.04 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.441 -0.787 . . . . 0.0 109.626 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.605 ' HA ' HD13 ' A' ' 44' ' ' LEU . 4.5 mt -71.15 -40.32 74.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.297 -0.877 . . . . 0.0 108.898 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.418 ' CG ' ' HE2' ' A' ' 11' ' ' LYS . 0.9 OUTLIER -76.5 -19.62 57.8 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.205 -0.934 . . . . 0.0 109.317 179.787 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.462 ' O ' ' O ' ' A' ' 35' ' ' ALA . 2.5 mtpt -75.33 -15.66 60.47 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.391 -0.818 . . . . 0.0 109.61 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.851 ' HB1' ' HB3' ' A' ' 40' ' ' GLU . . . -40.39 162.64 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.461 -0.774 . . . . 0.0 109.882 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.402 ' O ' HG23 ' A' ' 37' ' ' THR . 3.4 tttm -101.89 -19.86 15.1 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.424 -0.797 . . . . 0.0 109.021 179.66 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.81 ' O ' HG23 ' A' ' 41' ' ' VAL . 11.2 p -153.2 -179.76 8.0 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.446 -0.784 . . . . 0.0 109.04 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.809 HG22 ' ND2' ' A' ' 9' ' ' ASN . 18.7 t -65.04 -38.48 82.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.1 -1.0 . . . . 0.0 108.912 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.714 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 29.2 mt-10 -64.68 -28.49 69.64 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.254 -0.904 . . . . 0.0 108.782 179.332 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.851 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 0.3 OUTLIER -79.48 -31.18 42.29 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 179.485 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.903 HG21 HD11 ' A' ' 7' ' ' LEU . 12.5 t -70.49 -65.26 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 178.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -55.7 -33.34 64.11 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.596 -0.69 . . . . 0.0 109.34 179.274 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.714 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -61.2 -42.25 98.26 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.321 -0.862 . . . . 0.0 109.242 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.605 HD13 ' HA ' ' A' ' 32' ' ' ILE . 0.4 OUTLIER -57.74 -50.18 74.08 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.225 -0.922 . . . . 0.0 110.04 -179.62 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.736 ' CE ' HD22 ' A' ' 18' ' ' LEU . 10.4 tptp -50.02 -29.67 9.16 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.041 -1.037 . . . . 0.0 110.499 -179.367 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 36.5 m-20 -80.02 -46.79 15.98 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.026 -1.046 . . . . 0.0 110.21 -179.236 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -54.52 -28.4 45.04 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.086 -1.009 . . . . 0.0 110.01 -179.361 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.989 HG23 ' CE2' ' A' ' 28' ' ' TYR . 21.1 mt -60.37 -44.38 95.88 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 O-C-N 121.016 -1.052 . . . . 0.0 109.237 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.908 ' HA ' ' HB3' ' A' ' 53' ' ' ALA . 1.0 OUTLIER -56.23 -19.06 12.27 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.536 -0.727 . . . . 0.0 110.449 -179.411 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.1 -58.41 1.89 Allowed 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.801 -1.187 . . . . 0.0 110.774 -179.102 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.497 ' O ' ' CB ' ' A' ' 52' ' ' HIS . . . -82.67 46.45 1.08 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.315 -0.865 . . . . 0.0 110.293 -179.014 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.543 ' CG ' ' N ' ' A' ' 53' ' ' ALA . 3.7 t-80 170.22 -81.83 0.0 OUTLIER 'General case' 0 C--N 1.302 -1.488 0 O-C-N 120.83 -1.169 . . . . 0.0 109.476 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.908 ' HB3' ' HA ' ' A' ' 49' ' ' LEU . . . . . . . . 0 N--CA 1.489 1.524 0 CA-C-O 118.01 -0.995 . . . . 0.0 109.456 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' THR . . . . . 0.447 ' O ' HG23 ' A' ' 1' ' ' THR . 13.5 t . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.295 0.569 . . . . 0.0 109.538 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.99 HD13 ' CZ2' ' A' ' 5' ' ' TRP . 1.2 pp -104.15 17.68 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.396 0 O-C-N 121.278 -0.889 . . . . 0.0 109.794 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.434 ' O ' ' C ' ' A' ' 4' ' ' GLN . 7.5 t70 -58.51 -13.92 6.72 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.334 -0.854 . . . . 0.0 109.559 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.434 ' C ' ' O ' ' A' ' 3' ' ' ASP . 1.4 mm-40 -39.91 -47.88 2.25 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.428 -0.795 . . . . 0.0 110.869 -179.686 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.99 ' CZ2' HD13 ' A' ' 2' ' ' ILE . 11.9 p-90 -115.48 -135.0 0.35 Allowed 'General case' 0 C--N 1.309 -1.184 0 O-C-N 120.694 -1.254 . . . . 0.0 109.147 -179.159 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.439 ' H ' ' HB2' ' A' ' 5' ' ' TRP . 0.1 OUTLIER -176.57 91.22 0.04 OUTLIER 'General case' 0 C--N 1.299 -1.604 0 O-C-N 121.096 -1.002 . . . . 0.0 109.026 -179.873 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 1.009 HD21 ' CG2' ' A' ' 41' ' ' VAL . 14.8 tp 49.77 -128.33 2.15 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 121.433 -0.792 . . . . 0.0 109.492 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.443 ' HB2' ' O ' ' A' ' 7' ' ' LEU . 1.3 mmmm 64.19 62.05 0.87 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 120.851 -1.156 . . . . 0.0 109.613 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.746 HD21 HG22 ' A' ' 38' ' ' VAL . 0.9 OUTLIER -144.97 -55.73 0.32 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.36 -0.837 . . . . 0.0 108.84 179.61 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.561 ' HB3' HG11 ' A' ' 41' ' ' VAL . . . -79.67 4.59 15.64 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.302 -0.874 . . . . 0.0 109.212 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.532 ' O ' ' CG1' ' A' ' 15' ' ' ILE . 0.5 OUTLIER -52.44 -91.81 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.252 -0.905 . . . . 0.0 110.546 -179.407 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -67.26 -22.93 65.65 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.999 -1.063 . . . . 0.0 111.06 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -62.07 -63.51 1.23 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.763 -1.21 . . . . 0.0 109.508 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.526 ' HB1' ' HZ2' ' A' ' 45' ' ' LYS . . . -73.25 -47.97 38.69 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.179 -0.95 . . . . 0.0 109.12 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.991 HG23 ' CE1' ' A' ' 29' ' ' PHE . 70.5 mt -47.1 -30.47 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.491 -0.756 . . . . 0.0 109.756 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.47 -52.21 59.09 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.468 -0.77 . . . . 0.0 109.856 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -49.9 -32.15 13.89 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.246 -0.909 . . . . 0.0 110.123 -179.679 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.627 HD12 ' N ' ' A' ' 18' ' ' LEU . 10.0 mp -90.37 -24.94 20.66 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.43 -0.794 . . . . 0.0 110.263 -178.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.2 tttt -64.03 -22.3 66.87 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.339 -0.85 . . . . 0.0 110.02 -179.466 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.42 -13.21 41.03 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.204 -0.935 . . . . 0.0 109.625 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -81.66 -4.12 55.32 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.225 -0.922 . . . . 0.0 109.589 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.06 -41.8 2.2 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.802 -1.319 . . . . 0.0 109.802 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.73 HG21 HG21 ' A' ' 48' ' ' ILE . 59.7 mt -47.04 117.55 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.163 -1.198 . . . . 0.0 109.666 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.73 17.91 5.2 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.306 -0.872 . . . . 0.0 109.508 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.427 ' HB3' ' CD2' ' A' ' 28' ' ' TYR . 3.0 t -54.97 127.67 29.94 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.108 -0.995 . . . . 0.0 109.038 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.558 ' O ' ' CB ' ' A' ' 30' ' ' ASN . 17.4 p-10 -72.15 -13.39 61.54 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.187 -0.946 . . . . 0.0 109.878 -179.394 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.531 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 18.9 t80 -81.44 -3.2 52.24 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 120.479 -1.388 . . . . 0.0 108.901 179.368 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.906 ' CD2' HG23 ' A' ' 48' ' ' ILE . 21.4 m-30 -111.48 -29.88 7.6 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.991 ' CE1' HG23 ' A' ' 15' ' ' ILE . 3.9 m-30 -103.23 -43.75 5.37 Favored 'General case' 0 C--N 1.295 -1.763 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.558 ' CB ' ' O ' ' A' ' 26' ' ' ASP . 3.1 t-20 -68.33 -26.94 65.86 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 108.45 -0.945 . . . . 0.0 108.45 179.127 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -88.55 4.43 46.85 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.53 -0.731 . . . . 0.0 109.68 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.919 HD12 HG13 ' A' ' 41' ' ' VAL . 0.7 OUTLIER -84.73 -20.79 8.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.169 -0.957 . . . . 0.0 109.104 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.513 ' HB2' ' CE ' ' A' ' 11' ' ' LYS . 0.7 OUTLIER -76.5 -23.48 53.74 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.127 -0.983 . . . . 0.0 109.004 179.387 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.453 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.4 OUTLIER -80.21 -18.44 49.53 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.396 -0.815 . . . . 0.0 109.313 179.716 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.453 ' O ' ' O ' ' A' ' 34' ' ' LYS . . . -44.54 168.99 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.342 -0.849 . . . . 0.0 109.807 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.525 ' O ' HD13 ' A' ' 7' ' ' LEU . 45.0 mttp -106.27 -69.85 0.81 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.425 -0.797 . . . . 0.0 109.248 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 8.8 t -108.38 179.0 4.33 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.277 -0.889 . . . . 0.0 108.877 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.746 HG22 HD21 ' A' ' 9' ' ' ASN . 25.5 t -59.35 -44.92 93.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 O-C-N 120.956 -1.09 . . . . 0.0 108.942 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.705 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 0.5 OUTLIER -56.32 -27.01 54.32 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 179.449 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -78.89 -33.74 45.38 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 179.069 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 1.009 ' CG2' HD21 ' A' ' 7' ' ' LEU . 90.7 t -71.09 -73.4 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.389 0 N-CA-C 107.937 -1.135 . . . . 0.0 107.937 178.706 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.518 ' OD1' HG12 ' A' ' 38' ' ' VAL . 18.5 m120 -44.26 -28.19 0.5 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.553 -0.717 . . . . 0.0 109.328 179.15 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.705 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -68.55 -52.78 28.18 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.155 -0.966 . . . . 0.0 109.291 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.1 mt -60.12 -34.79 74.0 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.369 -0.832 . . . . 0.0 110.295 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.625 ' HE3' ' CA ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -77.17 -27.25 53.68 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.063 -1.023 . . . . 0.0 109.271 -179.777 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -80.47 -22.42 41.06 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.266 -0.897 . . . . 0.0 108.84 179.342 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.734 ' O ' ' HB3' ' A' ' 51' ' ' ALA . 0.6 OUTLIER -78.18 1.31 21.8 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.466 -0.771 . . . . 0.0 109.037 179.456 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.906 HG23 ' CD2' ' A' ' 28' ' ' TYR . 42.2 mt -80.6 -46.66 21.24 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 O-C-N 121.176 -0.953 . . . . 0.0 108.783 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.54 -30.18 68.43 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.652 -0.655 . . . . 0.0 109.944 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.7 mmtt -100.06 -62.61 1.22 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.108 -0.995 . . . . 0.0 109.751 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.734 ' HB3' ' O ' ' A' ' 47' ' ' GLU . . . -51.05 -21.68 1.97 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.214 -0.929 . . . . 0.0 109.031 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.684 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 1.4 t-80 -148.72 170.94 17.05 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 -179.739 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.684 ' HB3' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 118.044 -0.979 . . . . 0.0 109.445 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' THR . . . . . 0.622 ' O ' HG22 ' A' ' 2' ' ' ILE . 6.3 t . . . . . 0 N--CA 1.49 1.546 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.622 HG22 ' O ' ' A' ' 1' ' ' THR . 15.0 tt 41.83 41.63 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.486 -0.759 . . . . 0.0 109.654 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.438 ' H ' HG23 ' A' ' 1' ' ' THR . 0.2 OUTLIER -67.38 -9.18 38.92 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.303 -0.873 . . . . 0.0 109.176 179.461 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.482 ' O ' ' O ' ' A' ' 5' ' ' TRP . 0.0 OUTLIER -73.29 -2.24 21.19 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.335 -0.853 . . . . 0.0 109.622 179.943 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.493 ' O ' ' N ' ' A' ' 7' ' ' LEU . 18.4 t90 -40.35 -96.64 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.411 -0.806 . . . . 0.0 110.899 -179.399 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.558 ' H ' HD22 ' A' ' 6' ' ' LEU . 3.8 mm? 38.87 28.11 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.996 -1.065 . . . . 0.0 110.355 -179.575 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.946 HD13 ' O ' ' A' ' 7' ' ' LEU . 0.7 OUTLIER 40.57 74.06 0.11 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.341 -0.85 . . . . 0.0 109.39 -179.567 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 21.5 mtpt -129.65 17.36 5.82 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 121.284 -0.885 . . . . 0.0 108.621 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.501 ' O ' ' CB ' ' A' ' 13' ' ' ASP . 5.9 p-10 -85.5 -47.12 10.22 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 179.294 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.852 ' O ' ' HB3' ' A' ' 14' ' ' ALA . . . -81.02 -14.19 58.14 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.422 -0.799 . . . . 0.0 108.949 179.099 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.898 ' HA ' HG21 ' A' ' 32' ' ' ILE . 0.7 OUTLIER -48.36 -68.22 0.2 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.045 -1.034 . . . . 0.0 109.863 -179.823 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -98.9 -23.12 15.46 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.993 -1.067 . . . . 0.0 109.804 -179.733 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.501 ' CB ' ' O ' ' A' ' 9' ' ' ASN . 4.1 t0 -75.7 -19.21 59.28 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.162 -0.961 . . . . 0.0 109.02 179.768 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.852 ' HB3' ' O ' ' A' ' 10' ' ' ALA . . . -102.27 -44.31 5.45 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.64 HD12 ' O ' ' A' ' 11' ' ' LYS . 59.6 mt -54.99 -29.08 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 121.381 -0.824 . . . . 0.0 109.066 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.64 -37.09 84.98 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.502 -0.749 . . . . 0.0 109.364 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -88.22 -16.18 33.95 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.459 -0.776 . . . . 0.0 110.291 -179.41 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.731 HD22 ' CD ' ' A' ' 45' ' ' LYS . 47.6 mt -83.66 -32.32 25.69 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.041 -1.037 . . . . 0.0 109.745 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.4 mtmt -65.06 -35.58 81.6 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.056 -1.027 . . . . 0.0 109.319 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.08 -10.51 56.79 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.419 -0.8 . . . . 0.0 109.248 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.14 -42.49 98.64 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.254 -0.904 . . . . 0.0 109.261 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 141.74 -13.58 2.67 Favored Glycine 0 N--CA 1.491 2.353 0 N-CA-C 109.67 -1.372 . . . . 0.0 109.67 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.824 HD13 HG21 ' A' ' 48' ' ' ILE . 3.5 mt -105.53 146.39 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.108 -1.23 . . . . 0.0 109.85 -179.713 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.1 p -135.38 15.49 3.45 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 179.221 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.5 m -59.43 -168.51 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.424 -0.797 . . . . 0.0 109.475 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.518 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 0.3 OUTLIER -126.37 -16.05 5.5 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.222 -0.924 . . . . 0.0 109.862 -179.932 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.638 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 4.2 t80 -80.26 -9.07 59.72 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 120.635 -1.291 . . . . 0.0 109.038 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.696 ' CG ' HG12 ' A' ' 48' ' ' ILE . 17.8 m-85 -102.67 -23.97 13.79 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.342 -0.849 . . . . 0.0 108.837 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.486 ' CE2' ' HB2' ' A' ' 18' ' ' LEU . 80.3 m-85 -96.47 -51.95 4.15 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-O 121.149 0.5 . . . . 0.0 109.759 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.518 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 1.6 m-80 -63.66 -19.3 64.78 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.196 -0.94 . . . . 0.0 109.618 179.857 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -87.82 16.3 5.99 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.239 -0.913 . . . . 0.0 109.086 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.898 HG21 ' HA ' ' A' ' 11' ' ' LYS . 8.6 mm -76.21 -65.77 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 121.547 -0.721 . . . . 0.0 109.373 -179.826 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -51.28 -26.17 6.91 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.223 -0.923 . . . . 0.0 109.083 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.435 ' O ' ' C ' ' A' ' 35' ' ' ALA . 0.4 OUTLIER -62.3 -44.71 95.89 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.4 -0.812 . . . . 0.0 109.467 179.924 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.697 ' HB3' HG22 ' A' ' 41' ' ' VAL . . . -42.65 146.73 0.34 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.344 -0.847 . . . . 0.0 109.587 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.422 ' HG3' ' OE2' ' A' ' 40' ' ' GLU . 26.8 mttm -69.44 -64.65 0.84 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.272 -0.893 . . . . 0.0 109.825 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.812 ' O ' HG23 ' A' ' 41' ' ' VAL . 1.2 p -118.82 -163.56 0.97 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.121 -0.987 . . . . 0.0 109.48 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.429 HG13 HD22 ' A' ' 9' ' ' ASN . 18.0 t -68.61 -55.36 16.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.251 -0.905 . . . . 0.0 109.741 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.779 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 14.2 pt-20 -50.48 -23.16 2.28 Favored 'General case' 0 C--N 1.295 -1.778 0 O-C-N 121.058 -1.027 . . . . 0.0 108.542 179.592 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.422 ' OE2' ' HG3' ' A' ' 36' ' ' LYS . 1.4 mm-40 -83.1 -38.34 22.6 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.434 -0.791 . . . . 0.0 109.02 179.159 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.907 HG21 HD21 ' A' ' 7' ' ' LEU . 11.7 t -63.54 -58.87 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 179.263 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -62.52 -29.78 70.81 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.362 -0.836 . . . . 0.0 108.893 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.779 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -65.72 -33.41 75.81 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.413 -0.804 . . . . 0.0 109.642 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.72 HD12 ' C ' ' A' ' 44' ' ' LEU . 0.3 OUTLIER -61.07 -39.44 89.87 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.174 -0.954 . . . . 0.0 109.519 -179.752 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.786 ' HE3' HD12 ' A' ' 23' ' ' ILE . 30.5 tptt -66.61 -18.59 65.45 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.127 -0.983 . . . . 0.0 109.475 -179.874 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.464 ' HB2' ' O ' ' A' ' 43' ' ' ALA . 7.9 m120 -73.41 -40.02 64.6 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.203 -0.936 . . . . 0.0 109.232 179.846 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.536 ' O ' ' CB ' ' A' ' 51' ' ' ALA . 39.1 mt-10 -62.65 -27.07 68.97 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.273 -0.892 . . . . 0.0 109.308 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.824 HG21 HD13 ' A' ' 23' ' ' ILE . 2.5 mp -70.73 -29.81 39.44 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 179.35 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.427 ' HB2' ' O ' ' A' ' 46' ' ' ASN . 4.5 mp -59.31 -30.39 68.3 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 179.238 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -122.41 5.5 9.63 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.209 -0.932 . . . . 0.0 109.722 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.536 ' CB ' ' O ' ' A' ' 47' ' ' GLU . . . -101.54 -49.54 3.99 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.248 -0.907 . . . . 0.0 109.907 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.498 ' HB3' ' OH ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -106.91 -6.82 17.35 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.314 -0.866 . . . . 0.0 110.161 -178.987 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 118.112 -0.947 . . . . 0.0 109.539 -179.935 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.619 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.991 HD13 ' O ' ' A' ' 2' ' ' ILE . 0.0 OUTLIER -127.0 -7.59 4.61 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.159 -0.963 . . . . 0.0 109.699 -179.767 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.454 ' O ' ' N ' ' A' ' 5' ' ' TRP . 3.2 m-20 -51.83 -20.55 2.28 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.962 -1.086 . . . . 0.0 108.801 178.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.51 ' HG3' ' N ' ' A' ' 5' ' ' TRP . 0.4 OUTLIER -41.0 -25.74 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.467 -0.771 . . . . 0.0 110.402 179.724 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.512 ' O ' ' C ' ' A' ' 6' ' ' LEU . 1.1 t90 -37.92 -69.28 0.12 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.221 -0.924 . . . . 0.0 111.323 -179.566 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.512 ' C ' ' O ' ' A' ' 5' ' ' TRP . 30.4 tp -27.7 -43.76 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.005 0 CA-C-O 121.14 0.495 . . . . 0.0 110.939 -178.807 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.915 HD21 ' CG2' ' A' ' 41' ' ' VAL . 0.3 OUTLIER 75.9 -157.98 0.04 OUTLIER 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.257 -0.902 . . . . 0.0 109.358 179.761 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.521 ' CB ' ' O ' ' A' ' 7' ' ' LEU . 0.1 OUTLIER 76.57 -2.94 2.62 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.201 -0.937 . . . . 0.0 109.428 -179.711 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.416 ' CG ' ' N ' ' A' ' 10' ' ' ALA . 5.5 p-10 -73.6 -47.15 42.52 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.211 -0.931 . . . . 0.0 108.662 179.392 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.613 ' HB3' HG11 ' A' ' 41' ' ' VAL . . . -80.99 -4.51 55.34 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.322 -0.861 . . . . 0.0 109.014 179.199 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.401 ' O ' HG13 ' A' ' 15' ' ' ILE . 0.1 OUTLIER -50.43 -75.99 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.363 -0.836 . . . . 0.0 110.201 -179.572 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -76.92 -18.42 58.3 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.144 -0.972 . . . . 0.0 110.369 -179.2 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.6 -18.28 62.23 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.947 -1.096 . . . . 0.0 109.441 -179.767 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.598 ' HB1' ' HG3' ' A' ' 45' ' ' LYS . . . -106.75 -38.79 6.0 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 179.58 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.755 HG23 ' CE1' ' A' ' 29' ' ' PHE . 35.8 mt -61.9 -28.36 44.14 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 CA-C-O 121.752 0.787 . . . . 0.0 109.263 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.06 -3.06 4.75 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.651 -0.655 . . . . 0.0 110.941 -178.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.526 ' CG ' ' O ' ' A' ' 17' ' ' GLU . 17.0 tt0 -117.56 1.94 12.32 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 120.847 -1.158 . . . . 0.0 109.933 -179.531 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.685 HD12 HD12 ' A' ' 23' ' ' ILE . 3.7 mm? -100.44 -39.68 7.84 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.001 -1.062 . . . . 0.0 110.511 -179.47 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.63 -19.71 64.06 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.018 -1.051 . . . . 0.0 109.942 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.468 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -96.94 -14.8 21.49 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.144 -0.972 . . . . 0.0 109.381 179.892 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -79.81 -39.33 31.02 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.156 -0.965 . . . . 0.0 109.587 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 125.25 14.07 3.39 Favored Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.954 -1.259 . . . . 0.0 109.954 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.685 HD12 HD12 ' A' ' 18' ' ' LEU . 34.1 mt -105.03 117.99 51.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.078 -1.248 . . . . 0.0 109.257 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.2 p -113.44 -4.74 13.55 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.233 -0.917 . . . . 0.0 109.938 -179.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -45.97 133.58 8.66 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.101 -0.999 . . . . 0.0 109.149 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.458 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 7.4 p-10 -88.47 -2.84 58.82 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.282 -0.886 . . . . 0.0 109.732 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.472 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 26.1 t80 -76.21 -13.94 60.16 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.166 -0.959 . . . . 0.0 109.243 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.823 ' HB3' HD11 ' A' ' 48' ' ' ILE . 22.3 m-85 -100.6 -45.21 5.59 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.428 -0.795 . . . . 0.0 108.973 179.734 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.755 ' CE1' HG23 ' A' ' 15' ' ' ILE . 5.5 m-85 -66.84 -44.62 80.58 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.473 -0.767 . . . . 0.0 109.559 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.458 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 14.4 m120 -68.74 -24.66 64.48 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.322 -0.861 . . . . 0.0 110.055 -179.799 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -92.49 -17.27 24.74 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.123 -0.986 . . . . 0.0 110.565 -178.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.511 HD11 ' HG2' ' A' ' 45' ' ' LYS . 0.6 OUTLIER -53.69 -39.05 36.81 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 120.981 -1.074 . . . . 0.0 109.242 -179.853 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -71.17 -38.82 72.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.184 -0.947 . . . . 0.0 109.442 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.418 ' O ' ' C ' ' A' ' 35' ' ' ALA . 16.7 mmtt -52.7 -25.65 11.62 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.287 -0.883 . . . . 0.0 109.408 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.626 ' HB3' HG22 ' A' ' 41' ' ' VAL . . . -41.69 137.12 1.73 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.457 -0.777 . . . . 0.0 109.764 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.874 ' O ' HD13 ' A' ' 7' ' ' LEU . 6.5 mtpt -75.85 -64.85 0.99 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.213 -0.93 . . . . 0.0 109.275 179.792 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.69 ' C ' HD11 ' A' ' 7' ' ' LEU . 9.0 t -109.71 -178.4 3.53 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.213 -0.929 . . . . 0.0 108.901 179.541 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 12.1 t -61.25 -46.33 96.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 O-C-N 120.896 -1.127 . . . . 0.0 108.942 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.718 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 5.8 mt-10 -53.34 -25.72 16.26 Favored 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 179.07 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.556 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -79.68 -37.14 36.48 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 179.071 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.915 ' CG2' HD21 ' A' ' 7' ' ' LEU . 38.4 t -65.53 -66.12 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.434 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -55.68 -29.41 59.32 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.48 -0.762 . . . . 0.0 109.579 179.544 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.718 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -67.52 -39.87 85.1 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.216 -0.927 . . . . 0.0 109.622 -179.821 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.447 HD12 ' HB2' ' A' ' 35' ' ' ALA . 3.6 mt -61.39 -45.51 94.06 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.207 -0.933 . . . . 0.0 109.791 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.598 ' HG3' ' HB1' ' A' ' 14' ' ' ALA . 14.1 mmtm -63.14 -25.86 68.55 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.125 -0.984 . . . . 0.0 109.319 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -80.43 -19.83 45.27 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.283 -0.886 . . . . 0.0 109.743 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -79.51 -16.57 55.79 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.158 -0.964 . . . . 0.0 109.744 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.823 HD11 ' HB3' ' A' ' 28' ' ' TYR . 64.0 mt -71.46 -42.05 73.01 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 O-C-N 120.877 -1.139 . . . . 0.0 108.548 179.525 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 87.4 mt -51.89 -26.41 10.13 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.417 -0.802 . . . . 0.0 109.338 179.442 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.42 ' O ' ' N ' ' A' ' 52' ' ' HIS . 0.1 OUTLIER -112.31 -71.15 0.77 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.186 -0.946 . . . . 0.0 109.965 -179.89 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -43.58 -25.44 0.16 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.311 -0.868 . . . . 0.0 109.844 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.646 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 0.0 OUTLIER -130.32 152.04 50.17 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 121.22 -0.925 . . . . 0.0 108.707 -179.644 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.646 ' HB3' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 118.009 -0.996 . . . . 0.0 109.247 -179.165 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 121.234 0.54 . . . . 0.0 109.555 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.85 ' O ' HG22 ' A' ' 2' ' ' ILE . 14.7 mm 47.01 60.35 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.28 -0.887 . . . . 0.0 109.574 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.746 ' HA ' HD23 ' A' ' 6' ' ' LEU . 4.3 t0 -96.78 24.98 5.57 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 178.805 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 14.0 tt0 -76.05 -50.21 15.39 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.718 -0.614 . . . . 0.0 110.573 -178.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.83 ' CZ2' HG21 ' A' ' 2' ' ' ILE . 4.2 p-90 -105.77 -49.55 3.38 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.16 -0.963 . . . . 0.0 111.08 -178.643 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.746 HD23 ' HA ' ' A' ' 3' ' ' ASP . 0.5 OUTLIER 38.99 29.7 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.559 -0.713 . . . . 0.0 109.504 -178.773 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.955 HD11 ' CG2' ' A' ' 41' ' ' VAL . 11.6 tp 96.41 38.21 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 -179.271 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.422 ' N ' ' O ' ' A' ' 5' ' ' TRP . 9.7 mtmt -136.71 63.59 1.57 Allowed 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 179.629 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -142.4 -48.71 0.35 Allowed 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.464 -0.773 . . . . 0.0 109.137 -179.384 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.534 ' HB2' HG13 ' A' ' 38' ' ' VAL . . . -80.95 -18.97 45.25 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 121.291 -0.88 . . . . 0.0 108.863 179.545 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.602 ' O ' HD12 ' A' ' 15' ' ' ILE . 4.7 ptmt -74.88 -14.8 60.71 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.354 -0.842 . . . . 0.0 109.615 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -100.97 -37.84 8.46 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.055 -1.028 . . . . 0.0 109.513 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -74.85 -26.53 59.76 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.247 -0.908 . . . . 0.0 109.684 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.521 ' O ' HD23 ' A' ' 18' ' ' LEU . . . -92.97 -42.58 9.38 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.089 -1.007 . . . . 0.0 109.626 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.602 HD12 ' O ' ' A' ' 11' ' ' LYS . 20.4 mt -63.28 -31.0 51.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 CA-C-O 121.776 0.798 . . . . 0.0 108.999 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.507 ' HA ' ' HD2' ' A' ' 19' ' ' LYS . . . -67.24 -7.0 20.64 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.641 -0.662 . . . . 0.0 110.132 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.444 ' O ' ' CG ' ' A' ' 17' ' ' GLU . 9.4 tp10 -109.27 -5.97 15.69 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.231 -0.918 . . . . 0.0 109.522 -179.745 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.834 HD12 HD12 ' A' ' 23' ' ' ILE . 4.0 mm? -93.49 -41.01 10.02 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.113 -0.992 . . . . 0.0 109.031 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.507 ' HD2' ' HA ' ' A' ' 16' ' ' ALA . 0.1 OUTLIER -56.42 -23.31 37.59 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.504 -0.747 . . . . 0.0 109.524 -179.942 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.497 ' N ' ' HG2' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -97.64 -20.09 17.87 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.293 -0.879 . . . . 0.0 109.142 179.551 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -75.41 -28.67 59.51 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.259 -0.901 . . . . 0.0 109.575 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 128.36 -45.86 1.12 Allowed Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.26 -1.536 . . . . 0.0 109.26 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.867 HD13 HG21 ' A' ' 48' ' ' ILE . 5.5 mt -45.24 122.83 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.205 -1.173 . . . . 0.0 109.008 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -128.93 10.51 5.95 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.162 -0.961 . . . . 0.0 109.842 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.7 t -66.09 156.41 33.96 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.197 -0.939 . . . . 0.0 109.198 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.49 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 2.7 t70 -103.38 -4.11 24.58 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.103 -0.998 . . . . 0.0 109.825 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.472 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 5.9 t80 -77.57 -18.07 57.27 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.11 -0.993 . . . . 0.0 109.232 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.647 ' CG ' ' CG1' ' A' ' 48' ' ' ILE . 22.5 m-85 -95.46 -41.12 9.13 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.263 -0.898 . . . . 0.0 108.926 179.558 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.594 ' CE1' HG23 ' A' ' 15' ' ' ILE . 9.6 m-30 -71.03 -49.88 40.08 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.434 -0.791 . . . . 0.0 109.465 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.49 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 3.5 t-20 -59.12 -52.37 66.03 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.24 -0.912 . . . . 0.0 109.671 -179.746 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.16 -22.07 65.58 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.27 -0.894 . . . . 0.0 109.645 -179.708 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.61 HG23 HG13 ' A' ' 41' ' ' VAL . 1.4 mm -67.64 -53.94 27.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.205 -0.935 . . . . 0.0 109.399 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.524 ' CB ' ' HD2' ' A' ' 11' ' ' LYS . 1.6 p-10 -73.53 -1.96 20.74 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.149 -0.969 . . . . 0.0 109.461 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.483 ' O ' ' O ' ' A' ' 35' ' ' ALA . 7.2 mttt -105.3 -8.86 17.99 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.27 -0.894 . . . . 0.0 109.817 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.735 ' HB1' ' HB3' ' A' ' 40' ' ' GLU . . . -55.2 -158.89 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.531 -0.731 . . . . 0.0 110.088 -179.712 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.91 ' O ' HD22 ' A' ' 7' ' ' LEU . 6.7 mttt -110.02 -67.47 0.99 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.128 -0.983 . . . . 0.0 110.087 -179.702 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.952 ' O ' HG23 ' A' ' 41' ' ' VAL . 0.7 OUTLIER -118.79 -168.5 1.56 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.979 -1.075 . . . . 0.0 109.645 -179.565 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.534 HG13 ' HB2' ' A' ' 10' ' ' ALA . 65.3 t -70.41 -31.6 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.201 -0.937 . . . . 0.0 109.931 -179.683 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.748 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 1.7 mm-40 -71.01 -26.75 63.26 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 120.945 -1.097 . . . . 0.0 108.139 179.319 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.735 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 0.1 OUTLIER -84.51 -26.7 27.92 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 178.736 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.955 ' CG2' HD11 ' A' ' 7' ' ' LEU . 53.9 t -73.8 -70.04 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 178.72 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -50.14 -29.08 8.4 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 178.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.748 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -64.48 -50.66 66.57 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.389 -0.819 . . . . 0.0 108.923 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.786 ' O ' HD12 ' A' ' 48' ' ' ILE . 5.9 mt -61.09 -46.58 90.05 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.314 -0.867 . . . . 0.0 109.922 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.577 ' HA ' HD13 ' A' ' 48' ' ' ILE . 0.2 OUTLIER -56.09 -40.9 74.37 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.118 -0.989 . . . . 0.0 109.805 -179.596 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.1 m-20 -76.43 -18.74 58.67 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.149 -0.97 . . . . 0.0 109.388 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.404 ' O ' ' CB ' ' A' ' 51' ' ' ALA . 8.6 tp10 -73.17 -19.89 61.02 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.259 -0.901 . . . . 0.0 109.407 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.867 HG21 HD13 ' A' ' 23' ' ' ILE . 2.9 mp -68.62 -27.76 37.47 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 179.075 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.503 ' HB2' ' HE2' ' A' ' 50' ' ' LYS . 2.3 mm? -58.24 -38.3 76.59 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.612 -0.68 . . . . 0.0 109.951 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.503 ' HE2' ' HB2' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -114.69 0.16 13.79 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.929 -1.107 . . . . 0.0 110.201 -179.432 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.404 ' CB ' ' O ' ' A' ' 47' ' ' GLU . . . -100.62 -12.17 19.43 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 121.182 -0.949 . . . . 0.0 109.172 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.724 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 0.0 OUTLIER -154.47 -171.61 3.92 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.429 -0.794 . . . . 0.0 108.886 -179.723 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.724 ' HB3' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 117.945 -1.026 . . . . 0.0 109.585 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.648 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.759 HG23 ' O ' ' A' ' 2' ' ' ILE . 0.2 OUTLIER -147.4 33.68 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.265 -0.897 . . . . 0.0 109.495 -179.763 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -90.09 37.64 0.9 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.141 -0.974 . . . . 0.0 108.466 179.019 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 42.7 tp60 -62.91 -23.34 67.31 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.7 -0.625 . . . . 0.0 110.319 -179.343 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.691 ' HB2' HD23 ' A' ' 6' ' ' LEU . 0.0 OUTLIER -104.32 -102.72 0.31 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.974 -1.079 . . . . 0.0 110.055 -179.553 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.691 HD23 ' HB2' ' A' ' 5' ' ' TRP . 2.1 pt? -152.54 -19.06 0.17 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 120.715 -1.241 . . . . 0.0 111.446 -179.466 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.969 HD13 ' O ' ' A' ' 36' ' ' LYS . 1.2 tp 83.17 -135.87 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.889 -1.132 . . . . 0.0 109.112 -179.396 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.507 ' HA ' ' HG3' ' A' ' 11' ' ' LYS . 29.2 mttt 64.49 6.42 3.12 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.026 -1.046 . . . . 0.0 109.878 -179.365 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.431 HD21 HG22 ' A' ' 38' ' ' VAL . 7.4 p30 -80.99 -45.57 16.4 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.024 -1.048 . . . . 0.0 108.501 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.693 ' HB3' HG11 ' A' ' 41' ' ' VAL . . . -80.44 0.11 34.85 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.487 -0.758 . . . . 0.0 109.255 179.397 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.507 ' HG3' ' HA ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -51.31 -88.38 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.961 -1.087 . . . . 0.0 109.49 -179.686 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' A' ' 16' ' ' ALA . 19.9 tt0 -67.08 -10.73 53.08 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.064 -1.022 . . . . 0.0 109.907 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.56 -72.31 0.19 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.083 -1.011 . . . . 0.0 109.259 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.563 ' O ' HD23 ' A' ' 18' ' ' LEU . . . -64.16 -35.72 81.72 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.409 -0.807 . . . . 0.0 109.858 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 1.054 HG23 ' CE1' ' A' ' 29' ' ' PHE . 33.8 mt -61.2 -28.55 44.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 CA-C-O 121.774 0.797 . . . . 0.0 109.389 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.435 ' HB2' ' O ' ' A' ' 12' ' ' GLU . . . -66.77 -4.15 8.41 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.823 -0.548 . . . . 0.0 110.893 -178.654 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.561 ' C ' HD22 ' A' ' 18' ' ' LEU . 12.1 tt0 -116.12 -2.8 12.14 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 120.938 -1.101 . . . . 0.0 109.874 -179.609 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.613 ' N ' HD22 ' A' ' 18' ' ' LEU . 3.6 mm? -99.59 -40.14 7.95 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.945 -1.097 . . . . 0.0 109.707 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.8 ttpp -53.76 -23.81 13.07 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.225 -0.922 . . . . 0.0 109.601 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.77 -22.39 16.43 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.224 -0.922 . . . . 0.0 109.712 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.02 -7.41 28.88 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.179 -0.951 . . . . 0.0 109.534 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.72 -9.3 58.52 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.256 -1.537 . . . . 0.0 109.256 -179.622 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.612 ' CD1' ' CE1' ' A' ' 52' ' ' HIS . 4.9 mm -69.15 149.05 11.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.302 -1.117 . . . . 0.0 109.583 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.513 HG23 ' O ' ' A' ' 23' ' ' ILE . 1.4 p -155.88 20.13 0.38 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.315 -0.866 . . . . 0.0 109.346 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.0 m -80.17 142.17 34.99 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.361 -0.837 . . . . 0.0 109.428 179.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.489 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 1.8 p30 -88.96 -11.77 43.46 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.309 -0.869 . . . . 0.0 109.561 -179.748 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.511 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 5.8 t80 -75.7 -12.56 60.22 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.208 -0.933 . . . . 0.0 109.121 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.64 ' CG ' ' CG1' ' A' ' 48' ' ' ILE . 24.0 m-85 -100.77 -43.2 6.19 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.33 -0.857 . . . . 0.0 109.204 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 1.054 ' CE1' HG23 ' A' ' 15' ' ' ILE . 5.2 m-85 -71.87 -45.17 62.27 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.503 -0.748 . . . . 0.0 109.765 -179.849 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.489 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 0.1 OUTLIER -65.27 -33.57 76.3 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.117 -0.989 . . . . 0.0 109.141 179.96 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -75.32 -11.72 60.12 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.38 -0.825 . . . . 0.0 109.184 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.825 HD11 ' HD2' ' A' ' 45' ' ' LYS . 4.3 mm -74.4 -25.2 19.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.343 -0.848 . . . . 0.0 109.367 179.876 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.503 ' ND2' ' HE2' ' A' ' 8' ' ' LYS . 4.8 t-20 -80.32 -31.19 38.16 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.185 -0.947 . . . . 0.0 109.252 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.466 ' O ' ' C ' ' A' ' 35' ' ' ALA . 15.6 mtpp -77.12 -17.2 58.82 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.22 -0.925 . . . . 0.0 109.57 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.855 ' CB ' HG22 ' A' ' 41' ' ' VAL . . . -36.97 155.17 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 121.513 0.673 . . . . 0.0 110.497 -179.332 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.969 ' O ' HD13 ' A' ' 7' ' ' LEU . 2.8 mmtm -95.6 -66.63 0.9 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.433 -0.792 . . . . 0.0 109.682 -179.812 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.802 ' O ' HG23 ' A' ' 41' ' ' VAL . 38.2 p -116.44 178.22 4.41 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.149 -0.969 . . . . 0.0 109.198 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.431 HG22 HD21 ' A' ' 9' ' ' ASN . 26.3 t -63.29 -42.96 98.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.192 -0.942 . . . . 0.0 109.46 179.888 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.569 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 4.4 mm-40 -62.51 -23.07 66.75 Favored 'General case' 0 C--N 1.298 -1.661 0 O-C-N 121.219 -0.926 . . . . 0.0 109.035 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.498 ' HB2' ' H ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -85.71 -30.24 23.3 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.32 -0.862 . . . . 0.0 108.992 179.651 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.873 ' CG2' HD21 ' A' ' 7' ' ' LEU . 12.8 t -71.78 -61.58 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.434 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 179.005 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -57.72 -33.14 68.11 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.727 -0.608 . . . . 0.0 109.448 179.371 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.569 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -69.9 -31.74 69.69 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.323 -0.861 . . . . 0.0 109.753 -179.692 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.885 ' O ' HD12 ' A' ' 44' ' ' LEU . 0.2 OUTLIER -78.46 -24.75 45.87 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 121.105 -0.997 . . . . 0.0 109.346 -179.828 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.825 ' HD2' HD11 ' A' ' 32' ' ' ILE . 0.2 OUTLIER -80.5 -30.8 37.29 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.115 -0.991 . . . . 0.0 110.242 -179.314 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -79.87 -15.9 56.45 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 120.992 -1.067 . . . . 0.0 109.982 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 5.8 pt-20 -82.83 -6.98 59.68 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.058 -1.026 . . . . 0.0 109.521 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.64 ' CG1' ' CG ' ' A' ' 28' ' ' TYR . 1.6 mp -71.74 -48.42 51.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.473 0 N-CA-C 107.81 -1.182 . . . . 0.0 107.81 178.531 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.437 ' O ' ' C ' ' A' ' 53' ' ' ALA . 1.2 tp -50.2 -20.74 1.1 Allowed 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.297 -0.877 . . . . 0.0 109.793 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.421 ' O ' ' N ' ' A' ' 52' ' ' HIS . 0.0 OUTLIER -105.84 -74.49 0.65 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.991 -1.068 . . . . 0.0 109.877 -179.704 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -43.75 -22.62 0.05 Allowed 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.526 -0.734 . . . . 0.0 111.081 -179.482 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.612 ' CE1' ' CD1' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -126.91 -8.48 6.05 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.935 -1.103 . . . . 0.0 110.578 -178.397 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.437 ' C ' ' O ' ' A' ' 49' ' ' LEU . . . . . . . . 0 N--CA 1.491 1.587 0 O-C-N 120.943 -1.098 . . . . 0.0 109.643 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 1.5 p . . . . . 0 N--CA 1.489 1.512 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.543 ' CG1' ' O ' ' A' ' 2' ' ' ILE . 1.9 tt -169.88 41.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.136 -0.977 . . . . 0.0 109.479 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -49.3 -22.99 1.21 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.075 -1.015 . . . . 0.0 108.711 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.439 ' O ' ' O ' ' A' ' 5' ' ' TRP . 0.9 OUTLIER -64.44 -67.92 0.4 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.509 -0.744 . . . . 0.0 109.13 179.497 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.439 ' O ' ' O ' ' A' ' 4' ' ' GLN . 0.6 OUTLIER 59.75 128.75 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.343 0 CA-C-O 122.415 1.102 . . . . 0.0 110.862 179.557 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.565 HD13 ' HD2' ' A' ' 8' ' ' LYS . 0.5 OUTLIER -164.75 14.31 0.05 OUTLIER 'General case' 0 C--N 1.289 -2.024 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.636 -179.735 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.603 HD21 ' HB3' ' A' ' 35' ' ' ALA . 10.1 tp 83.89 -145.46 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.384 -0.823 . . . . 0.0 109.645 179.792 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.565 ' HD2' HD13 ' A' ' 6' ' ' LEU . 45.3 mttp 56.74 34.18 24.19 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 120.961 -1.087 . . . . 0.0 108.915 -178.798 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 13.1 p-10 -131.18 -50.1 1.01 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.346 -0.846 . . . . 0.0 109.481 179.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -81.03 -13.55 58.72 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.096 -1.003 . . . . 0.0 109.194 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.498 ' HE3' ' CG ' ' A' ' 12' ' ' GLU . 0.0 OUTLIER -53.73 -92.26 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.365 -0.834 . . . . 0.0 110.163 -179.289 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.539 ' HA ' ' HB ' ' A' ' 15' ' ' ILE . 26.0 mt-10 -47.04 -23.57 0.5 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.294 -0.879 . . . . 0.0 110.342 -179.109 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -56.35 -52.1 65.83 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.17 -0.956 . . . . 0.0 108.958 179.678 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 1.03 ' O ' HD13 ' A' ' 18' ' ' LEU . . . -78.14 -47.92 17.1 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.281 -0.887 . . . . 0.0 109.238 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.939 ' HA ' HD22 ' A' ' 18' ' ' LEU . 55.0 mt -46.34 -30.15 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 O-C-N 121.324 -0.86 . . . . 0.0 109.481 -179.801 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.4 -47.25 70.84 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.411 ' O ' ' HB2' ' A' ' 21' ' ' ALA . 11.4 mt-10 -79.32 4.75 14.29 Favored 'General case' 0 C--N 1.296 -1.755 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.271 178.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 1.03 HD13 ' O ' ' A' ' 14' ' ' ALA . 5.2 mp -91.57 -46.78 7.77 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.181 -0.95 . . . . 0.0 110.197 -178.191 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.8 ttpt -58.77 -27.62 65.16 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.054 -1.029 . . . . 0.0 109.179 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.0 tttt -95.01 -14.49 24.29 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.398 -0.813 . . . . 0.0 109.116 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.411 ' HB2' ' O ' ' A' ' 17' ' ' GLU . . . -63.58 -54.73 31.47 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.312 -0.868 . . . . 0.0 109.627 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 151.01 -14.16 0.86 Allowed Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.924 -1.271 . . . . 0.0 109.924 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.74 HD13 HG21 ' A' ' 48' ' ' ILE . 1.2 mt -103.65 161.24 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 120.988 -1.301 . . . . 0.0 109.482 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.4 p -147.81 15.97 1.09 Allowed 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 179.269 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.72 174.03 0.07 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.366 -0.834 . . . . 0.0 109.429 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.51 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 1.1 m-20 -112.13 -16.02 13.12 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.346 -0.846 . . . . 0.0 109.353 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.582 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 2.8 t80 -81.27 -20.78 40.17 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 120.869 -1.144 . . . . 0.0 108.864 179.556 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 1.048 ' CE2' HG23 ' A' ' 48' ' ' ILE . 18.8 m-30 -93.16 -4.75 51.58 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.372 -0.83 . . . . 0.0 109.351 179.482 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.687 ' CE2' ' HB3' ' A' ' 18' ' ' LEU . 23.5 m-85 -115.71 -55.64 2.41 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.475 -0.765 . . . . 0.0 109.57 -179.553 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.51 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 1.0 OUTLIER -64.12 -36.34 83.7 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.548 -0.72 . . . . 0.0 109.749 179.74 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.582 ' HB3' ' O ' ' A' ' 27' ' ' PHE . . . -80.88 -0.11 37.63 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.256 -0.903 . . . . 0.0 109.354 -179.8 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.495 ' CG2' ' HA ' ' A' ' 11' ' ' LYS . 15.6 mm -62.41 -55.55 23.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.445 -0.784 . . . . 0.0 109.606 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.5 p30 -64.26 -23.41 67.29 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.257 -0.902 . . . . 0.0 109.269 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.453 ' HB2' ' O ' ' A' ' 31' ' ' ALA . 0.4 OUTLIER -61.63 -28.28 69.26 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.165 -0.959 . . . . 0.0 109.191 179.615 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.625 ' HB3' HG22 ' A' ' 41' ' ' VAL . . . -41.54 159.04 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.424 -0.798 . . . . 0.0 109.917 -179.713 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.436 ' O ' HD22 ' A' ' 7' ' ' LEU . 9.8 mtpt -92.04 -61.84 1.54 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.433 -0.792 . . . . 0.0 109.413 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.479 ' C ' ' CD1' ' A' ' 7' ' ' LEU . 0.4 OUTLIER -117.06 178.47 4.34 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.575 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.469 ' N ' ' OG1' ' A' ' 37' ' ' THR . 96.4 t -56.78 -52.98 47.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.094 -1.004 . . . . 0.0 109.143 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.744 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 10.6 pt-20 -48.42 -27.98 2.97 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.352 -0.843 . . . . 0.0 108.934 179.521 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.422 ' HB2' ' O ' ' A' ' 37' ' ' THR . 19.7 mm-40 -79.1 -39.17 34.41 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.329 -0.857 . . . . 0.0 108.852 179.582 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.625 HG22 ' HB3' ' A' ' 35' ' ' ALA . 21.6 t -64.27 -64.62 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 178.845 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -55.16 -36.19 65.57 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.432 -0.793 . . . . 0.0 109.204 179.417 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.744 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -59.03 -39.73 82.83 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.381 -0.824 . . . . 0.0 109.08 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.448 HD23 ' HA ' ' A' ' 44' ' ' LEU . 8.5 mt -53.07 -44.55 67.57 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.337 -0.852 . . . . 0.0 109.831 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.846 ' HD3' HD11 ' A' ' 18' ' ' LEU . 4.7 tptp -62.74 -45.34 93.17 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.043 -1.036 . . . . 0.0 109.752 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.452 ' OD1' ' HA ' ' A' ' 43' ' ' ALA . 1.9 m120 -66.49 -19.96 65.92 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.421 -0.799 . . . . 0.0 109.755 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.901 ' O ' ' HB3' ' A' ' 51' ' ' ALA . 0.0 OUTLIER -86.67 11.93 11.81 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.163 -0.961 . . . . 0.0 109.326 179.797 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 1.048 HG23 ' CE2' ' A' ' 28' ' ' TYR . 11.8 mm -96.55 -51.99 9.88 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.566 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 178.532 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.429 ' N ' HD23 ' A' ' 49' ' ' LEU . 7.8 mt -52.96 -22.97 6.29 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 121.357 -0.839 . . . . 0.0 108.883 178.601 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.4 mmpt? -107.68 -45.83 3.94 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.132 -0.98 . . . . 0.0 109.532 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.901 ' HB3' ' O ' ' A' ' 47' ' ' GLU . . . -92.02 44.22 1.16 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.223 -0.923 . . . . 0.0 109.429 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.72 ' CG ' HG22 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -178.2 -27.86 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.191 -0.943 . . . . 0.0 109.979 179.865 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.596 ' HB2' ' CE1' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.49 1.569 0 O-C-N 120.999 -1.063 . . . . 0.0 109.505 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.418 HD13 HG21 ' A' ' 2' ' ' ILE . 1.3 pt -114.17 60.34 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.177 -0.952 . . . . 0.0 109.817 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.63 -10.93 30.09 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.222 -0.924 . . . . 0.0 109.134 179.433 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.12 -52.95 48.34 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.382 -0.823 . . . . 0.0 110.275 -179.551 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.569 ' O ' ' CB ' ' A' ' 6' ' ' LEU . 20.5 p-90 -129.09 -138.26 0.23 Allowed 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.098 -1.001 . . . . 0.0 109.348 -179.164 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.595 ' O ' ' N ' ' A' ' 8' ' ' LYS . 1.3 tp 93.46 -4.54 0.13 Allowed 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.548 ' O ' ' N ' ' A' ' 9' ' ' ASN . 0.1 OUTLIER 40.05 -80.1 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.094 0 O-C-N 122.047 -0.408 . . . . 0.0 112.099 178.884 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.595 ' N ' ' O ' ' A' ' 6' ' ' LEU . 2.9 mtpt -35.91 -28.43 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.108 -0.995 . . . . 0.0 110.963 -179.008 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.548 ' N ' ' O ' ' A' ' 7' ' ' LEU . 6.3 p-10 -47.12 -50.55 19.98 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.02 -1.05 . . . . 0.0 110.257 -179.761 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.485 ' O ' ' C ' ' A' ' 11' ' ' LYS . . . -80.83 -31.64 35.46 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.878 -1.139 . . . . 0.0 110.115 -179.571 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.693 ' O ' HD12 ' A' ' 15' ' ' ILE . 0.0 OUTLIER -33.29 -55.88 0.41 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.533 -0.73 . . . . 0.0 111.609 -179.138 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -74.67 -50.97 15.67 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 120.868 -1.145 . . . . 0.0 111.893 -177.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -47.76 -56.97 6.18 Favored 'General case' 0 C--N 1.299 -1.626 0 O-C-N 120.555 -1.341 . . . . 0.0 110.142 -178.794 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.432 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . -69.62 -58.28 4.13 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.147 -0.971 . . . . 0.0 110.621 -179.358 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.693 HD12 ' O ' ' A' ' 11' ' ' LYS . 65.5 mt -42.02 -30.64 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.041 -1.037 . . . . 0.0 109.607 -179.448 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.7 -51.56 40.34 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.419 -0.801 . . . . 0.0 109.438 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.44 ' O ' ' CG ' ' A' ' 17' ' ' GLU . 19.9 tt0 -70.24 -5.52 28.2 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.393 -0.817 . . . . 0.0 109.405 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.768 HD13 ' O ' ' A' ' 18' ' ' LEU . 1.3 tm? -93.68 -39.8 10.59 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.39 -0.819 . . . . 0.0 109.751 -179.56 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.5 ' HD3' HG22 ' A' ' 24' ' ' THR . 0.4 OUTLIER -67.59 -23.07 65.34 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.298 -0.877 . . . . 0.0 109.733 -179.463 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.19 -26.07 16.13 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.142 -0.974 . . . . 0.0 109.381 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.26 -37.2 54.71 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.271 -0.893 . . . . 0.0 109.297 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 130.2 11.11 2.59 Favored Glycine 0 N--CA 1.491 2.305 0 C-N-CA 119.939 -1.124 . . . . 0.0 110.393 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.767 HG21 ' NE2' ' A' ' 52' ' ' HIS . 0.0 OUTLIER -127.18 154.71 37.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 120.928 -1.337 . . . . 0.0 109.708 179.813 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.5 HG22 ' HD3' ' A' ' 19' ' ' LYS . 18.0 p -140.42 19.63 2.39 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.381 -0.824 . . . . 0.0 109.021 179.663 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.1 t -58.01 124.28 18.78 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.377 -0.827 . . . . 0.0 109.717 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -80.06 -1.87 41.85 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.239 -0.913 . . . . 0.0 109.405 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -73.69 -33.61 64.49 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.37 -0.831 . . . . 0.0 109.275 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.959 ' CE2' HG23 ' A' ' 48' ' ' ILE . 21.9 m-85 -80.59 -44.98 18.09 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.328 -0.857 . . . . 0.0 109.414 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.627 ' CD1' HG12 ' A' ' 15' ' ' ILE . 18.3 m-30 -62.8 -53.34 55.8 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.315 -0.866 . . . . 0.0 109.859 -179.894 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.428 ' O ' ' OD1' ' A' ' 33' ' ' ASN . 12.0 t-20 -54.54 -41.83 70.2 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.153 -0.967 . . . . 0.0 109.044 179.835 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.73 -25.22 63.74 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.498 -0.751 . . . . 0.0 109.451 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.853 HG23 HG13 ' A' ' 41' ' ' VAL . 5.3 mt -64.43 -46.2 93.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.268 -0.895 . . . . 0.0 109.344 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.428 ' OD1' ' O ' ' A' ' 30' ' ' ASN . 1.2 p-10 -71.87 -10.47 59.81 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.03 -1.044 . . . . 0.0 109.066 179.71 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.405 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -96.97 -20.7 17.9 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.294 -0.879 . . . . 0.0 109.363 179.938 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.958 ' HB1' ' HB3' ' A' ' 40' ' ' GLU . . . -46.75 169.66 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.28 -0.887 . . . . 0.0 109.458 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.7 mtmt -84.82 -58.91 2.52 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.218 -0.926 . . . . 0.0 109.281 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.652 HG22 ' OE2' ' A' ' 40' ' ' GLU . 15.1 t -131.2 -174.16 3.31 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.254 -0.904 . . . . 0.0 109.297 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 54.9 t -60.71 -39.99 83.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.064 -1.022 . . . . 0.0 109.256 179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.564 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 3.5 mt-10 -56.2 -28.76 59.46 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 179.159 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.958 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 0.4 OUTLIER -79.62 -31.41 41.64 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 179.037 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.853 HG13 HG23 ' A' ' 32' ' ' ILE . 16.3 t -66.73 -68.05 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 178.839 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 45.7 m-20 -53.16 -33.92 54.63 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.616 -0.678 . . . . 0.0 109.635 179.28 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.564 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -67.39 -34.95 78.33 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.339 -0.851 . . . . 0.0 110.31 -179.267 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 12.4 mt -76.95 -38.81 52.59 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.029 -1.044 . . . . 0.0 110.065 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.81 ' HG3' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -61.28 -29.57 69.94 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.169 -0.957 . . . . 0.0 109.943 -179.521 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 24.1 m-20 -71.24 -25.56 62.53 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.188 -0.945 . . . . 0.0 109.287 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.588 ' O ' ' HB3' ' A' ' 51' ' ' ALA . 2.8 tt0 -83.43 9.04 12.03 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.233 -0.917 . . . . 0.0 109.04 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.959 HG23 ' CE2' ' A' ' 28' ' ' TYR . 43.9 mt -88.34 -43.18 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 179.366 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.404 ' HA ' HD23 ' A' ' 49' ' ' LEU . 0.8 OUTLIER -69.94 -10.93 60.29 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.594 -0.692 . . . . 0.0 110.401 -179.89 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -120.38 -31.55 4.32 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.695 -1.253 . . . . 0.0 110.835 -179.253 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.588 ' HB3' ' O ' ' A' ' 47' ' ' GLU . . . -79.56 -20.07 47.91 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.881 -1.137 . . . . 0.0 110.617 -179.058 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.767 ' NE2' HG21 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -125.83 -16.79 5.58 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.955 -1.091 . . . . 0.0 109.9 -179.474 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.533 0 O-C-N 121.037 -1.039 . . . . 0.0 109.371 179.595 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' THR . . . . . 0.441 ' O ' ' C ' ' A' ' 2' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.511 ' O ' ' CD1' ' A' ' 5' ' ' TRP . 1.0 OUTLIER 42.5 35.69 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.271 -0.893 . . . . 0.0 109.778 179.622 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -49.17 -18.52 0.34 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.232 -0.917 . . . . 0.0 109.833 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -74.99 13.9 0.6 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.269 -0.894 . . . . 0.0 111.338 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.531 ' CE3' ' N ' ' A' ' 6' ' ' LEU . 1.2 p-90 -57.06 -46.92 82.09 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.389 -1.444 . . . . 0.0 109.147 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.531 ' N ' ' CE3' ' A' ' 5' ' ' TRP . 68.9 mt 48.07 16.78 0.09 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.485 -0.76 . . . . 0.0 111.394 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.568 HD11 ' CG2' ' A' ' 41' ' ' VAL . 14.2 tp 60.86 6.51 1.21 Allowed 'General case' 0 N--CA 1.497 1.903 0 O-C-N 120.652 -1.28 . . . . 0.0 110.662 179.75 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.51 ' HG3' ' NZ ' ' A' ' 11' ' ' LYS . 5.9 mttm -102.98 84.45 2.37 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 120.765 -1.209 . . . . 0.0 108.912 179.591 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -151.57 -82.26 0.1 Allowed 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.57 ' O ' ' HB3' ' A' ' 14' ' ' ALA . . . -70.68 -3.65 19.57 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.252 -0.905 . . . . 0.0 109.405 179.426 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.75 ' HD2' HG22 ' A' ' 32' ' ' ILE . 0.7 OUTLIER -54.47 -53.28 56.43 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.064 -1.022 . . . . 0.0 109.94 -179.823 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -88.83 -42.1 12.08 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.049 -1.032 . . . . 0.0 109.626 -179.648 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.91 -16.26 28.21 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.018 -1.051 . . . . 0.0 108.747 179.44 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.57 ' HB3' ' O ' ' A' ' 10' ' ' ALA . . . -102.99 -41.46 6.11 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.355 -0.84 . . . . 0.0 108.866 179.455 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.575 ' CG1' ' CD1' ' A' ' 32' ' ' ILE . 22.7 mt -52.88 -33.61 19.31 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 179.147 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.87 -38.88 79.99 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 179.055 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.534 ' CG ' ' O ' ' A' ' 17' ' ' GLU . 15.6 tt0 -90.22 4.22 51.22 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 179.228 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.602 HD23 ' HE3' ' A' ' 45' ' ' LYS . 20.1 mt -96.11 -55.33 3.0 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.262 -0.899 . . . . 0.0 108.725 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 25.5 ttpt -59.05 -40.9 86.54 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.81 -26.53 68.67 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.355 -0.841 . . . . 0.0 108.948 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.464 ' HB3' ' O ' ' A' ' 18' ' ' LEU . . . -53.92 -39.34 65.75 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.328 -0.857 . . . . 0.0 109.141 179.654 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 134.8 -1.72 3.94 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.742 -1.343 . . . . 0.0 109.742 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.47 HG22 ' H ' ' A' ' 25' ' ' SER . 9.4 mt -106.74 158.99 6.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.096 -1.237 . . . . 0.0 109.63 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 5.8 p -151.17 18.4 0.76 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.414 -0.804 . . . . 0.0 108.926 179.584 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.47 ' H ' HG22 ' A' ' 23' ' ' ILE . 0.6 OUTLIER -62.69 -177.44 0.15 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.395 -0.816 . . . . 0.0 109.447 -179.895 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.481 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 3.4 t0 -116.18 -21.0 9.59 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.42 -0.8 . . . . 0.0 109.009 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.54 ' CD1' ' O ' ' A' ' 27' ' ' PHE . 5.7 t80 -81.04 -3.92 53.44 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 120.991 -1.068 . . . . 0.0 108.443 179.001 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.89 ' CE2' HG23 ' A' ' 48' ' ' ILE . 16.9 m-30 -109.42 -6.9 15.29 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.527 -0.733 . . . . 0.0 109.614 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.547 ' CE1' ' HB3' ' A' ' 18' ' ' LEU . 61.6 m-85 -119.38 -43.93 2.59 Favored 'General case' 0 C--N 1.298 -1.672 0 CA-C-O 121.728 0.775 . . . . 0.0 109.381 -178.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.481 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 0.8 OUTLIER -65.5 -21.06 66.58 Favored 'General case' 0 C--N 1.295 -1.765 0 O-C-N 121.738 -0.601 . . . . 0.0 109.38 179.301 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.28 -3.1 58.71 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.224 -0.922 . . . . 0.0 109.823 -179.334 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.75 HG22 ' HD2' ' A' ' 11' ' ' LYS . 18.1 mt -65.27 -61.6 1.62 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.394 -0.816 . . . . 0.0 109.759 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.539 ' HA ' ' CD ' ' A' ' 11' ' ' LYS . 2.3 p30 -65.29 -9.46 24.42 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.196 -0.94 . . . . 0.0 109.807 -179.617 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.455 ' O ' ' O ' ' A' ' 35' ' ' ALA . 18.7 mmtm -93.62 -19.1 21.47 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.189 -0.945 . . . . 0.0 109.395 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.564 ' HB1' ' HB3' ' A' ' 40' ' ' GLU . . . -55.17 -164.52 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.413 -0.805 . . . . 0.0 109.72 -179.88 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.7 -63.89 1.37 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.191 -0.943 . . . . 0.0 109.715 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.596 ' O ' HG23 ' A' ' 41' ' ' VAL . 21.4 p -120.02 178.22 4.7 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.166 -0.958 . . . . 0.0 109.444 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 86.6 t -62.33 -43.45 98.11 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.334 -0.854 . . . . 0.0 109.157 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.706 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 0.0 OUTLIER -57.08 -26.33 60.24 Favored 'General case' 0 C--N 1.297 -1.678 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 179.135 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.564 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -80.69 -33.98 34.99 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 178.896 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.615 HG13 HG23 ' A' ' 32' ' ' ILE . 14.6 t -65.27 -64.53 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 178.821 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 55.9 m-80 -56.34 -31.96 64.24 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.03 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.706 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -59.5 -42.34 91.96 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.25 -0.906 . . . . 0.0 108.722 179.569 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.411 ' HB2' ' O ' ' A' ' 41' ' ' VAL . 2.3 mt -49.8 -54.57 18.37 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.407 -0.808 . . . . 0.0 109.89 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.84 ' HA ' HD12 ' A' ' 48' ' ' ILE . 17.1 tptp -49.61 -34.62 18.46 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.094 -1.004 . . . . 0.0 109.607 -179.599 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.407 ' HA ' HD21 ' A' ' 49' ' ' LEU . 2.8 m-20 -67.53 -48.77 66.03 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.26 -0.9 . . . . 0.0 109.428 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.45 ' O ' ' HB3' ' A' ' 51' ' ' ALA . 0.1 OUTLIER -74.27 -0.95 18.62 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.057 -1.027 . . . . 0.0 109.176 179.333 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.89 HG23 ' CE2' ' A' ' 28' ' ' TYR . 20.4 mt -87.63 -53.3 10.18 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 O-C-N 121.237 -0.914 . . . . 0.0 108.649 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.565 HD23 ' O ' ' A' ' 45' ' ' LYS . 0.6 OUTLIER -67.03 -18.7 65.49 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.046 -1.033 . . . . 0.0 108.424 179.12 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.9 -41.23 11.91 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 179.246 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.45 ' HB3' ' O ' ' A' ' 47' ' ' GLU . . . -89.56 13.7 13.32 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.706 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 0.0 OUTLIER -166.76 164.68 16.58 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 -179.731 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.706 ' HB3' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.493 1.687 0 CA-C-O 118.005 -0.998 . . . . 0.0 109.287 -179.594 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 1.6 m . . . . . 0 N--CA 1.49 1.555 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 1.8 mt -131.87 61.66 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.183 -0.948 . . . . 0.0 110.036 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -86.11 15.81 4.8 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.101 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.506 ' O ' ' O ' ' A' ' 5' ' ' TRP . 1.4 tt0 -99.75 14.42 30.29 Favored 'General case' 0 N--CA 1.483 1.215 0 O-C-N 121.623 -0.673 . . . . 0.0 109.892 -179.407 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.616 ' CE3' ' HG ' ' A' ' 6' ' ' LEU . 2.4 t90 -53.45 -107.3 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.32 -0.862 . . . . 0.0 109.626 -179.699 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.616 ' HG ' ' CE3' ' A' ' 5' ' ' TRP . 0.5 OUTLIER 158.94 19.11 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.194 0 O-C-N 120.813 -1.179 . . . . 0.0 112.336 178.982 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.882 HD21 HG21 ' A' ' 41' ' ' VAL . 0.6 OUTLIER 25.97 -134.77 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.339 -0.851 . . . . 0.0 110.92 178.893 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.503 ' H ' HD22 ' A' ' 7' ' ' LEU . 7.8 mttp 64.69 33.91 10.12 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.776 -1.203 . . . . 0.0 109.866 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.731 ' ND2' HD23 ' A' ' 7' ' ' LEU . 4.5 p30 -129.23 -48.98 1.19 Allowed 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 179.194 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.77 ' HB2' HG13 ' A' ' 38' ' ' VAL . . . -81.77 -7.16 59.57 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.308 -0.87 . . . . 0.0 109.115 178.915 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.749 ' O ' HD12 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -37.89 -46.48 0.96 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.555 -0.716 . . . . 0.0 110.512 -179.503 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -97.93 -22.18 16.46 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.005 -1.059 . . . . 0.0 110.455 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -61.27 -41.93 97.77 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.069 -1.02 . . . . 0.0 110.483 -179.194 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.548 ' CB ' ' HA ' ' A' ' 42' ' ' ASN . . . -85.41 -40.31 16.59 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.03 -1.044 . . . . 0.0 109.893 -179.631 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 1.001 HG23 ' CE1' ' A' ' 29' ' ' PHE . 67.2 mt -61.08 -27.04 40.86 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.542 0 CA-C-O 121.566 0.698 . . . . 0.0 109.81 -179.592 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.12 -7.1 10.87 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.643 -0.661 . . . . 0.0 110.743 -178.333 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.465 ' OE2' ' OD1' ' A' ' 46' ' ' ASN . 2.9 pt-20 -109.35 -8.55 15.05 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 121.022 -1.049 . . . . 0.0 109.51 -179.515 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.637 HD11 HG21 ' A' ' 48' ' ' ILE . 0.6 OUTLIER -100.65 -46.81 5.06 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.19 -0.943 . . . . 0.0 110.125 179.946 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 27.8 ttmt -52.75 -39.38 62.13 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.126 -0.984 . . . . 0.0 109.934 -179.555 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -31.27 71.86 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.195 -0.94 . . . . 0.0 109.613 -179.759 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.52 -49.07 78.19 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.19 -0.944 . . . . 0.0 109.239 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 135.46 -8.88 4.34 Favored Glycine 0 N--CA 1.489 2.193 0 N-CA-C 109.661 -1.376 . . . . 0.0 109.661 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.825 HD13 ' CE1' ' A' ' 52' ' ' HIS . 48.8 mt -75.08 122.98 29.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.213 -1.169 . . . . 0.0 109.499 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -117.86 19.08 13.88 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.388 -0.82 . . . . 0.0 109.43 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.48 121.58 15.22 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.292 -0.88 . . . . 0.0 109.52 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.42 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 0.3 OUTLIER -74.41 -1.68 22.08 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.238 -0.914 . . . . 0.0 109.598 179.87 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.69 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 4.5 t80 -76.64 -14.99 59.93 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.235 -0.915 . . . . 0.0 109.175 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.714 ' HB3' HD11 ' A' ' 48' ' ' ILE . 62.3 m-85 -104.27 -33.37 8.7 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.421 -0.799 . . . . 0.0 109.073 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 1.001 ' CE1' HG23 ' A' ' 15' ' ' ILE . 8.7 m-85 -71.44 -47.37 56.2 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.362 -0.836 . . . . 0.0 108.805 179.082 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.461 ' O ' ' HD2' ' A' ' 34' ' ' LYS . 0.1 OUTLIER -61.33 -29.77 70.1 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.374 -0.829 . . . . 0.0 109.561 179.821 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.6 -22.4 50.91 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.268 -0.895 . . . . 0.0 109.462 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.71 HD13 ' O ' ' A' ' 28' ' ' TYR . 1.2 mp -65.18 -42.54 94.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.301 -0.874 . . . . 0.0 108.932 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 31.2 t30 -80.81 8.29 8.52 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.168 -0.957 . . . . 0.0 110.222 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.479 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.2 OUTLIER -122.14 -14.47 7.95 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.027 -1.046 . . . . 0.0 110.034 -179.746 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.803 ' HB2' HD12 ' A' ' 44' ' ' LEU . . . -47.65 -102.54 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.36 -0.838 . . . . 0.0 110.599 -179.487 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.55 ' C ' HD12 ' A' ' 7' ' ' LEU . 0.9 OUTLIER -171.05 -68.71 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.803 -1.185 . . . . 0.0 109.565 -179.311 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.938 ' O ' HG23 ' A' ' 41' ' ' VAL . 33.3 p -123.41 -167.72 1.66 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.313 -0.867 . . . . 0.0 109.399 -179.856 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.77 HG13 ' HB2' ' A' ' 10' ' ' ALA . 26.1 t -64.85 -53.9 36.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.152 -0.968 . . . . 0.0 109.372 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.56 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 9.2 pt-20 -52.97 -27.32 18.51 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.273 -0.892 . . . . 0.0 109.469 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.615 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 2.8 mm-40 -81.08 -33.09 33.63 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.167 -0.958 . . . . 0.0 109.001 179.507 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.938 HG23 ' O ' ' A' ' 37' ' ' THR . 15.6 t -70.61 -62.35 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.391 -0.818 . . . . 0.0 108.959 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.548 ' HA ' ' CB ' ' A' ' 14' ' ' ALA . 27.9 m120 -57.12 -31.7 65.58 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.467 -0.771 . . . . 0.0 109.61 179.54 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.56 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -67.36 -40.47 85.8 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.181 -0.949 . . . . 0.0 109.058 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.803 HD12 ' HB2' ' A' ' 35' ' ' ALA . 6.0 mt -61.91 -48.52 80.08 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.313 -0.867 . . . . 0.0 110.704 -179.793 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.645 ' HD2' HD11 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -65.73 -24.94 67.08 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.868 -1.145 . . . . 0.0 110.356 -178.898 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.465 ' OD1' ' OE2' ' A' ' 17' ' ' GLU . 41.1 m-20 -80.94 -25.1 37.66 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.964 -1.085 . . . . 0.0 110.398 -179.513 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.434 ' O ' ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -77.69 -18.97 56.08 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.986 -1.072 . . . . 0.0 110.412 -179.365 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.714 HD11 ' HB3' ' A' ' 28' ' ' TYR . 1.1 mt -66.14 -29.06 45.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.084 -1.01 . . . . 0.0 108.989 179.528 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.466 ' O ' ' OXT' ' A' ' 53' ' ' ALA . 1.4 mm? -60.34 -25.66 65.99 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.037 -1.039 . . . . 0.0 109.19 179.373 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.59 6.37 5.67 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.062 -1.024 . . . . 0.0 109.87 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.445 ' HB3' ' HA ' ' A' ' 48' ' ' ILE . . . -101.0 -19.52 15.8 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.283 -0.886 . . . . 0.0 109.496 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.825 ' CE1' HD13 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -143.36 8.55 1.59 Allowed 'General case' 0 C--N 1.303 -1.454 0 C-N-CA 119.573 -0.851 . . . . 0.0 110.156 -178.398 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.466 ' OXT' ' O ' ' A' ' 49' ' ' LEU . . . . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 117.999 -1.0 . . . . 0.0 109.596 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 14.6 t . . . . . 0 N--CA 1.491 1.575 0 CA-C-O 121.315 0.579 . . . . 0.0 109.633 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.537 ' CG1' ' O ' ' A' ' 2' ' ' ILE . 2.1 tt -170.1 33.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.246 -0.908 . . . . 0.0 109.353 179.735 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.71 -10.83 50.85 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.056 -1.028 . . . . 0.0 108.634 179.266 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -71.88 -23.32 61.48 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.388 -0.82 . . . . 0.0 109.291 179.77 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.491 ' O ' ' N ' ' A' ' 7' ' ' LEU . 1.3 t90 -52.32 -48.5 65.41 Favored 'General case' 0 C--N 1.306 -1.304 0 O-C-N 121.242 -0.911 . . . . 0.0 110.86 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.48 ' O ' ' HB3' ' A' ' 7' ' ' LEU . 44.7 mt -38.68 -28.83 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.325 -0.859 . . . . 0.0 110.247 -178.888 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 1.094 HD11 HG21 ' A' ' 41' ' ' VAL . 20.5 tp 62.38 113.74 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.261 -0.899 . . . . 0.0 109.773 179.365 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.554 ' CG ' ' O ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER 179.26 40.37 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 179.647 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.827 ' OD1' HG22 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -110.73 -61.98 1.6 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.366 -0.834 . . . . 0.0 109.799 -178.984 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -81.15 10.98 4.56 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.251 -0.906 . . . . 0.0 109.709 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.488 ' O ' HG13 ' A' ' 15' ' ' ILE . 0.1 OUTLIER -50.98 -78.15 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.028 -1.045 . . . . 0.0 110.505 -179.244 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -88.16 -18.34 28.98 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.011 -1.056 . . . . 0.0 110.94 -178.743 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -61.08 -39.48 90.06 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.826 -1.171 . . . . 0.0 109.308 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.522 ' O ' HD23 ' A' ' 18' ' ' LEU . . . -85.86 -45.93 11.09 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.27 -0.894 . . . . 0.0 109.254 179.724 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.808 HG23 ' CE1' ' A' ' 29' ' ' PHE . 95.2 mt -50.49 -29.23 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.535 -0.728 . . . . 0.0 110.288 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.3 -39.05 89.04 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.407 -0.808 . . . . 0.0 110.145 -178.629 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.416 ' C ' HD22 ' A' ' 18' ' ' LEU . 12.8 tt0 -83.37 -2.02 54.77 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.411 -0.806 . . . . 0.0 110.969 -178.83 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.522 HD23 ' O ' ' A' ' 14' ' ' ALA . 4.1 mm? -98.1 -38.01 9.51 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.814 -1.179 . . . . 0.0 110.066 -179.685 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.66 -38.92 49.12 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.237 -0.914 . . . . 0.0 109.736 -179.598 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.9 ttpt -71.51 -32.78 68.59 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.015 -1.053 . . . . 0.0 109.263 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.62 -22.21 32.44 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.259 -0.901 . . . . 0.0 109.582 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.444 ' O ' ' N ' ' A' ' 24' ' ' THR . . . 106.26 -41.14 2.25 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.536 HD13 ' CG2' ' A' ' 48' ' ' ILE . 46.8 mt -52.01 94.2 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.3 -1.118 . . . . 0.0 109.397 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.444 ' N ' ' O ' ' A' ' 22' ' ' GLY . 0.8 OUTLIER -97.27 19.8 12.53 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.22 -0.925 . . . . 0.0 109.848 -179.843 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.98 150.85 32.14 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.119 -0.988 . . . . 0.0 109.752 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -96.77 -8.18 31.86 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.244 -0.91 . . . . 0.0 109.276 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.514 ' CD1' ' O ' ' A' ' 27' ' ' PHE . 8.4 t80 -80.65 -8.8 59.75 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.038 -1.039 . . . . 0.0 109.476 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.656 ' CE2' HG23 ' A' ' 48' ' ' ILE . 18.6 m-30 -106.18 -15.33 14.89 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.384 -0.823 . . . . 0.0 109.207 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.808 ' CE1' HG23 ' A' ' 15' ' ' ILE . 10.7 m-30 -104.66 -49.75 3.46 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.577 -0.702 . . . . 0.0 109.376 -179.783 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -64.61 -41.23 96.34 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.244 -0.91 . . . . 0.0 109.35 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.7 1.27 20.45 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.228 -0.92 . . . . 0.0 109.775 -179.609 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.613 ' HA ' HD21 ' A' ' 44' ' ' LEU . 0.1 OUTLIER -72.96 -41.45 60.13 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.154 -0.966 . . . . 0.0 109.017 179.914 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 23.0 p30 -80.19 -0.78 37.66 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.339 -0.851 . . . . 0.0 109.576 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.497 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -107.03 -16.54 14.41 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.264 -0.898 . . . . 0.0 109.752 -179.563 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.634 ' HB1' ' OE1' ' A' ' 40' ' ' GLU . . . -39.61 -98.91 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.641 -0.662 . . . . 0.0 110.624 -179.273 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.518 ' CG ' ' O ' ' A' ' 35' ' ' ALA . 5.3 mttt -171.15 -69.28 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.993 -1.067 . . . . 0.0 109.027 -179.235 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.855 ' O ' HG23 ' A' ' 41' ' ' VAL . 5.1 t -127.94 -177.65 4.21 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.827 HG22 ' OD1' ' A' ' 9' ' ' ASN . 4.6 t -61.53 -48.87 86.79 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 O-C-N 120.909 -1.119 . . . . 0.0 109.661 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.554 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 1.1 tt0 -61.35 -18.47 58.81 Favored 'General case' 0 C--N 1.296 -1.749 0 O-C-N 121.087 -1.008 . . . . 0.0 109.103 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.634 ' OE1' ' HB1' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -90.78 -26.15 19.61 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.208 -0.932 . . . . 0.0 109.019 179.657 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 1.094 HG21 HD11 ' A' ' 7' ' ' LEU . 20.2 t -76.09 -54.75 12.92 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.398 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 179.007 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -66.68 -28.49 68.49 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.514 -0.741 . . . . 0.0 109.493 179.08 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.554 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -76.99 -23.97 52.26 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.201 -0.937 . . . . 0.0 109.678 -179.68 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.681 HD12 ' C ' ' A' ' 44' ' ' LEU . 0.3 OUTLIER -78.75 -41.23 31.24 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.162 -0.961 . . . . 0.0 109.86 -179.581 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.83 ' HA ' HD13 ' A' ' 48' ' ' ILE . 6.4 mmtt -61.58 -35.17 77.05 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.959 -1.088 . . . . 0.0 109.592 -179.787 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.2 m-20 -70.39 -23.5 62.78 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.083 -1.01 . . . . 0.0 108.457 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.552 ' O ' ' HB3' ' A' ' 51' ' ' ALA . 2.2 tt0 -78.85 1.56 23.0 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.5 -0.75 . . . . 0.0 109.038 179.183 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.83 HD13 ' HA ' ' A' ' 45' ' ' LYS . 1.7 mp -79.33 -33.16 15.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.545 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 23.1 tp -69.98 -30.86 68.3 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.426 -0.796 . . . . 0.0 109.938 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.6 mttt -102.79 -14.89 16.43 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.025 -1.047 . . . . 0.0 110.01 -179.546 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.552 ' HB3' ' O ' ' A' ' 47' ' ' GLU . . . -100.77 19.69 16.67 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.154 -0.966 . . . . 0.0 109.72 -179.768 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -165.52 -44.26 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.272 -0.892 . . . . 0.0 109.153 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.545 ' HB3' ' O ' ' A' ' 49' ' ' LEU . . . . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 117.953 -1.023 . . . . 0.0 109.558 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 13.9 t . . . . . 0 N--CA 1.491 1.597 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.405 ' C ' ' N ' ' A' ' 4' ' ' GLN . 0.2 OUTLIER -147.37 26.32 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.184 -0.948 . . . . 0.0 110.183 -179.622 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -55.34 -18.71 7.03 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 177.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.405 ' N ' ' C ' ' A' ' 2' ' ' ILE . 24.5 mt-30 -94.04 55.39 2.07 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.517 ' O ' ' N ' ' A' ' 7' ' ' LEU . 5.0 p-90 -79.43 -56.69 4.14 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.884 -1.135 . . . . 0.0 109.829 -179.605 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.865 HD12 ' N ' ' A' ' 6' ' ' LEU . 4.6 mp 38.34 25.42 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.595 -0.691 . . . . 0.0 111.02 179.766 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.81 HD11 ' CG2' ' A' ' 41' ' ' VAL . 42.1 tp 67.09 -10.09 0.34 Allowed 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.12 -0.988 . . . . 0.0 112.012 179.547 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -99.48 90.82 4.65 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 120.35 -1.469 . . . . 0.0 109.233 -179.743 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.469 HD21 ' HA ' ' A' ' 5' ' ' TRP . 0.1 OUTLIER -161.93 -87.82 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.413 -0.804 . . . . 0.0 109.189 -179.572 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.43 ' HB3' HG13 ' A' ' 38' ' ' VAL . . . -54.45 -18.3 4.09 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.333 -0.854 . . . . 0.0 109.687 179.782 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.462 ' O ' HG13 ' A' ' 15' ' ' ILE . 0.4 OUTLIER -57.82 -71.46 0.11 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.237 -0.915 . . . . 0.0 110.181 -179.471 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -64.29 -28.54 69.79 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.002 -1.061 . . . . 0.0 110.013 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -61.77 -31.87 72.1 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 120.975 -1.078 . . . . 0.0 109.125 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.28 -58.25 2.83 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.312 -0.868 . . . . 0.0 108.775 179.323 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.597 HG23 ' CE1' ' A' ' 29' ' ' PHE . 8.3 mt -43.33 -35.22 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 O-C-N 121.531 -0.731 . . . . 0.0 110.413 179.717 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -77.15 29.26 0.14 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.294 -0.879 . . . . 0.0 110.652 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -151.66 -36.62 0.13 Allowed 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 179.862 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.619 HD12 ' HE3' ' A' ' 45' ' ' LYS . 14.9 mt -78.72 -31.31 46.34 Favored 'General case' 0 C--N 1.306 -1.287 0 O-C-N 121.64 -0.662 . . . . 0.0 109.558 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.9 tttt -58.95 -21.53 58.5 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.131 -0.981 . . . . 0.0 109.674 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 41.1 mtmt -84.03 -25.91 29.51 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.289 -0.882 . . . . 0.0 109.527 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.32 -4.06 13.11 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.27 -0.894 . . . . 0.0 109.773 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 102.36 -34.73 5.49 Favored Glycine 0 N--CA 1.488 2.149 0 N-CA-C 108.966 -1.654 . . . . 0.0 108.966 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.472 ' O ' ' CG2' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -46.9 117.67 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 O-C-N 121.44 -1.035 . . . . 0.0 108.864 179.735 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.39 6.77 6.36 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.08 -1.013 . . . . 0.0 110.042 -179.661 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -54.01 121.1 7.35 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.237 -0.914 . . . . 0.0 109.222 179.67 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.471 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 33.3 m-20 -73.51 -1.4 18.4 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.083 -1.01 . . . . 0.0 109.641 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.466 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 3.2 t80 -80.82 -39.79 26.02 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.034 -1.041 . . . . 0.0 109.247 179.884 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 1.079 ' CE2' HG23 ' A' ' 48' ' ' ILE . 21.7 m-30 -74.83 -25.03 58.72 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.472 -0.768 . . . . 0.0 110.129 -179.467 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.597 ' CE1' HG23 ' A' ' 15' ' ' ILE . 11.7 m-85 -94.97 -49.93 5.33 Favored 'General case' 0 C--N 1.297 -1.677 0 O-C-N 121.271 -0.893 . . . . 0.0 110.205 -178.838 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.471 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 66.3 m-20 -61.0 -35.77 77.72 Favored 'General case' 0 C--N 1.297 -1.704 0 O-C-N 121.152 -0.968 . . . . 0.0 109.476 179.67 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.432 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . . . -85.26 -4.39 59.14 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.256 -0.903 . . . . 0.0 110.328 -179.033 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.551 ' CD1' ' HE2' ' A' ' 45' ' ' LYS . 0.4 OUTLIER -62.59 -44.82 99.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.074 -1.016 . . . . 0.0 109.554 -179.67 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -77.82 -5.63 51.46 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.14 -0.975 . . . . 0.0 109.489 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.452 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -77.99 -22.86 48.72 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.244 -0.91 . . . . 0.0 109.607 -179.92 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.901 ' HB1' ' HB3' ' A' ' 40' ' ' GLU . . . -51.53 -175.47 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.216 -0.928 . . . . 0.0 109.973 -179.683 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.446 ' H ' ' CB ' ' A' ' 40' ' ' GLU . 0.5 OUTLIER -106.58 -54.04 2.53 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.498 -0.751 . . . . 0.0 109.096 179.824 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.686 ' O ' HG23 ' A' ' 41' ' ' VAL . 51.9 p -123.61 -172.95 2.63 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.312 -0.868 . . . . 0.0 109.24 179.752 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.463 HG22 ' OD1' ' A' ' 9' ' ' ASN . 67.4 t -66.91 -26.17 36.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.111 -0.993 . . . . 0.0 109.474 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.722 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 63.7 mt-10 -73.12 -29.18 62.71 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 179.381 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.901 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 2.9 mm-40 -79.23 -32.54 43.94 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 178.831 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.81 ' CG2' HD11 ' A' ' 7' ' ' LEU . 21.1 t -68.61 -68.37 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.891 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -51.3 -28.27 11.63 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 179.222 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.722 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -64.21 -50.34 68.45 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.43 -0.794 . . . . 0.0 109.031 179.563 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.9 mt -54.98 -44.0 74.05 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.29 -0.882 . . . . 0.0 109.881 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.655 ' NZ ' HD11 ' A' ' 48' ' ' ILE . 0.3 OUTLIER -57.64 -40.53 79.45 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.16 -0.963 . . . . 0.0 109.162 179.862 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.5 m-20 -69.65 -21.87 63.5 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.263 -0.898 . . . . 0.0 109.622 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.67 ' O ' ' HB3' ' A' ' 51' ' ' ALA . 1.4 mt-10 -82.96 10.27 8.27 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.212 -0.93 . . . . 0.0 109.314 179.488 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 1.079 HG23 ' CE2' ' A' ' 28' ' ' TYR . 62.0 mt -90.03 -45.02 15.1 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 179.154 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 7.4 mp -61.72 -21.48 64.53 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.436 -0.79 . . . . 0.0 109.681 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -106.42 -43.22 4.82 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.902 -1.124 . . . . 0.0 109.906 -179.736 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.67 ' HB3' ' O ' ' A' ' 47' ' ' GLU . . . -84.71 43.15 0.96 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.163 -0.961 . . . . 0.0 109.134 179.517 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.725 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 0.4 OUTLIER 163.14 157.03 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 -179.54 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.725 ' HB3' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 118.037 -0.982 . . . . 0.0 109.425 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 7.7 p . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.488 HG12 ' O ' ' A' ' 2' ' ' ILE . 17.4 tt -136.62 36.66 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.203 -0.936 . . . . 0.0 109.69 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -69.57 -6.67 32.56 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.176 -0.953 . . . . 0.0 108.576 178.643 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -91.56 57.45 3.29 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.466 -0.771 . . . . 0.0 109.917 -179.737 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.444 ' O ' ' HB2' ' A' ' 6' ' ' LEU . 1.3 t90 -56.32 -87.61 0.0 OUTLIER 'General case' 0 C--N 1.304 -1.395 0 O-C-N 120.977 -1.077 . . . . 0.0 111.123 -179.24 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' A' ' 5' ' ' TRP . 0.7 OUTLIER 179.23 -44.94 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.601 -1.312 . . . . 0.0 109.389 -179.792 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.915 HD21 ' CG2' ' A' ' 41' ' ' VAL . 0.7 OUTLIER -139.09 -106.12 0.17 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.362 -0.837 . . . . 0.0 109.108 179.805 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.632 ' H ' HD23 ' A' ' 7' ' ' LEU . 0.4 OUTLIER 41.97 35.95 0.61 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.073 -1.017 . . . . 0.0 109.867 179.731 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.488 ' ND2' ' HG ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER -87.36 -75.08 0.42 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.249 -0.907 . . . . 0.0 108.714 179.705 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -81.87 29.73 0.39 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.184 -0.947 . . . . 0.0 110.396 179.583 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.768 ' O ' HD12 ' A' ' 15' ' ' ILE . 0.4 OUTLIER -63.81 -42.86 97.59 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 120.788 -1.195 . . . . 0.0 109.915 -179.715 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.519 ' O ' ' HB2' ' A' ' 16' ' ' ALA . 1.5 tt0 -96.01 -26.04 15.7 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.048 -1.033 . . . . 0.0 110.437 -179.241 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -65.83 -56.43 11.93 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.822 -1.174 . . . . 0.0 110.146 -179.341 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.64 ' HB1' ' HD2' ' A' ' 45' ' ' LYS . . . -69.77 -46.78 65.03 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.203 -0.936 . . . . 0.0 110.009 -179.531 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 1.052 HG23 ' CZ ' ' A' ' 29' ' ' PHE . 46.0 mt -57.85 -29.59 35.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 CA-C-O 121.718 0.77 . . . . 0.0 109.652 -179.699 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.519 ' HB2' ' O ' ' A' ' 12' ' ' GLU . . . -61.79 -6.8 2.92 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.51 -0.744 . . . . 0.0 111.284 -178.84 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.589 ' HB3' ' HZ2' ' A' ' 45' ' ' LYS . 28.6 tt0 -105.39 -22.61 12.99 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 120.906 -1.121 . . . . 0.0 109.996 -179.365 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.987 HD21 HD12 ' A' ' 48' ' ' ILE . 0.7 OUTLIER -76.78 -35.98 57.31 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.924 -1.11 . . . . 0.0 109.449 -179.87 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.7 ttmt -50.34 -35.12 26.35 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.323 -0.861 . . . . 0.0 109.843 -179.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.85 -21.77 21.29 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.141 -0.974 . . . . 0.0 109.746 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.27 -28.13 69.52 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.154 -0.966 . . . . 0.0 109.17 179.753 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 115.61 -16.93 16.37 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.668 HD13 HG21 ' A' ' 48' ' ' ILE . 67.4 mt -84.19 115.13 25.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.198 -1.178 . . . . 0.0 109.798 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.414 ' O ' ' C ' ' A' ' 25' ' ' SER . 0.0 OUTLIER -117.47 0.45 12.15 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.187 -0.946 . . . . 0.0 109.302 179.36 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.414 ' C ' ' O ' ' A' ' 24' ' ' THR . 49.6 m -44.75 157.44 0.07 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.177 -0.952 . . . . 0.0 109.45 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.463 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 4.8 p-10 -104.11 -7.17 20.42 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.22 -0.925 . . . . 0.0 109.866 -179.621 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.563 ' O ' ' CG ' ' A' ' 27' ' ' PHE . 27.0 t80 -80.54 1.3 30.13 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.982 -1.073 . . . . 0.0 109.55 -179.881 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.961 ' CE2' HG23 ' A' ' 48' ' ' ILE . 15.6 m-85 -117.34 -50.66 2.54 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 179.205 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 1.052 ' CZ ' HG23 ' A' ' 15' ' ' ILE . 1.2 m-30 -66.41 -38.83 88.34 Favored 'General case' 0 C--N 1.302 -1.48 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.121 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.463 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 12.0 m-20 -69.76 -34.33 73.64 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.209 -0.932 . . . . 0.0 108.833 179.435 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.91 -15.42 58.35 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.476 -0.765 . . . . 0.0 109.471 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 1.111 HG23 HG13 ' A' ' 41' ' ' VAL . 1.3 mm -53.12 -27.72 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.251 -0.905 . . . . 0.0 108.968 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.457 ' OD1' ' O ' ' A' ' 30' ' ' ASN . 2.2 p-10 -80.38 -33.32 37.24 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.031 -1.043 . . . . 0.0 109.486 179.784 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.46 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -54.71 -27.98 44.61 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.245 -0.909 . . . . 0.0 109.428 179.986 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.716 ' HB2' HD12 ' A' ' 44' ' ' LEU . . . -44.99 169.27 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.288 -0.883 . . . . 0.0 109.476 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.3 mttp -99.0 -47.0 5.4 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.319 -0.863 . . . . 0.0 109.455 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.627 ' O ' HG23 ' A' ' 41' ' ' VAL . 70.6 p -126.73 -163.08 1.2 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.208 -0.932 . . . . 0.0 109.388 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.484 HG22 HD22 ' A' ' 9' ' ' ASN . 87.3 t -70.56 -54.98 15.96 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 O-C-N 121.301 -0.874 . . . . 0.0 109.317 179.818 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.685 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 3.2 tt0 -53.33 -27.94 26.02 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.275 -0.891 . . . . 0.0 109.228 179.755 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.596 ' HB2' ' HB1' ' A' ' 35' ' ' ALA . 4.8 mm-40 -79.07 -35.38 42.54 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 179.295 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 1.111 HG13 HG23 ' A' ' 32' ' ' ILE . 55.4 t -65.76 -67.18 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 178.685 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.484 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 7.4 m-20 -53.9 -30.71 47.29 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.674 -0.641 . . . . 0.0 109.537 179.228 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.685 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -66.14 -39.89 90.2 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.215 -0.928 . . . . 0.0 109.457 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.716 HD12 ' HB2' ' A' ' 35' ' ' ALA . 4.0 mt -61.67 -43.11 99.48 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.262 -0.899 . . . . 0.0 110.699 -179.451 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.942 ' HE2' HD13 ' A' ' 18' ' ' LEU . 0.0 OUTLIER -67.32 -43.51 81.42 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.846 -1.159 . . . . 0.0 109.883 -179.163 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.475 ' N ' ' CG ' ' A' ' 45' ' ' LYS . 28.0 m-20 -69.35 -21.47 63.81 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.108 -0.995 . . . . 0.0 108.69 179.626 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.426 ' HB2' ' O ' ' A' ' 43' ' ' ALA . 1.3 tm-20 -73.32 -12.71 60.93 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.987 HD12 HD21 ' A' ' 18' ' ' LEU . 53.9 mt -65.81 -41.08 89.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 179.082 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.2 mp -50.76 -29.47 11.56 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.78 -0.575 . . . . 0.0 110.353 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.45 ' CD ' ' O ' ' A' ' 50' ' ' LYS . 0.1 OUTLIER -111.99 -13.89 13.54 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.778 -1.201 . . . . 0.0 110.675 -179.228 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -100.9 20.49 15.32 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 179.36 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.715 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 0.0 OUTLIER 173.47 155.21 0.11 Allowed 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.84 -1.171 . . . . 0.0 107.84 -179.248 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.715 ' HB3' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.492 1.654 0 CA-C-O 117.943 -1.027 . . . . 0.0 109.252 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 17.8 m . . . . . 0 N--CA 1.49 1.525 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.669 HD13 ' O ' ' A' ' 2' ' ' ILE . 0.0 OUTLIER -109.82 24.02 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.294 -0.879 . . . . 0.0 109.525 -179.833 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.429 ' OD1' ' NE2' ' A' ' 4' ' ' GLN . 35.5 p30 -90.36 29.37 1.28 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.095 -1.003 . . . . 0.0 108.661 179.105 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.429 ' NE2' ' OD1' ' A' ' 3' ' ' ASP . 1.2 mp0 -99.88 53.4 0.92 Allowed 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.508 -0.745 . . . . 0.0 109.946 -179.446 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.631 ' O ' ' CB ' ' A' ' 6' ' ' LEU . 27.3 p-90 -114.49 -133.25 0.34 Allowed 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 179.286 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.631 ' CB ' ' O ' ' A' ' 5' ' ' TRP . 17.8 tp 101.11 -14.21 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.536 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 1.006 HD22 ' O ' ' A' ' 36' ' ' LYS . 5.1 tp 74.88 -68.75 0.2 Allowed 'General case' 0 N--CA 1.499 1.981 0 CA-C-O 120.944 0.402 . . . . 0.0 110.459 179.319 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.493 ' HB3' ' HD3' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -56.25 -12.84 1.75 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.889 -1.132 . . . . 0.0 110.13 179.806 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.9 p-10 -56.97 -41.2 77.93 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 120.991 -1.068 . . . . 0.0 110.032 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.76 ' HB3' HG11 ' A' ' 41' ' ' VAL . . . -80.22 -9.54 59.73 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.218 -0.926 . . . . 0.0 110.401 -179.213 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.493 ' HD3' ' HB3' ' A' ' 8' ' ' LYS . 36.4 mtpt -45.26 -69.89 0.12 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.118 -0.989 . . . . 0.0 110.152 -179.44 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -90.79 -20.67 22.09 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.05 -1.031 . . . . 0.0 110.322 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.82 -30.86 71.8 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 120.911 -1.118 . . . . 0.0 109.426 -179.836 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.549 ' O ' ' CD2' ' A' ' 18' ' ' LEU . . . -93.77 -49.04 6.03 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.685 -0.858 . . . . 0.0 108.685 179.458 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.863 HG23 ' CE1' ' A' ' 29' ' ' PHE . 70.0 mt -53.65 -27.32 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 CA-C-O 121.547 0.689 . . . . 0.0 110.65 179.929 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.4 -3.05 1.21 Allowed 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.444 -0.785 . . . . 0.0 111.351 -178.39 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -122.31 -3.6 8.94 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 120.683 -1.261 . . . . 0.0 110.201 -179.514 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.808 ' N ' HD22 ' A' ' 18' ' ' LEU . 2.5 mm? -99.71 -38.53 8.66 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.036 -1.04 . . . . 0.0 109.562 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.7 tptp -50.91 -45.07 60.24 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.245 -0.909 . . . . 0.0 109.148 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.93 -31.27 72.1 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.232 -0.917 . . . . 0.0 109.548 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.97 -48.86 79.98 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.254 -0.904 . . . . 0.0 109.52 -179.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.532 ' O ' HG23 ' A' ' 24' ' ' THR . . . 136.29 -22.25 3.4 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.294 -1.522 . . . . 0.0 109.294 -179.81 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.582 HD13 HG21 ' A' ' 48' ' ' ILE . 53.9 mt -66.57 122.5 17.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.336 -1.097 . . . . 0.0 109.301 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.532 HG23 ' O ' ' A' ' 22' ' ' GLY . 13.7 p -128.99 1.38 5.29 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.192 -0.942 . . . . 0.0 109.845 -179.686 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.421 ' C ' ' O ' ' A' ' 24' ' ' THR . 18.3 t -44.22 161.2 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.178 -0.951 . . . . 0.0 108.958 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.528 ' O ' ' CB ' ' A' ' 30' ' ' ASN . 3.6 p30 -99.6 -10.89 21.48 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.129 -0.982 . . . . 0.0 109.573 -179.834 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.608 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 18.4 t80 -81.01 -6.38 58.72 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.029 -1.045 . . . . 0.0 109.611 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.832 ' CD1' HD11 ' A' ' 48' ' ' ILE . 23.1 m-85 -110.97 -37.11 5.47 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.205 -0.934 . . . . 0.0 108.494 179.446 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.863 ' CE1' HG23 ' A' ' 15' ' ' ILE . 3.5 m-85 -85.39 -43.53 13.57 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 179.175 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.61 ' O ' ' ND2' ' A' ' 33' ' ' ASN . 48.3 t30 -69.87 -57.87 4.55 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.4 -0.813 . . . . 0.0 108.955 179.636 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.5 -16.29 23.35 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.437 -0.79 . . . . 0.0 109.203 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.539 HG21 HD11 ' A' ' 15' ' ' ILE . 0.4 OUTLIER -54.15 -39.38 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.34 -0.85 . . . . 0.0 108.814 179.924 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.61 ' ND2' ' O ' ' A' ' 30' ' ' ASN . 14.4 p30 -75.77 -35.03 60.26 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.274 -0.891 . . . . 0.0 109.094 179.618 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.448 ' O ' ' C ' ' A' ' 35' ' ' ALA . 0.7 OUTLIER -55.41 -25.2 34.51 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.377 -0.827 . . . . 0.0 109.501 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.706 ' HB2' HD12 ' A' ' 44' ' ' LEU . . . -40.12 155.96 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.667 -0.646 . . . . 0.0 109.914 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 1.006 ' O ' HD22 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -86.39 -70.85 0.58 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.318 -0.864 . . . . 0.0 109.535 -179.976 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.654 ' O ' HG23 ' A' ' 41' ' ' VAL . 0.6 OUTLIER -108.55 -179.94 4.02 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.159 -0.963 . . . . 0.0 109.138 179.758 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 27.8 t -59.3 -37.77 70.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.23 -0.918 . . . . 0.0 109.234 179.864 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.655 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 43.4 mt-10 -63.51 -28.48 69.98 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 121.281 -0.887 . . . . 0.0 108.747 179.378 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.502 ' OE1' ' N ' ' A' ' 40' ' ' GLU . 1.1 mp0 -79.49 -31.27 42.26 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 179.131 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.76 HG11 ' HB3' ' A' ' 10' ' ' ALA . 12.7 t -67.21 -66.67 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.343 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 178.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 32.4 m120 -55.46 -35.29 65.32 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 179.182 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.655 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -62.05 -35.82 79.78 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.283 -0.885 . . . . 0.0 109.164 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.706 HD12 ' HB2' ' A' ' 35' ' ' ALA . 3.7 mt -59.44 -52.15 66.85 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.433 -0.792 . . . . 0.0 110.314 -179.758 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.524 ' HA ' HD13 ' A' ' 48' ' ' ILE . 43.0 mmtt -64.39 -25.67 68.13 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.106 -0.997 . . . . 0.0 109.998 -179.119 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.4 m-20 -76.46 -18.07 58.98 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.054 -1.029 . . . . 0.0 109.621 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.534 ' O ' ' CB ' ' A' ' 51' ' ' ALA . 0.0 OUTLIER -90.18 -12.79 37.1 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.186 -0.946 . . . . 0.0 109.294 179.76 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.832 HD11 ' CD1' ' A' ' 28' ' ' TYR . 1.2 mp -73.3 -35.38 46.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 179.529 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 5.7 tp -61.82 -24.03 66.62 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.074 -1.016 . . . . 0.0 110.081 -179.793 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 26.1 mttt -121.76 -1.72 9.42 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.818 -1.176 . . . . 0.0 110.076 -179.822 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.534 ' CB ' ' O ' ' A' ' 47' ' ' GLU . . . -101.11 -28.11 12.88 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.111 -0.993 . . . . 0.0 109.886 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.549 ' CE1' ' CD1' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -131.96 -0.03 3.82 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.094 -1.004 . . . . 0.0 109.87 -179.334 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.656 0 CA-C-O 118.027 -0.987 . . . . 0.0 109.572 179.769 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' THR . . . . . 0.506 ' O ' ' CG2' ' A' ' 2' ' ' ILE . 1.8 t . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 121.247 0.546 . . . . 0.0 109.73 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.53 ' CG1' ' O ' ' A' ' 2' ' ' ILE . 0.3 OUTLIER 39.9 34.4 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 CA-C-O 121.601 0.715 . . . . 0.0 109.787 179.786 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 63.1 m-20 -91.49 21.1 4.79 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 178.796 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -100.46 76.61 1.86 Allowed 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.744 -0.598 . . . . 0.0 109.517 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.528 ' CE3' ' N ' ' A' ' 6' ' ' LEU . 0.7 OUTLIER -97.27 -38.51 9.65 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.225 -0.922 . . . . 0.0 109.294 179.8 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.528 ' N ' ' CE3' ' A' ' 5' ' ' TRP . 4.6 mp 61.92 86.46 0.11 Allowed 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.35 -0.844 . . . . 0.0 109.805 179.812 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 1.014 HD21 ' CG2' ' A' ' 41' ' ' VAL . 14.0 tp -85.16 47.11 1.36 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.368 -0.832 . . . . 0.0 108.945 179.612 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.664 ' HA ' ' HB2' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -94.66 -15.09 24.25 Favored 'General case' 0 C--N 1.304 -1.388 0 O-C-N 121.217 -0.927 . . . . 0.0 109.66 -179.748 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.44 ' C ' ' O ' ' A' ' 8' ' ' LYS . 0.4 OUTLIER -38.02 -91.36 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.732 -0.605 . . . . 0.0 110.632 -179.758 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.54 ' HA ' ' HB2' ' A' ' 13' ' ' ASP . . . -69.8 0.2 6.1 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.177 -0.952 . . . . 0.0 110.818 -179.085 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.664 ' HB2' ' HA ' ' A' ' 8' ' ' LYS . 0.1 OUTLIER -44.63 -74.05 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.464 0 O-C-N 120.819 -1.176 . . . . 0.0 110.571 -179.712 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.49 ' HA ' ' HB ' ' A' ' 15' ' ' ILE . 76.0 mt-10 -75.76 -5.77 47.38 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.962 -1.086 . . . . 0.0 110.307 -179.103 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.54 ' HB2' ' HA ' ' A' ' 10' ' ' ALA . 1.0 OUTLIER -70.37 -44.82 67.3 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.208 -0.933 . . . . 0.0 109.333 179.8 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.408 ' CB ' ' HD3' ' A' ' 45' ' ' LYS . . . -87.25 -31.7 20.12 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.329 -0.857 . . . . 0.0 109.284 179.686 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.922 HG23 ' CE1' ' A' ' 29' ' ' PHE . 31.4 mt -62.39 -28.84 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 CA-C-O 121.917 0.865 . . . . 0.0 109.051 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.29 -10.96 12.53 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.808 -0.557 . . . . 0.0 110.145 -179.087 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -101.27 -18.66 16.01 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.299 -0.876 . . . . 0.0 109.526 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.59 ' HG ' ' CE ' ' A' ' 45' ' ' LYS . 4.2 mm? -90.02 -56.07 3.37 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.278 -0.889 . . . . 0.0 109.824 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.6 tttp -49.5 -29.59 6.96 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.4 -0.813 . . . . 0.0 109.908 -179.288 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.0 tttp -86.7 -29.53 22.36 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.1 -1.0 . . . . 0.0 109.715 -179.801 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.23 -33.99 75.41 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.27 -0.894 . . . . 0.0 109.713 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.721 ' O ' HG23 ' A' ' 24' ' ' THR . . . 131.04 -45.15 1.15 Allowed Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.414 -1.475 . . . . 0.0 109.414 -179.854 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.476 HD13 ' CG2' ' A' ' 48' ' ' ILE . 66.0 mt -45.62 136.6 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.272 -1.134 . . . . 0.0 109.517 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.721 HG23 ' O ' ' A' ' 22' ' ' GLY . 64.1 p -137.74 25.22 2.84 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.249 -0.907 . . . . 0.0 109.457 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 9.8 t -65.11 156.63 30.96 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.281 -0.887 . . . . 0.0 109.329 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.48 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 68.7 m-20 -96.45 -6.98 36.03 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.223 -0.923 . . . . 0.0 109.597 -179.871 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.528 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 8.6 t80 -81.83 -19.27 41.43 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 120.971 -1.081 . . . . 0.0 109.013 179.625 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.629 ' CD2' HG12 ' A' ' 48' ' ' ILE . 22.2 m-30 -97.16 -11.82 23.84 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.39 -0.819 . . . . 0.0 109.615 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.922 ' CE1' HG23 ' A' ' 15' ' ' ILE . 9.8 m-85 -112.55 -49.96 2.92 Favored 'General case' 0 C--N 1.297 -1.697 0 O-C-N 121.296 -0.877 . . . . 0.0 109.45 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.48 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 8.5 t30 -62.19 -40.55 96.43 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.581 -0.699 . . . . 0.0 109.285 179.501 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.16 -1.2 43.64 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.39 -0.819 . . . . 0.0 109.886 -179.686 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.646 ' HA ' HD21 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -76.45 -55.93 9.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.108 -0.995 . . . . 0.0 109.611 -179.659 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.597 ' N ' HG22 ' A' ' 32' ' ' ILE . 6.8 t-20 -69.24 -6.42 29.07 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.136 -0.977 . . . . 0.0 109.193 179.77 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.48 ' O ' ' O ' ' A' ' 35' ' ' ALA . 4.2 mttt -103.38 -20.63 14.01 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.255 -0.903 . . . . 0.0 109.636 -179.838 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.515 ' HB3' HG22 ' A' ' 41' ' ' VAL . . . -40.29 164.09 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.747 0 CA-C-O 121.625 0.726 . . . . 0.0 110.175 -179.568 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.6 mttp -51.4 -78.93 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.336 -0.852 . . . . 0.0 110.165 -179.629 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.873 HG21 ' OE2' ' A' ' 39' ' ' GLU . 4.8 t -128.76 -154.09 0.61 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.186 -0.946 . . . . 0.0 109.724 -179.555 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.665 ' N ' HG23 ' A' ' 37' ' ' THR . 12.3 t -75.79 -53.9 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 O-C-N 121.119 -0.988 . . . . 0.0 109.845 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.873 ' OE2' HG21 ' A' ' 37' ' ' THR . 1.3 pt-20 -55.36 -22.6 20.21 Favored 'General case' 0 C--N 1.296 -1.732 0 O-C-N 121.007 -1.058 . . . . 0.0 108.575 179.542 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.459 ' O ' ' HB3' ' A' ' 44' ' ' LEU . 20.0 tp10 -84.9 -32.82 22.94 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.881 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 1.014 ' CG2' HD21 ' A' ' 7' ' ' LEU . 53.9 t -66.62 -59.96 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.432 ' O ' ' OD1' ' A' ' 46' ' ' ASN . 10.3 m120 -58.75 -34.93 71.95 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.474 -0.766 . . . . 0.0 109.735 179.574 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.85 -26.64 61.54 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.156 -0.965 . . . . 0.0 109.631 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.712 ' O ' HD12 ' A' ' 44' ' ' LEU . 0.3 OUTLIER -75.83 -30.15 58.86 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.139 -0.976 . . . . 0.0 108.464 179.502 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.59 ' CE ' ' HG ' ' A' ' 18' ' ' LEU . 0.0 OUTLIER -64.62 -26.21 68.3 Favored 'General case' 0 N--CA 1.487 1.408 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.369 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASN . . . . . 0.432 ' OD1' ' O ' ' A' ' 42' ' ' ASN . 23.1 m120 -80.18 -15.86 56.11 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.554 -0.716 . . . . 0.0 109.813 -179.657 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -83.01 -7.61 59.65 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.201 -0.937 . . . . 0.0 109.82 -179.837 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.629 HG12 ' CD2' ' A' ' 28' ' ' TYR . 2.4 mp -74.82 -46.67 40.46 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 O-C-N 120.966 -1.084 . . . . 0.0 108.586 179.348 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.2 mp -54.09 -40.12 66.97 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.311 -0.868 . . . . 0.0 109.105 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.6 tmtt? -80.4 -73.14 0.38 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.162 -0.962 . . . . 0.0 108.548 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.463 ' O ' ' HB3' ' A' ' 52' ' ' HIS . . . -55.88 161.46 2.23 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.075 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.625 ' CG ' ' O ' ' A' ' 52' ' ' HIS . 1.0 OUTLIER 64.73 10.46 6.04 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 120.911 -1.118 . . . . 0.0 108.964 179.674 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.453 0 O-C-N 120.963 -1.086 . . . . 0.0 109.455 179.722 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.669 HD13 ' O ' ' A' ' 2' ' ' ILE . 0.3 OUTLIER -106.7 12.95 8.43 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.26 -0.9 . . . . 0.0 109.343 -179.91 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 19.3 p-10 -60.34 -16.99 40.04 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.16 -0.962 . . . . 0.0 109.054 179.829 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.493 ' O ' ' C ' ' A' ' 5' ' ' TRP . 0.2 OUTLIER -57.18 -33.63 67.67 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.363 -0.835 . . . . 0.0 109.421 179.997 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.523 ' O ' ' N ' ' A' ' 7' ' ' LEU . 22.2 t90 -32.96 -88.17 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.741 -0.599 . . . . 0.0 110.578 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.471 ' O ' ' HB3' ' A' ' 7' ' ' LEU . 0.5 OUTLIER 36.59 28.53 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.383 -0.823 . . . . 0.0 111.039 179.841 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.833 HD21 ' CG2' ' A' ' 41' ' ' VAL . 0.4 OUTLIER 61.71 99.01 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.009 -1.057 . . . . 0.0 110.079 179.45 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.497 ' HD3' ' CD ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -151.58 58.57 0.88 Allowed 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.5 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.666 ' OD1' HG22 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -126.85 -49.01 1.49 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.399 -0.813 . . . . 0.0 109.619 -178.974 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.654 ' HB3' HG11 ' A' ' 41' ' ' VAL . . . -80.78 0.82 33.09 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.262 -0.899 . . . . 0.0 109.617 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.497 ' CD ' ' HD3' ' A' ' 8' ' ' LYS . 5.4 mtpm? -62.52 -88.01 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.171 -0.956 . . . . 0.0 109.969 -179.463 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.431 ' O ' ' HB2' ' A' ' 16' ' ' ALA . 4.7 tt0 -57.83 -17.15 14.32 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.159 -0.963 . . . . 0.0 110.077 -179.3 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.457 ' HB2' ' HA ' ' A' ' 10' ' ' ALA . 61.8 m-20 -59.94 -73.61 0.09 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.097 -1.002 . . . . 0.0 109.475 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.545 ' O ' HD12 ' A' ' 18' ' ' LEU . . . -68.47 -42.36 78.84 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.228 -0.92 . . . . 0.0 109.461 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.748 HG23 ' CE1' ' A' ' 29' ' ' PHE . 10.6 mt -49.86 -30.82 6.33 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.524 0 O-C-N 121.206 -0.934 . . . . 0.0 109.033 179.796 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.431 ' HB2' ' O ' ' A' ' 12' ' ' GLU . . . -66.4 -38.74 88.17 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.633 -0.667 . . . . 0.0 110.582 -178.43 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.3 tp10 -76.21 -25.0 54.67 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.179 -0.951 . . . . 0.0 110.763 -178.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.581 HD13 ' HB3' ' A' ' 45' ' ' LYS . 0.9 OUTLIER -88.69 -30.21 19.29 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 120.929 -1.107 . . . . 0.0 110.37 -178.945 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.6 -29.67 68.14 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.305 -0.872 . . . . 0.0 109.504 -179.516 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -86.29 -26.37 24.98 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.335 -0.853 . . . . 0.0 109.211 179.844 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.31 -30.57 69.59 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.236 -0.915 . . . . 0.0 109.316 179.786 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 121.19 -28.99 5.88 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.779 -1.328 . . . . 0.0 109.779 179.781 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.596 ' CD1' ' CE1' ' A' ' 52' ' ' HIS . 26.8 mt -48.87 110.51 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.153 -1.204 . . . . 0.0 109.485 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -105.99 -7.12 18.28 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.213 -0.929 . . . . 0.0 109.4 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -48.12 118.62 2.47 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.25 -0.906 . . . . 0.0 109.182 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.505 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 0.3 OUTLIER -80.05 6.45 11.46 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.336 -0.853 . . . . 0.0 109.644 -179.868 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.442 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 20.4 t80 -78.85 -22.58 45.89 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.107 -0.996 . . . . 0.0 109.462 -179.802 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.863 ' CE2' HG23 ' A' ' 48' ' ' ILE . 22.6 m-85 -94.75 -45.2 7.44 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.179 -0.95 . . . . 0.0 108.821 179.464 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.748 ' CE1' HG23 ' A' ' 15' ' ' ILE . 14.4 m-85 -61.03 -50.95 71.26 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 179.08 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.505 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 1.9 t30 -60.34 -31.32 70.2 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.419 -0.801 . . . . 0.0 108.901 179.615 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.04 -22.08 53.52 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.453 -0.779 . . . . 0.0 109.682 -179.751 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.714 HD11 ' HG2' ' A' ' 45' ' ' LYS . 0.8 OUTLIER -68.28 -34.09 64.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.212 -0.93 . . . . 0.0 108.837 179.914 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -75.91 -4.54 41.49 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.213 -0.929 . . . . 0.0 109.021 179.366 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.448 ' O ' ' C ' ' A' ' 35' ' ' ALA . 6.5 mmmt -108.83 -17.78 13.85 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.212 -0.93 . . . . 0.0 109.531 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.538 ' HB2' HD12 ' A' ' 44' ' ' LEU . . . -38.45 154.82 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.71 -0.619 . . . . 0.0 110.127 -179.711 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.465 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -87.74 -73.09 0.49 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.295 -0.878 . . . . 0.0 109.954 -179.791 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.668 ' O ' HG23 ' A' ' 41' ' ' VAL . 0.8 OUTLIER -105.89 -177.38 3.35 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.152 -0.968 . . . . 0.0 109.365 -179.741 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.666 HG22 ' OD1' ' A' ' 9' ' ' ASN . 92.4 t -67.44 -30.05 47.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.134 -0.979 . . . . 0.0 109.028 179.649 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.56 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 3.0 pt-20 -71.33 -25.29 62.34 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 178.254 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.532 ' N ' ' HG3' ' A' ' 39' ' ' GLU . 4.5 mm-40 -80.97 -30.74 35.05 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 178.592 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.833 ' CG2' HD21 ' A' ' 7' ' ' LEU . 48.7 t -67.41 -61.16 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 179.038 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 58.1 m-80 -62.05 -29.4 70.27 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.589 -0.695 . . . . 0.0 109.306 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.56 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -71.17 -29.4 65.15 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.259 -0.901 . . . . 0.0 109.497 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.538 HD12 ' HB2' ' A' ' 35' ' ' ALA . 7.4 mt -75.1 -47.94 26.23 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.117 -0.989 . . . . 0.0 110.947 -179.228 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.714 ' HG2' HD11 ' A' ' 32' ' ' ILE . 0.3 OUTLIER -75.29 -43.45 51.09 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.861 -1.15 . . . . 0.0 110.081 -178.888 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -68.32 -21.08 64.77 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.029 -1.045 . . . . 0.0 109.436 179.782 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.481 ' HG2' ' HB2' ' A' ' 51' ' ' ALA . 14.6 tt0 -79.79 -7.11 58.47 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.176 -0.952 . . . . 0.0 109.674 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.863 HG23 ' CE2' ' A' ' 28' ' ' TYR . 83.3 mt -68.95 -41.67 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 178.729 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.414 ' HA ' HD23 ' A' ' 49' ' ' LEU . 12.7 mt -47.32 -32.33 4.66 Favored 'General case' 0 C--N 1.302 -1.472 0 C-N-CA 119.688 -0.805 . . . . 0.0 109.435 179.613 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.7 mttm -115.66 -3.61 12.28 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.977 -1.077 . . . . 0.0 110.177 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.481 ' HB2' ' HG2' ' A' ' 47' ' ' GLU . . . -100.58 -2.55 32.58 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.126 -0.984 . . . . 0.0 109.218 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.708 ' ND1' HG22 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -160.89 -164.97 1.28 Allowed 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.343 -0.848 . . . . 0.0 108.957 -179.614 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.604 ' N ' ' CG ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.49 1.542 0 O-C-N 121.11 -0.994 . . . . 0.0 109.277 -179.731 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' THR . . . . . 0.66 ' O ' HG23 ' A' ' 1' ' ' THR . 10.6 t . . . . . 0 N--CA 1.492 1.626 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.483 ' O ' HG13 ' A' ' 2' ' ' ILE . 1.1 tp -88.26 50.32 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.317 -0.864 . . . . 0.0 109.499 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -76.61 0.24 20.88 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.082 -1.011 . . . . 0.0 108.822 178.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -81.07 10.15 5.65 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.392 -0.817 . . . . 0.0 109.621 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.516 ' O ' ' N ' ' A' ' 7' ' ' LEU . 1.7 t90 -50.96 -46.38 61.13 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 121.223 -0.923 . . . . 0.0 111.28 -179.668 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.583 ' O ' ' CB ' ' A' ' 7' ' ' LEU . 46.6 mt -38.88 -25.8 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.318 -0.864 . . . . 0.0 110.998 -178.631 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 1.016 HD21 HG21 ' A' ' 41' ' ' VAL . 1.0 OUTLIER 85.66 -134.72 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.665 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 -179.835 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.45 ' H ' HD22 ' A' ' 7' ' ' LEU . 6.1 mtpt 53.23 17.59 1.04 Allowed 'General case' 0 N--CA 1.488 1.451 0 O-C-N 120.522 -1.361 . . . . 0.0 109.298 -179.103 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.624 HD22 HG13 ' A' ' 38' ' ' VAL . 7.2 p-10 -95.85 -48.18 5.84 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 179.153 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.424 ' N ' ' CG ' ' A' ' 9' ' ' ASN . . . -81.56 -11.82 59.01 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 178.041 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.547 ' O ' HD12 ' A' ' 15' ' ' ILE . 1.3 ttpt -43.82 -64.22 0.7 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.459 -0.776 . . . . 0.0 110.926 -179.424 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -95.95 -22.83 17.16 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.895 -1.128 . . . . 0.0 111.18 -178.428 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -61.28 -28.78 69.43 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.794 -1.191 . . . . 0.0 109.876 -179.469 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.615 ' O ' HD23 ' A' ' 18' ' ' LEU . . . -96.65 -43.62 7.48 Favored 'General case' 0 C--N 1.301 -1.5 0 O-C-N 121.096 -1.003 . . . . 0.0 108.853 179.549 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.641 HG23 ' CE1' ' A' ' 29' ' ' PHE . 88.0 mt -54.31 -28.72 18.69 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 O-C-N 121.66 -0.65 . . . . 0.0 109.705 179.815 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.483 ' HA ' ' CE ' ' A' ' 19' ' ' LYS . . . -64.06 -37.51 87.71 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.42 -0.8 . . . . 0.0 109.639 -179.03 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.574 ' O ' ' HB2' ' A' ' 21' ' ' ALA . 0.5 OUTLIER -86.86 9.6 18.7 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.386 -0.822 . . . . 0.0 109.913 -179.48 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.615 HD23 ' O ' ' A' ' 14' ' ' ALA . 0.5 OUTLIER -101.04 -47.93 4.59 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.249 -0.907 . . . . 0.0 109.627 -179.766 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.483 ' CE ' ' HA ' ' A' ' 16' ' ' ALA . 2.1 ptpt -59.43 -28.76 67.24 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.457 -0.777 . . . . 0.0 109.345 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.06 -16.79 23.5 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.41 -0.807 . . . . 0.0 108.966 179.664 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ALA . . . . . 0.574 ' HB2' ' O ' ' A' ' 17' ' ' GLU . . . -69.09 -29.92 68.11 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.334 -0.854 . . . . 0.0 109.532 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 126.87 -12.76 6.85 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.768 -1.333 . . . . 0.0 109.768 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.651 HD12 HG21 ' A' ' 48' ' ' ILE . 0.2 OUTLIER -101.97 123.05 54.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.101 -1.235 . . . . 0.0 109.696 -179.792 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -122.89 28.62 7.16 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.3 -0.875 . . . . 0.0 108.986 179.468 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.98 177.81 2.48 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.363 -0.836 . . . . 0.0 109.64 -179.748 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.476 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 9.0 m-20 -122.22 0.78 9.62 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.26 -0.9 . . . . 0.0 109.659 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.591 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 2.3 t80 -81.15 -40.41 24.02 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.159 -0.963 . . . . 0.0 109.569 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.605 ' CE2' HG23 ' A' ' 48' ' ' ILE . 21.5 m-85 -78.34 -31.05 48.42 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.351 -0.843 . . . . 0.0 110.198 -179.008 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.641 ' CE1' HG23 ' A' ' 15' ' ' ILE . 6.7 m-30 -75.53 -49.24 19.27 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.282 -0.886 . . . . 0.0 109.924 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.476 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 0.4 OUTLIER -59.37 -25.65 64.42 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.156 -0.965 . . . . 0.0 110.175 -179.504 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -87.15 -16.18 36.19 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.97 -1.081 . . . . 0.0 110.44 -179.029 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 1.036 HD11 ' HD2' ' A' ' 45' ' ' LYS . 0.6 OUTLIER -64.8 -38.16 82.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.096 -1.002 . . . . 0.0 109.873 -179.596 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 45.9 p-10 -79.74 -8.65 59.37 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.023 -1.048 . . . . 0.0 110.348 -179.238 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.437 ' O ' ' C ' ' A' ' 35' ' ' ALA . 3.5 mtmt -99.64 -17.16 17.93 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.962 -1.086 . . . . 0.0 109.976 -179.821 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.737 ' HB3' HG22 ' A' ' 41' ' ' VAL . . . -43.14 154.54 0.07 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.23 -0.919 . . . . 0.0 109.554 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.502 ' HB2' ' HG3' ' A' ' 40' ' ' GLU . 0.1 OUTLIER -73.09 -59.49 2.68 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.077 -1.014 . . . . 0.0 109.634 -179.775 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.859 ' O ' HG23 ' A' ' 41' ' ' VAL . 70.2 p -124.01 -167.0 1.57 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.09 -1.006 . . . . 0.0 109.754 -179.834 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.624 HG13 HD22 ' A' ' 9' ' ' ASN . 16.0 t -66.63 -52.09 49.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.406 -0.809 . . . . 0.0 109.587 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.765 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 11.7 pt-20 -52.36 -26.51 12.55 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 179.597 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.502 ' HG3' ' HB2' ' A' ' 36' ' ' LYS . 27.6 mm-40 -80.45 -35.6 34.7 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.321 -0.862 . . . . 0.0 108.763 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 1.016 HG21 HD21 ' A' ' 7' ' ' LEU . 7.0 t -67.88 -66.88 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 179.051 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -53.85 -28.6 36.9 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.565 -0.709 . . . . 0.0 109.375 179.391 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.765 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -66.88 -46.18 75.77 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.287 -0.883 . . . . 0.0 109.605 -179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.1 mt -57.85 -37.14 73.34 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.244 -0.91 . . . . 0.0 109.985 -179.642 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 1.036 ' HD2' HD11 ' A' ' 32' ' ' ILE . 0.2 OUTLIER -63.4 -34.01 76.79 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.087 -1.008 . . . . 0.0 109.5 -179.847 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 8.4 m-20 -77.77 -30.23 51.31 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.196 -0.94 . . . . 0.0 109.504 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -57.09 -23.33 46.14 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.338 -0.851 . . . . 0.0 109.165 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.651 HG21 HD12 ' A' ' 23' ' ' ILE . 41.4 mt -66.64 -45.7 87.78 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 179.518 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.443 HD12 ' HA ' ' A' ' 49' ' ' LEU . 1.2 mp -48.17 -36.78 14.22 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.178 -0.951 . . . . 0.0 108.558 179.046 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.6 mttt -90.53 -80.78 0.32 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.42 -0.8 . . . . 0.0 108.917 179.396 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.499 ' O ' ' HB3' ' A' ' 52' ' ' HIS . . . -54.81 151.57 8.32 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 178.809 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.557 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 0.2 OUTLIER 64.95 165.7 0.16 Allowed 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.658 -1.276 . . . . 0.0 107.784 -179.276 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.557 ' HB3' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 118.045 -0.979 . . . . 0.0 109.414 -179.559 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 1.5 t . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ILE . . . . . 0.538 ' CG1' ' O ' ' A' ' 2' ' ' ILE . 0.9 OUTLIER -118.24 40.04 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.248 -0.908 . . . . 0.0 109.509 179.921 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -71.24 -5.1 29.49 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.141 -0.974 . . . . 0.0 108.782 179.078 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.49 ' O ' ' O ' ' A' ' 5' ' ' TRP . 2.1 mt-30 -81.08 -31.08 34.55 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.488 -0.758 . . . . 0.0 110.194 -179.661 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.49 ' O ' ' O ' ' A' ' 4' ' ' GLN . 6.3 t90 -46.58 -99.4 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.244 -0.91 . . . . 0.0 110.319 -179.073 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.437 ' C ' ' O ' ' A' ' 5' ' ' TRP . 5.0 mt 43.36 27.53 0.14 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.56 -1.338 . . . . 0.0 109.757 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 1.033 HD21 HG21 ' A' ' 41' ' ' VAL . 0.5 OUTLIER 42.56 59.85 2.6 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.322 -0.861 . . . . 0.0 109.693 -179.917 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -120.59 -3.8 9.82 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.065 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.435 ' ND2' ' CG2' ' A' ' 38' ' ' VAL . 1.6 p30 -59.6 -99.1 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.509 -0.744 . . . . 0.0 110.061 179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.604 ' CB ' HG13 ' A' ' 38' ' ' VAL . . . -55.77 -16.82 4.87 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 120.979 -1.076 . . . . 0.0 109.619 -179.883 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.543 ' HG2' HG21 ' A' ' 32' ' ' ILE . 2.5 tttp -40.85 -35.47 0.51 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.196 -0.94 . . . . 0.0 110.241 -179.734 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -88.07 -32.6 18.65 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.109 -0.994 . . . . 0.0 110.038 -179.51 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.82 -56.23 21.57 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.154 -0.966 . . . . 0.0 109.399 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.461 ' HB1' ' HG2' ' A' ' 45' ' ' LYS . . . -62.68 -55.7 24.47 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.294 -0.879 . . . . 0.0 110.149 -179.774 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.777 ' CG1' HD13 ' A' ' 32' ' ' ILE . 73.0 mt -53.41 -30.85 18.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.151 -0.968 . . . . 0.0 109.48 -179.819 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.29 -38.73 88.44 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.462 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 2.4 pt-20 -83.57 1.88 39.94 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 109.111 -0.699 . . . . 0.0 109.111 179.634 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.702 HD13 ' O ' ' A' ' 18' ' ' LEU . 1.1 tm? -97.86 -53.64 3.34 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.286 -0.884 . . . . 0.0 109.377 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.425 ' O ' ' HG2' ' A' ' 19' ' ' LYS . 5.7 ttmt -56.71 -18.2 11.6 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.32 -0.863 . . . . 0.0 109.294 -179.857 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.4 ttmt -96.16 -26.15 15.57 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.315 -0.865 . . . . 0.0 109.264 179.743 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.33 -49.74 75.18 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.257 -0.902 . . . . 0.0 109.557 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 138.86 -3.57 2.86 Favored Glycine 0 N--CA 1.49 2.236 0 C-N-CA 119.665 -1.255 . . . . 0.0 110.133 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.489 ' CD1' HG21 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -100.18 149.26 6.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 120.867 -1.372 . . . . 0.0 109.574 179.846 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -133.23 11.58 4.19 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.432 -0.792 . . . . 0.0 109.234 179.755 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.34 139.88 58.53 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.234 -0.916 . . . . 0.0 109.447 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.401 ' N ' ' OD1' ' A' ' 26' ' ' ASP . 1.3 m-20 -87.64 6.07 36.45 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.313 -0.867 . . . . 0.0 109.784 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.688 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 8.3 t80 -80.26 -17.23 52.78 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.119 -0.988 . . . . 0.0 109.321 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.826 ' HB3' HD11 ' A' ' 48' ' ' ILE . 18.1 m-85 -101.36 -28.46 12.59 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.226 -0.921 . . . . 0.0 109.12 179.687 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 0.844 ' HA ' HD12 ' A' ' 32' ' ' ILE . 9.5 m-85 -83.07 -47.05 12.08 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.474 -0.766 . . . . 0.0 109.193 179.536 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 40.7 m-20 -60.78 -36.63 79.48 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.479 -0.763 . . . . 0.0 109.406 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.6 -13.7 59.84 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.342 -0.849 . . . . 0.0 109.691 -179.55 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.844 HD12 ' HA ' ' A' ' 29' ' ' PHE . 4.3 mt -68.01 -48.61 73.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.268 -0.895 . . . . 0.0 109.351 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.52 ' HB2' ' CE ' ' A' ' 11' ' ' LYS . 8.4 t30 -64.92 -22.53 67.01 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.218 -0.926 . . . . 0.0 109.624 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.473 ' O ' ' O ' ' A' ' 35' ' ' ALA . 5.7 mptp? -96.54 -14.71 22.07 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.178 -0.951 . . . . 0.0 109.744 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.907 ' HB3' HG22 ' A' ' 41' ' ' VAL . . . -43.61 168.68 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.315 -0.865 . . . . 0.0 109.795 -179.67 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.4 ' HB2' ' HG2' ' A' ' 40' ' ' GLU . 1.7 tttm -77.3 -78.73 0.12 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.211 -0.931 . . . . 0.0 109.582 -179.965 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.961 ' O ' HG23 ' A' ' 41' ' ' VAL . 14.8 t -121.54 -174.34 2.84 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.233 -0.917 . . . . 0.0 108.868 179.787 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.604 HG13 ' CB ' ' A' ' 10' ' ' ALA . 24.9 t -59.79 -57.31 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.105 -0.997 . . . . 0.0 109.436 179.828 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.556 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 73.2 mm-40 -51.37 -19.51 1.36 Allowed 'General case' 0 C--N 1.295 -1.797 0 O-C-N 120.974 -1.079 . . . . 0.0 109.414 -179.639 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.495 ' OE1' ' HA ' ' A' ' 40' ' ' GLU . 4.6 tp10 -90.5 -33.24 16.02 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.924 -1.11 . . . . 0.0 109.181 179.596 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 1.033 HG21 HD21 ' A' ' 7' ' ' LEU . 2.2 t -76.7 -66.27 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.456 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 178.372 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.407 ' OD1' ' C ' ' A' ' 42' ' ' ASN . 0.0 OUTLIER -46.94 -40.73 14.82 Favored 'General case' 0 C--N 1.296 -1.738 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.19 178.317 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.556 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -68.49 -37.37 80.05 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.263 -0.898 . . . . 0.0 109.748 179.884 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.726 ' O ' HD12 ' A' ' 44' ' ' LEU . 0.3 OUTLIER -65.28 -30.56 71.44 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.152 -0.967 . . . . 0.0 109.051 -179.916 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.794 ' CE ' HD11 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -63.39 -43.94 96.13 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.179 -0.95 . . . . 0.0 109.181 179.641 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -75.76 -13.93 60.31 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.426 -0.796 . . . . 0.0 109.537 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -79.7 -28.33 40.64 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.29 -0.881 . . . . 0.0 109.716 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.826 HD11 ' HB3' ' A' ' 28' ' ' TYR . 14.4 mt -56.15 -41.61 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.115 -0.991 . . . . 0.0 108.725 179.429 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.416 ' HA ' HD23 ' A' ' 49' ' ' LEU . 89.7 mt -45.24 -36.1 3.74 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.31 -0.869 . . . . 0.0 109.978 179.722 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.4 mttt -117.68 2.17 12.27 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.985 -1.072 . . . . 0.0 110.789 -179.361 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -100.83 -7.74 23.29 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.98 -1.075 . . . . 0.0 109.503 179.79 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.555 ' HB3' ' OH ' ' A' ' 28' ' ' TYR . 0.5 OUTLIER -145.13 8.74 1.23 Allowed 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.153 -0.967 . . . . 0.0 110.232 -178.822 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.522 0 CA-C-O 117.95 -1.024 . . . . 0.0 109.449 -179.94 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 14.8 t . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 121.301 0.572 . . . . 0.0 109.548 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -103.64 48.91 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.366 0 O-C-N 121.232 -0.918 . . . . 0.0 109.698 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -67.58 -7.45 26.35 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 178.875 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.426 ' O ' ' O ' ' A' ' 5' ' ' TRP . 5.7 mp0 -54.6 -16.68 2.59 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.405 -0.809 . . . . 0.0 109.658 179.844 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' TRP . . . . . 0.453 ' O ' ' C ' ' A' ' 6' ' ' LEU . 0.0 OUTLIER -64.11 -123.02 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 179.407 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.463 ' O ' ' C ' ' A' ' 7' ' ' LEU . 93.6 mt 39.08 36.84 0.19 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.933 -1.104 . . . . 0.0 110.104 179.221 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.926 HD21 HG21 ' A' ' 41' ' ' VAL . 4.8 tt -38.42 115.94 0.5 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.579 -0.701 . . . . 0.0 109.87 -179.752 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.542 ' CG ' ' O ' ' A' ' 7' ' ' LEU . 10.6 mttp -168.07 -34.01 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.488 -0.758 . . . . 0.0 109.481 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.457 ' C ' ' O ' ' A' ' 8' ' ' LYS . 0.7 OUTLIER -36.08 -93.48 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.555 -0.715 . . . . 0.0 110.995 -179.969 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.459 ' O ' ' C ' ' A' ' 11' ' ' LYS . . . -54.93 -13.2 1.01 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.181 -0.949 . . . . 0.0 111.037 -179.076 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.743 ' O ' HD12 ' A' ' 15' ' ' ILE . 0.0 OUTLIER -36.9 -43.01 0.42 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.231 -0.918 . . . . 0.0 110.982 -179.407 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -100.63 -21.07 15.37 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.888 -1.132 . . . . 0.0 110.28 -179.407 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -69.21 -15.95 63.5 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.044 -1.035 . . . . 0.0 109.454 -179.705 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -105.75 -40.61 5.68 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.346 -0.846 . . . . 0.0 108.927 179.575 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 1.125 HG23 ' CZ ' ' A' ' 29' ' ' PHE . 55.2 mt -62.81 -28.6 45.27 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 O-C-N 121.494 -0.754 . . . . 0.0 109.17 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.5 -22.67 22.1 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.404 -0.81 . . . . 0.0 109.675 -179.466 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -85.26 -28.06 25.6 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.377 -0.827 . . . . 0.0 110.343 -179.617 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.524 ' CD1' ' HE2' ' A' ' 45' ' ' LYS . 2.2 mt -84.25 -32.33 24.51 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.14 -0.975 . . . . 0.0 110.693 -178.964 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -56.5 -21.64 27.36 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 120.97 -1.081 . . . . 0.0 109.736 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 6.5 tttm -100.9 -29.46 12.2 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.21 -0.931 . . . . 0.0 110.038 -179.715 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -69.14 -33.32 73.25 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.136 -0.978 . . . . 0.0 109.741 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 124.81 -26.58 5.62 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.356 -1.497 . . . . 0.0 109.356 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.552 HG12 ' CE1' ' A' ' 52' ' ' HIS . 62.0 mt -66.2 106.44 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.368 -1.077 . . . . 0.0 109.393 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 9.6 p -128.99 17.67 6.15 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.085 -1.009 . . . . 0.0 109.56 -179.83 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 65.6 m -65.62 152.63 43.69 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.255 -0.903 . . . . 0.0 109.242 179.807 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.458 ' O ' ' CB ' ' A' ' 30' ' ' ASN . 7.9 m-20 -87.21 -3.08 59.03 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.189 -0.944 . . . . 0.0 109.787 -179.765 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.722 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 18.0 t80 -80.08 -7.5 58.91 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.155 -0.966 . . . . 0.0 109.269 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.915 ' O ' HD13 ' A' ' 32' ' ' ILE . 37.8 m-85 -118.49 -34.78 3.92 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 179.308 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' PHE . . . . . 1.125 ' CZ ' HG23 ' A' ' 15' ' ' ILE . 6.1 m-30 -78.58 -40.9 33.37 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 178.838 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.458 ' CB ' ' O ' ' A' ' 26' ' ' ASP . 19.8 t30 -68.62 -49.61 57.87 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.465 -0.772 . . . . 0.0 108.966 179.527 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ALA . . . . . 0.407 ' HA ' ' HB2' ' A' ' 34' ' ' LYS . . . -69.06 -12.85 62.06 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.495 -0.753 . . . . 0.0 109.603 -179.702 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ILE . . . . . 0.915 HD13 ' O ' ' A' ' 28' ' ' TYR . 0.7 OUTLIER -73.7 -50.52 29.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.262 -0.899 . . . . 0.0 108.961 179.839 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASN . . . . . 0.53 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 17.2 p30 -79.7 -10.93 59.86 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.242 -0.911 . . . . 0.0 109.366 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.479 ' O ' ' O ' ' A' ' 35' ' ' ALA . 7.8 mmtt -91.29 -14.83 30.13 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.344 -0.848 . . . . 0.0 109.654 -179.686 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.479 ' O ' ' O ' ' A' ' 34' ' ' LYS . . . -55.09 -160.74 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.527 -0.733 . . . . 0.0 110.198 -179.517 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.682 ' C ' HD12 ' A' ' 7' ' ' LEU . 27.8 mmtp -101.79 -62.87 1.2 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.103 -0.998 . . . . 0.0 110.401 -179.293 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.508 ' O ' HG23 ' A' ' 41' ' ' VAL . 66.6 p -125.86 178.02 5.97 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.945 -1.097 . . . . 0.0 110.082 -179.415 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.446 HG13 ' HB3' ' A' ' 10' ' ' ALA . 88.6 t -61.39 -34.46 61.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.331 -0.856 . . . . 0.0 109.331 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.13 -27.39 69.05 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 178.891 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.441 ' HG2' ' HB1' ' A' ' 35' ' ' ALA . 0.9 OUTLIER -79.58 -31.27 41.83 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.662 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.926 HG21 HD21 ' A' ' 7' ' ' LEU . 18.6 t -68.32 -67.53 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 178.796 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -49.56 -39.37 34.61 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.429 -0.794 . . . . 0.0 109.468 179.496 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.9 -38.96 93.01 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.294 -0.879 . . . . 0.0 109.619 -179.671 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.424 ' O ' HD12 ' A' ' 48' ' ' ILE . 7.6 mt -66.85 -46.61 74.54 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.282 -0.887 . . . . 0.0 110.258 -179.531 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.652 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.2 OUTLIER -65.61 -19.65 66.0 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.037 -1.04 . . . . 0.0 110.23 -179.243 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -79.84 -18.23 51.29 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.054 -1.029 . . . . 0.0 109.566 -179.757 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.539 ' O ' ' CB ' ' A' ' 51' ' ' ALA . 55.7 tt0 -90.76 -17.74 26.14 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.186 -0.946 . . . . 0.0 109.172 179.669 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.677 ' CG1' ' CD1' ' A' ' 28' ' ' TYR . 1.4 mt -68.6 -35.43 70.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.252 -0.905 . . . . 0.0 108.91 179.478 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 49' ' ' LEU . 14.5 tp -56.4 -30.05 62.29 Favored 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.162 -0.961 . . . . 0.0 109.324 179.646 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.419 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -122.28 5.87 9.68 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.197 -0.939 . . . . 0.0 109.889 -179.894 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ALA . . . . . 0.539 ' CB ' ' O ' ' A' ' 47' ' ' GLU . . . -101.39 -46.62 4.95 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.092 -1.005 . . . . 0.0 109.466 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.6 ' HB3' ' OH ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -112.66 -19.5 12.03 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.447 -0.783 . . . . 0.0 109.661 -178.975 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.486 ' N ' ' CD2' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.489 1.512 0 CA-C-O 118.012 -0.994 . . . . 0.0 109.42 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.8 p30 . . . . . 0 N--CA 1.493 1.686 0 CA-C-O 121.012 0.434 . . . . 0.0 109.87 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.455 ' HB3' HG21 ' A' ' 41' ' ' VAL . . . -80.43 -15.37 56.95 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.1 -1.0 . . . . 0.0 109.501 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.608 ' O ' HD12 ' A' ' 15' ' ' ILE . 0.1 OUTLIER -63.44 -32.6 74.09 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.271 -0.893 . . . . 0.0 109.91 -179.44 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.474 ' HG2' ' CE ' ' A' ' 11' ' ' LYS . 3.8 mm-40 -92.36 -44.12 8.88 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.865 -1.147 . . . . 0.0 109.627 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -65.94 -18.71 65.52 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.132 -0.98 . . . . 0.0 109.696 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.53 ' HB1' HD11 ' A' ' 18' ' ' LEU . . . -99.0 -43.83 6.54 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.313 -0.867 . . . . 0.0 109.262 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.608 HD12 ' O ' ' A' ' 11' ' ' LYS . 58.6 mt -62.83 -29.04 46.14 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.529 0 O-C-N 121.491 -0.756 . . . . 0.0 109.371 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.04 -15.55 63.65 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.499 -0.75 . . . . 0.0 110.342 -178.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 32.7 tt0 -116.98 -14.41 10.62 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.074 -1.016 . . . . 0.0 109.857 -179.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.623 HD22 ' HG2' ' A' ' 45' ' ' LYS . 5.7 mt -90.21 -33.0 16.35 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.111 -0.993 . . . . 0.0 109.459 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.1 ptmm? -56.84 -19.54 17.98 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.14 -0.975 . . . . 0.0 108.702 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -86.95 -31.22 20.76 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.466 -0.771 . . . . 0.0 108.973 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.65 -20.25 7.76 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.387 -0.821 . . . . 0.0 109.389 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 116.14 -39.16 2.8 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.42 -1.472 . . . . 0.0 109.42 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.965 HD13 HG21 ' A' ' 48' ' ' ILE . 13.0 mt -54.03 107.89 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.224 -1.162 . . . . 0.0 109.332 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -115.2 7.51 15.32 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.259 -0.901 . . . . 0.0 109.629 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.3 t -59.95 152.98 22.29 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.15 -0.969 . . . . 0.0 109.265 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.498 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 9.4 p-10 -100.46 -9.13 22.45 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.238 -0.914 . . . . 0.0 109.578 -179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.538 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 15.1 t80 -74.83 -24.45 58.61 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.078 -1.014 . . . . 0.0 109.583 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.639 ' CG ' ' CG1' ' A' ' 48' ' ' ILE . 23.6 m-85 -94.95 -42.39 8.68 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.217 -0.927 . . . . 0.0 109.171 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.579 ' CD1' HG12 ' A' ' 15' ' ' ILE . 5.3 m-85 -62.81 -45.87 90.59 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 121.54 -0.725 . . . . 0.0 109.734 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.498 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 0.4 OUTLIER -65.78 -39.55 91.1 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.13 -0.981 . . . . 0.0 109.626 -179.844 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.6 -10.73 60.21 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.206 -0.934 . . . . 0.0 109.519 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.541 HD11 ' CD ' ' A' ' 45' ' ' LYS . 0.3 OUTLIER -65.94 -24.36 33.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.399 -0.813 . . . . 0.0 109.071 -179.869 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.8 m-20 -80.51 -37.61 31.31 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.315 -0.865 . . . . 0.0 109.764 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -57.88 -20.44 36.8 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.259 -0.901 . . . . 0.0 109.438 -179.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.72 ' HB3' HG22 ' A' ' 41' ' ' VAL . . . -47.13 155.93 0.26 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.248 -0.908 . . . . 0.0 109.343 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.494 ' CD ' ' N ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -90.94 -55.3 3.61 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.323 -0.861 . . . . 0.0 109.382 -179.967 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.625 HG23 ' H ' ' A' ' 39' ' ' GLU . 13.7 t -125.02 -175.79 3.39 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.244 -0.91 . . . . 0.0 109.466 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 95.9 t -63.21 -30.32 49.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.049 -1.032 . . . . 0.0 109.267 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.807 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 1.9 tt0 -72.14 -21.7 61.42 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 179.456 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.591 ' HG2' HG22 ' A' ' 37' ' ' THR . 37.6 mm-40 -86.48 -31.09 21.52 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.39 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.72 HG22 ' HB3' ' A' ' 35' ' ' ALA . 24.5 t -72.72 -56.68 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 179.108 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 65.8 m-20 -62.86 -27.93 69.68 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 178.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.807 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -66.87 -46.74 74.01 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.485 -0.76 . . . . 0.0 109.448 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.706 ' O ' HD12 ' A' ' 48' ' ' ILE . 2.1 mt -59.2 -35.15 73.1 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.233 -0.917 . . . . 0.0 108.87 179.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.714 ' HA ' HD13 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -62.0 -40.48 95.8 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.321 -0.862 . . . . 0.0 108.973 179.494 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.481 ' O ' ' HB2' ' A' ' 49' ' ' LEU . 75.1 m-20 -65.9 -20.69 66.31 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.315 -0.865 . . . . 0.0 109.04 179.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.07 -36.31 61.77 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.298 -0.876 . . . . 0.0 109.659 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.965 HG21 HD13 ' A' ' 23' ' ' ILE . 3.7 mp -58.47 -27.41 33.39 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 O-C-N 120.959 -1.088 . . . . 0.0 108.376 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.481 ' HB2' ' O ' ' A' ' 46' ' ' ASN . 2.5 mm? -56.07 -39.0 71.42 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.435 -0.79 . . . . 0.0 109.072 179.189 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.429 ' O ' ' C ' ' A' ' 51' ' ' ALA . 0.0 OUTLIER -109.63 -62.24 1.53 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.212 -0.93 . . . . 0.0 109.818 -179.401 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.429 ' C ' ' O ' ' A' ' 50' ' ' LYS . . . -41.23 -37.81 1.01 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.295 -0.878 . . . . 0.0 109.966 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.713 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 0.0 OUTLIER -115.62 129.07 56.37 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.349 -0.845 . . . . 0.0 109.083 -179.547 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.713 ' HB3' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 118.068 -0.968 . . . . 0.0 109.307 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.809 ' ND2' HG22 ' A' ' 38' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.547 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.51 -6.92 58.92 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 178.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.418 ' HE2' ' CG ' ' A' ' 33' ' ' ASN . 13.6 tttm -61.31 -35.71 78.11 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 121.614 -0.678 . . . . 0.0 109.985 -179.666 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -89.25 -51.3 5.64 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.05 -1.031 . . . . 0.0 109.115 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -53.97 -21.72 8.72 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.566 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -89.51 -59.16 2.28 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 121.558 -0.714 . . . . 0.0 109.14 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.497 ' HA ' ' HG ' ' A' ' 18' ' ' LEU . 0.2 OUTLIER -41.09 -36.98 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 O-C-N 121.52 -0.737 . . . . 0.0 109.392 179.978 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.22 -48.68 77.26 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.587 ' C ' HD23 ' A' ' 18' ' ' LEU . 3.7 mm-40 -73.27 -12.68 60.94 Favored 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.834 -0.541 . . . . 0.0 110.79 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.838 HD23 ' N ' ' A' ' 18' ' ' LEU . 1.0 OUTLIER -88.43 -32.56 18.24 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.637 -1.29 . . . . 0.0 109.694 -179.307 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.29 -17.11 62.48 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.185 -0.947 . . . . 0.0 109.339 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.431 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 1.0 OUTLIER -96.55 -22.36 17.12 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.232 -0.918 . . . . 0.0 109.548 -179.873 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.17 -26.68 66.77 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.218 -0.926 . . . . 0.0 109.411 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 112.66 -23.78 14.52 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.48 HD12 ' NZ ' ' A' ' 45' ' ' LYS . 31.7 mt -75.09 92.57 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.288 -1.125 . . . . 0.0 109.735 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.1 p -95.66 5.5 51.28 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.126 -0.984 . . . . 0.0 109.127 179.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.7 t -57.18 138.34 54.75 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.318 -0.864 . . . . 0.0 109.025 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.472 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 5.0 m-20 -91.78 -5.77 52.93 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.218 -0.927 . . . . 0.0 109.816 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.653 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 2.1 t80 -74.09 -16.27 61.03 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.129 -0.982 . . . . 0.0 108.591 179.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.989 ' CE2' HG23 ' A' ' 48' ' ' ILE . 21.7 m-85 -103.99 -50.15 3.45 Favored 'General case' 0 C--N 1.298 -1.667 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 179.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.65 ' CZ ' ' CB ' ' A' ' 18' ' ' LEU . 3.1 m-85 -55.89 -45.35 78.64 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.472 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 8.3 m120 -60.82 -43.97 97.51 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.251 -0.906 . . . . 0.0 109.091 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.67 -13.75 61.04 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.441 -0.787 . . . . 0.0 109.626 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.605 ' HA ' HD13 ' A' ' 44' ' ' LEU . 4.5 mt -71.15 -40.32 74.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.297 -0.877 . . . . 0.0 108.898 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.418 ' CG ' ' HE2' ' A' ' 11' ' ' LYS . 0.9 OUTLIER -76.5 -19.62 57.8 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.205 -0.934 . . . . 0.0 109.317 179.787 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.462 ' O ' ' O ' ' A' ' 35' ' ' ALA . 2.5 mtpt -75.33 -15.66 60.47 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.391 -0.818 . . . . 0.0 109.61 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.851 ' HB1' ' HB3' ' A' ' 40' ' ' GLU . . . -40.39 162.64 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.461 -0.774 . . . . 0.0 109.882 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.402 ' O ' HG23 ' A' ' 37' ' ' THR . 3.4 tttm -101.89 -19.86 15.1 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.424 -0.797 . . . . 0.0 109.021 179.66 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.81 ' O ' HG23 ' A' ' 41' ' ' VAL . 11.2 p -153.2 -179.76 8.0 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.446 -0.784 . . . . 0.0 109.04 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.809 HG22 ' ND2' ' A' ' 9' ' ' ASN . 18.7 t -65.04 -38.48 82.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.1 -1.0 . . . . 0.0 108.912 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.714 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 29.2 mt-10 -64.68 -28.49 69.64 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.254 -0.904 . . . . 0.0 108.782 179.332 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.851 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 0.3 OUTLIER -79.48 -31.18 42.29 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 179.485 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.81 HG23 ' O ' ' A' ' 37' ' ' THR . 12.5 t -70.49 -65.26 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 178.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -55.7 -33.34 64.11 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.596 -0.69 . . . . 0.0 109.34 179.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.714 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -61.2 -42.25 98.26 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.321 -0.862 . . . . 0.0 109.242 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.605 HD13 ' HA ' ' A' ' 32' ' ' ILE . 0.4 OUTLIER -57.74 -50.18 74.08 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.225 -0.922 . . . . 0.0 110.04 -179.62 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.736 ' CE ' HD22 ' A' ' 18' ' ' LEU . 10.4 tptp -50.02 -29.67 9.16 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.041 -1.037 . . . . 0.0 110.499 -179.367 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 36.5 m-20 -80.02 -46.79 15.98 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.026 -1.046 . . . . 0.0 110.21 -179.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -54.52 -28.4 45.04 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.086 -1.009 . . . . 0.0 110.01 -179.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.989 HG23 ' CE2' ' A' ' 28' ' ' TYR . 21.1 mt -60.37 -44.38 95.88 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 O-C-N 121.016 -1.052 . . . . 0.0 109.237 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.908 ' HA ' ' HB3' ' A' ' 53' ' ' ALA . 1.0 OUTLIER -56.23 -19.06 12.27 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.536 -0.727 . . . . 0.0 110.449 -179.411 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.1 -58.41 1.89 Allowed 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.801 -1.187 . . . . 0.0 110.774 -179.102 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.497 ' O ' ' CB ' ' A' ' 52' ' ' HIS . . . -82.67 46.45 1.08 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.315 -0.865 . . . . 0.0 110.293 -179.014 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.543 ' CG ' ' N ' ' A' ' 53' ' ' ALA . 3.7 t-80 170.22 -81.83 0.0 OUTLIER 'General case' 0 C--N 1.302 -1.488 0 O-C-N 120.83 -1.169 . . . . 0.0 109.476 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.908 ' HB3' ' HA ' ' A' ' 49' ' ' LEU . . . . . . . . 0 N--CA 1.489 1.524 0 CA-C-O 118.01 -0.995 . . . . 0.0 109.456 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.746 HD21 HG22 ' A' ' 38' ' ' VAL . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.615 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.561 ' HB3' HG11 ' A' ' 41' ' ' VAL . . . -79.67 4.59 15.64 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.302 -0.874 . . . . 0.0 109.212 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.532 ' O ' ' CG1' ' A' ' 15' ' ' ILE . 0.5 OUTLIER -52.44 -91.81 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.252 -0.905 . . . . 0.0 110.546 -179.407 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -67.26 -22.93 65.65 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.999 -1.063 . . . . 0.0 111.06 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -62.07 -63.51 1.23 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.763 -1.21 . . . . 0.0 109.508 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.526 ' HB1' ' HZ2' ' A' ' 45' ' ' LYS . . . -73.25 -47.97 38.69 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.179 -0.95 . . . . 0.0 109.12 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.991 HG23 ' CE1' ' A' ' 29' ' ' PHE . 70.5 mt -47.1 -30.47 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.491 -0.756 . . . . 0.0 109.756 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.47 -52.21 59.09 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.468 -0.77 . . . . 0.0 109.856 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -49.9 -32.15 13.89 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.246 -0.909 . . . . 0.0 110.123 -179.679 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.627 HD12 ' N ' ' A' ' 18' ' ' LEU . 10.0 mp -90.37 -24.94 20.66 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.43 -0.794 . . . . 0.0 110.263 -178.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.2 tttt -64.03 -22.3 66.87 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.339 -0.85 . . . . 0.0 110.02 -179.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.42 -13.21 41.03 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.204 -0.935 . . . . 0.0 109.625 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -81.66 -4.12 55.32 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.225 -0.922 . . . . 0.0 109.589 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.06 -41.8 2.2 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.802 -1.319 . . . . 0.0 109.802 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.73 HG21 HG21 ' A' ' 48' ' ' ILE . 59.7 mt -47.04 117.55 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.163 -1.198 . . . . 0.0 109.666 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.73 17.91 5.2 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.306 -0.872 . . . . 0.0 109.508 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.427 ' HB3' ' CD2' ' A' ' 28' ' ' TYR . 3.0 t -54.97 127.67 29.94 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.108 -0.995 . . . . 0.0 109.038 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.558 ' O ' ' CB ' ' A' ' 30' ' ' ASN . 17.4 p-10 -72.15 -13.39 61.54 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.187 -0.946 . . . . 0.0 109.878 -179.394 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.531 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 18.9 t80 -81.44 -3.2 52.24 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 120.479 -1.388 . . . . 0.0 108.901 179.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.906 ' CD2' HG23 ' A' ' 48' ' ' ILE . 21.4 m-30 -111.48 -29.88 7.6 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.991 ' CE1' HG23 ' A' ' 15' ' ' ILE . 3.9 m-30 -103.23 -43.75 5.37 Favored 'General case' 0 C--N 1.295 -1.763 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.558 ' CB ' ' O ' ' A' ' 26' ' ' ASP . 3.1 t-20 -68.33 -26.94 65.86 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 108.45 -0.945 . . . . 0.0 108.45 179.127 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -88.55 4.43 46.85 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.53 -0.731 . . . . 0.0 109.68 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.919 HD12 HG13 ' A' ' 41' ' ' VAL . 0.7 OUTLIER -84.73 -20.79 8.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.169 -0.957 . . . . 0.0 109.104 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.513 ' HB2' ' CE ' ' A' ' 11' ' ' LYS . 0.7 OUTLIER -76.5 -23.48 53.74 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.127 -0.983 . . . . 0.0 109.004 179.387 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.453 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.4 OUTLIER -80.21 -18.44 49.53 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.396 -0.815 . . . . 0.0 109.313 179.716 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.453 ' O ' ' O ' ' A' ' 34' ' ' LYS . . . -44.54 168.99 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.342 -0.849 . . . . 0.0 109.807 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 45.0 mttp -106.27 -69.85 0.81 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.425 -0.797 . . . . 0.0 109.248 179.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 8.8 t -108.38 179.0 4.33 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.277 -0.889 . . . . 0.0 108.877 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.746 HG22 HD21 ' A' ' 9' ' ' ASN . 25.5 t -59.35 -44.92 93.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 O-C-N 120.956 -1.09 . . . . 0.0 108.942 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.705 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 0.5 OUTLIER -56.32 -27.01 54.32 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 179.449 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -78.89 -33.74 45.38 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 179.069 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.919 HG13 HD12 ' A' ' 32' ' ' ILE . 90.7 t -71.09 -73.4 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.389 0 N-CA-C 107.937 -1.135 . . . . 0.0 107.937 178.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.677 ' ND2' HG12 ' A' ' 38' ' ' VAL . 76.2 m-20 -44.26 -28.19 0.5 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.553 -0.717 . . . . 0.0 109.328 179.15 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.705 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -68.55 -52.78 28.18 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.155 -0.966 . . . . 0.0 109.291 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.1 mt -60.12 -34.79 74.0 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.369 -0.832 . . . . 0.0 110.295 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.625 ' HE3' ' CA ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -77.17 -27.25 53.68 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.063 -1.023 . . . . 0.0 109.271 -179.777 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -80.47 -22.42 41.06 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.266 -0.897 . . . . 0.0 108.84 179.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.734 ' O ' ' HB3' ' A' ' 51' ' ' ALA . 0.6 OUTLIER -78.18 1.31 21.8 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.466 -0.771 . . . . 0.0 109.037 179.456 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.906 HG23 ' CD2' ' A' ' 28' ' ' TYR . 42.2 mt -80.6 -46.66 21.24 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 O-C-N 121.176 -0.953 . . . . 0.0 108.783 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.54 -30.18 68.43 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.652 -0.655 . . . . 0.0 109.944 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.7 mmtt -100.06 -62.61 1.22 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.108 -0.995 . . . . 0.0 109.751 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.734 ' HB3' ' O ' ' A' ' 47' ' ' GLU . . . -51.05 -21.68 1.97 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.214 -0.929 . . . . 0.0 109.031 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.684 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 1.4 t-80 -148.72 170.94 17.05 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 -179.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.684 ' HB3' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 118.044 -0.979 . . . . 0.0 109.445 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.824 HD21 HG22 ' A' ' 38' ' ' VAL . 5.8 p30 . . . . . 0 N--CA 1.486 1.336 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.852 ' O ' ' HB3' ' A' ' 14' ' ' ALA . . . -81.02 -14.19 58.14 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.422 -0.799 . . . . 0.0 108.949 179.099 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.898 ' HA ' HG21 ' A' ' 32' ' ' ILE . 0.7 OUTLIER -48.36 -68.22 0.2 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.045 -1.034 . . . . 0.0 109.863 -179.823 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -98.9 -23.12 15.46 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.993 -1.067 . . . . 0.0 109.804 -179.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.501 ' CB ' ' O ' ' A' ' 9' ' ' ASN . 4.1 t0 -75.7 -19.21 59.28 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.162 -0.961 . . . . 0.0 109.02 179.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.852 ' HB3' ' O ' ' A' ' 10' ' ' ALA . . . -102.27 -44.31 5.45 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.64 HD12 ' O ' ' A' ' 11' ' ' LYS . 59.6 mt -54.99 -29.08 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 121.381 -0.824 . . . . 0.0 109.066 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.64 -37.09 84.98 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.502 -0.749 . . . . 0.0 109.364 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -88.22 -16.18 33.95 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.459 -0.776 . . . . 0.0 110.291 -179.41 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.731 HD22 ' CD ' ' A' ' 45' ' ' LYS . 47.6 mt -83.66 -32.32 25.69 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.041 -1.037 . . . . 0.0 109.745 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.4 mtmt -65.06 -35.58 81.6 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.056 -1.027 . . . . 0.0 109.319 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.08 -10.51 56.79 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.419 -0.8 . . . . 0.0 109.248 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.14 -42.49 98.64 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.254 -0.904 . . . . 0.0 109.261 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 141.74 -13.58 2.67 Favored Glycine 0 N--CA 1.491 2.353 0 N-CA-C 109.67 -1.372 . . . . 0.0 109.67 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.824 HD13 HG21 ' A' ' 48' ' ' ILE . 3.5 mt -105.53 146.39 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.108 -1.23 . . . . 0.0 109.85 -179.713 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.1 p -135.38 15.49 3.45 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 179.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.5 m -59.43 -168.51 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.424 -0.797 . . . . 0.0 109.475 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.518 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 0.3 OUTLIER -126.37 -16.05 5.5 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.222 -0.924 . . . . 0.0 109.862 -179.932 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.638 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 4.2 t80 -80.26 -9.07 59.72 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 120.635 -1.291 . . . . 0.0 109.038 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.696 ' CG ' HG12 ' A' ' 48' ' ' ILE . 17.8 m-85 -102.67 -23.97 13.79 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.342 -0.849 . . . . 0.0 108.837 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.486 ' CE2' ' HB2' ' A' ' 18' ' ' LEU . 80.3 m-85 -96.47 -51.95 4.15 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-O 121.149 0.5 . . . . 0.0 109.759 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.518 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 0.4 OUTLIER -63.66 -19.3 64.78 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.196 -0.94 . . . . 0.0 109.618 179.857 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -87.82 16.3 5.99 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.239 -0.913 . . . . 0.0 109.086 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.898 HG21 ' HA ' ' A' ' 11' ' ' LYS . 8.6 mm -76.21 -65.77 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 121.547 -0.721 . . . . 0.0 109.373 -179.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -51.28 -26.17 6.91 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.223 -0.923 . . . . 0.0 109.083 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.435 ' O ' ' C ' ' A' ' 35' ' ' ALA . 0.4 OUTLIER -62.3 -44.71 95.89 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.4 -0.812 . . . . 0.0 109.467 179.924 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.697 ' HB3' HG22 ' A' ' 41' ' ' VAL . . . -42.65 146.73 0.34 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.344 -0.847 . . . . 0.0 109.587 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.422 ' HG3' ' OE2' ' A' ' 40' ' ' GLU . 26.8 mttm -69.44 -64.65 0.84 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.272 -0.893 . . . . 0.0 109.825 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.812 ' O ' HG23 ' A' ' 41' ' ' VAL . 1.2 p -118.82 -163.56 0.97 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.121 -0.987 . . . . 0.0 109.48 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.824 HG22 HD21 ' A' ' 9' ' ' ASN . 18.0 t -68.61 -55.36 16.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.251 -0.905 . . . . 0.0 109.741 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.779 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 14.2 pt-20 -50.48 -23.16 2.28 Favored 'General case' 0 C--N 1.295 -1.778 0 O-C-N 121.058 -1.027 . . . . 0.0 108.542 179.592 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.422 ' OE2' ' HG3' ' A' ' 36' ' ' LYS . 1.4 mm-40 -83.1 -38.34 22.6 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.434 -0.791 . . . . 0.0 109.02 179.159 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.812 HG23 ' O ' ' A' ' 37' ' ' THR . 11.7 t -63.54 -58.87 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 179.263 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -62.52 -29.78 70.81 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.362 -0.836 . . . . 0.0 108.893 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.779 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -65.72 -33.41 75.81 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.413 -0.804 . . . . 0.0 109.642 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.72 ' C ' HD12 ' A' ' 44' ' ' LEU . 0.3 OUTLIER -61.07 -39.44 89.87 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.174 -0.954 . . . . 0.0 109.519 -179.752 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.786 ' HE3' HD12 ' A' ' 23' ' ' ILE . 30.5 tptt -66.61 -18.59 65.45 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.127 -0.983 . . . . 0.0 109.475 -179.874 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.464 ' HB2' ' O ' ' A' ' 43' ' ' ALA . 26.0 m-80 -73.41 -40.02 64.6 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.203 -0.936 . . . . 0.0 109.232 179.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.536 ' O ' ' CB ' ' A' ' 51' ' ' ALA . 39.1 mt-10 -62.65 -27.07 68.97 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.273 -0.892 . . . . 0.0 109.308 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.824 HG21 HD13 ' A' ' 23' ' ' ILE . 2.5 mp -70.73 -29.81 39.44 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 179.35 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.427 ' HB2' ' O ' ' A' ' 46' ' ' ASN . 4.5 mp -59.31 -30.39 68.3 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 179.238 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -122.41 5.5 9.63 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.209 -0.932 . . . . 0.0 109.722 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.536 ' CB ' ' O ' ' A' ' 47' ' ' GLU . . . -101.54 -49.54 3.99 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.248 -0.907 . . . . 0.0 109.907 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.507 ' CD2' ' C ' ' A' ' 52' ' ' HIS . 0.0 OUTLIER -106.91 -6.82 17.35 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.314 -0.866 . . . . 0.0 110.161 -178.987 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 118.112 -0.947 . . . . 0.0 109.539 -179.935 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.708 HD21 HG22 ' A' ' 38' ' ' VAL . 6.1 p30 . . . . . 0 N--CA 1.489 1.499 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.613 ' HB3' HG11 ' A' ' 41' ' ' VAL . . . -80.99 -4.51 55.34 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.322 -0.861 . . . . 0.0 109.014 179.199 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.401 ' O ' HG13 ' A' ' 15' ' ' ILE . 0.1 OUTLIER -50.43 -75.99 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.363 -0.836 . . . . 0.0 110.201 -179.572 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -76.92 -18.42 58.3 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.144 -0.972 . . . . 0.0 110.369 -179.2 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.6 -18.28 62.23 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.947 -1.096 . . . . 0.0 109.441 -179.767 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.598 ' HB1' ' HG3' ' A' ' 45' ' ' LYS . . . -106.75 -38.79 6.0 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 179.58 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.755 HG23 ' CE1' ' A' ' 29' ' ' PHE . 35.8 mt -61.9 -28.36 44.14 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 CA-C-O 121.752 0.787 . . . . 0.0 109.263 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.06 -3.06 4.75 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.651 -0.655 . . . . 0.0 110.941 -178.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.526 ' O ' ' CG ' ' A' ' 17' ' ' GLU . 17.0 tt0 -117.56 1.94 12.32 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 120.847 -1.158 . . . . 0.0 109.933 -179.531 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.685 HD12 HD12 ' A' ' 23' ' ' ILE . 3.7 mm? -100.44 -39.68 7.84 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.001 -1.062 . . . . 0.0 110.511 -179.47 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.63 -19.71 64.06 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.018 -1.051 . . . . 0.0 109.942 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.468 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -96.94 -14.8 21.49 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.144 -0.972 . . . . 0.0 109.381 179.892 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -79.81 -39.33 31.02 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.156 -0.965 . . . . 0.0 109.587 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 125.25 14.07 3.39 Favored Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.954 -1.259 . . . . 0.0 109.954 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.736 HG23 ' CE1' ' A' ' 52' ' ' HIS . 34.1 mt -105.03 117.99 51.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.078 -1.248 . . . . 0.0 109.257 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.2 p -113.44 -4.74 13.55 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.233 -0.917 . . . . 0.0 109.938 -179.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -45.97 133.58 8.66 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.101 -0.999 . . . . 0.0 109.149 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.458 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 7.4 p-10 -88.47 -2.84 58.82 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.282 -0.886 . . . . 0.0 109.732 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.472 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 26.1 t80 -76.21 -13.94 60.16 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.166 -0.959 . . . . 0.0 109.243 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.823 ' HB3' HD11 ' A' ' 48' ' ' ILE . 22.3 m-85 -100.6 -45.21 5.59 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.428 -0.795 . . . . 0.0 108.973 179.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.755 ' CE1' HG23 ' A' ' 15' ' ' ILE . 5.5 m-85 -66.84 -44.62 80.58 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.473 -0.767 . . . . 0.0 109.559 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.458 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 14.4 m120 -68.74 -24.66 64.48 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.322 -0.861 . . . . 0.0 110.055 -179.799 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -92.49 -17.27 24.74 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.123 -0.986 . . . . 0.0 110.565 -178.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.511 HD11 ' HG2' ' A' ' 45' ' ' LYS . 0.6 OUTLIER -53.69 -39.05 36.81 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 120.981 -1.074 . . . . 0.0 109.242 -179.853 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -71.17 -38.82 72.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.184 -0.947 . . . . 0.0 109.442 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.418 ' O ' ' C ' ' A' ' 35' ' ' ALA . 16.7 mmtt -52.7 -25.65 11.62 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.287 -0.883 . . . . 0.0 109.408 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.626 ' HB3' HG22 ' A' ' 41' ' ' VAL . . . -41.69 137.12 1.73 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.457 -0.777 . . . . 0.0 109.764 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.5 mtpt -75.85 -64.85 0.99 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.213 -0.93 . . . . 0.0 109.275 179.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.492 HG22 ' OE1' ' A' ' 40' ' ' GLU . 9.0 t -109.71 -178.4 3.53 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.213 -0.929 . . . . 0.0 108.901 179.541 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.708 HG22 HD21 ' A' ' 9' ' ' ASN . 12.1 t -61.25 -46.33 96.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 O-C-N 120.896 -1.127 . . . . 0.0 108.942 179.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.718 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 5.8 mt-10 -53.34 -25.72 16.26 Favored 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 179.07 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.556 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -79.68 -37.14 36.48 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 179.071 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.626 HG22 ' HB3' ' A' ' 35' ' ' ALA . 38.4 t -65.53 -66.12 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.434 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.509 ' ND2' HG12 ' A' ' 38' ' ' VAL . 28.2 m-80 -55.68 -29.41 59.32 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.48 -0.762 . . . . 0.0 109.579 179.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.718 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -67.52 -39.87 85.1 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.216 -0.927 . . . . 0.0 109.622 -179.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.447 HD12 ' HB2' ' A' ' 35' ' ' ALA . 3.6 mt -61.39 -45.51 94.06 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.207 -0.933 . . . . 0.0 109.791 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.598 ' HG3' ' HB1' ' A' ' 14' ' ' ALA . 14.1 mmtm -63.14 -25.86 68.55 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.125 -0.984 . . . . 0.0 109.319 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -80.43 -19.83 45.27 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.283 -0.886 . . . . 0.0 109.743 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -79.51 -16.57 55.79 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.158 -0.964 . . . . 0.0 109.744 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.823 HD11 ' HB3' ' A' ' 28' ' ' TYR . 64.0 mt -71.46 -42.05 73.01 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 O-C-N 120.877 -1.139 . . . . 0.0 108.548 179.525 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 87.4 mt -51.89 -26.41 10.13 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.417 -0.802 . . . . 0.0 109.338 179.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.42 ' O ' ' N ' ' A' ' 52' ' ' HIS . 0.1 OUTLIER -112.31 -71.15 0.77 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.186 -0.946 . . . . 0.0 109.965 -179.89 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -43.58 -25.44 0.16 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.311 -0.868 . . . . 0.0 109.844 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.771 ' CD2' HG22 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -130.32 152.04 50.17 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 121.22 -0.925 . . . . 0.0 108.707 -179.644 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.646 ' HB3' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 118.009 -0.996 . . . . 0.0 109.247 -179.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.487 1.404 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.534 ' HB2' HG13 ' A' ' 38' ' ' VAL . . . -80.95 -18.97 45.25 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 121.291 -0.88 . . . . 0.0 108.863 179.545 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.602 ' O ' HD12 ' A' ' 15' ' ' ILE . 4.7 ptmt -74.88 -14.8 60.71 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.354 -0.842 . . . . 0.0 109.615 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -100.97 -37.84 8.46 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.055 -1.028 . . . . 0.0 109.513 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -74.85 -26.53 59.76 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.247 -0.908 . . . . 0.0 109.684 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.521 ' O ' HD23 ' A' ' 18' ' ' LEU . . . -92.97 -42.58 9.38 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.089 -1.007 . . . . 0.0 109.626 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.602 HD12 ' O ' ' A' ' 11' ' ' LYS . 20.4 mt -63.28 -31.0 51.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 CA-C-O 121.776 0.798 . . . . 0.0 108.999 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.507 ' HA ' ' HD2' ' A' ' 19' ' ' LYS . . . -67.24 -7.0 20.64 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.641 -0.662 . . . . 0.0 110.132 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.444 ' O ' ' CG ' ' A' ' 17' ' ' GLU . 9.4 tp10 -109.27 -5.97 15.69 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.231 -0.918 . . . . 0.0 109.522 -179.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.834 HD12 HD12 ' A' ' 23' ' ' ILE . 4.0 mm? -93.49 -41.01 10.02 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.113 -0.992 . . . . 0.0 109.031 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.507 ' HD2' ' HA ' ' A' ' 16' ' ' ALA . 0.1 OUTLIER -56.42 -23.31 37.59 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.504 -0.747 . . . . 0.0 109.524 -179.942 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.497 ' N ' ' HG2' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -97.64 -20.09 17.87 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.293 -0.879 . . . . 0.0 109.142 179.551 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -75.41 -28.67 59.51 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.259 -0.901 . . . . 0.0 109.575 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 128.36 -45.86 1.12 Allowed Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.26 -1.536 . . . . 0.0 109.26 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.867 HD13 HG21 ' A' ' 48' ' ' ILE . 5.5 mt -45.24 122.83 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.205 -1.173 . . . . 0.0 109.008 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -128.93 10.51 5.95 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.162 -0.961 . . . . 0.0 109.842 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.7 t -66.09 156.41 33.96 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.197 -0.939 . . . . 0.0 109.198 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.49 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 2.7 t70 -103.38 -4.11 24.58 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.103 -0.998 . . . . 0.0 109.825 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.472 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 5.9 t80 -77.57 -18.07 57.27 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.11 -0.993 . . . . 0.0 109.232 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.647 ' CG ' ' CG1' ' A' ' 48' ' ' ILE . 22.5 m-85 -95.46 -41.12 9.13 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.263 -0.898 . . . . 0.0 108.926 179.558 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.594 ' CE1' HG23 ' A' ' 15' ' ' ILE . 9.6 m-30 -71.03 -49.88 40.08 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.434 -0.791 . . . . 0.0 109.465 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.49 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 3.5 t-20 -59.12 -52.37 66.03 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.24 -0.912 . . . . 0.0 109.671 -179.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.16 -22.07 65.58 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.27 -0.894 . . . . 0.0 109.645 -179.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.61 HG23 HG13 ' A' ' 41' ' ' VAL . 1.4 mm -67.64 -53.94 27.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.205 -0.935 . . . . 0.0 109.399 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.524 ' CB ' ' HD2' ' A' ' 11' ' ' LYS . 1.6 p-10 -73.53 -1.96 20.74 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.149 -0.969 . . . . 0.0 109.461 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.483 ' O ' ' O ' ' A' ' 35' ' ' ALA . 7.2 mttt -105.3 -8.86 17.99 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.27 -0.894 . . . . 0.0 109.817 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.735 ' HB1' ' HB3' ' A' ' 40' ' ' GLU . . . -55.2 -158.89 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.531 -0.731 . . . . 0.0 110.088 -179.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 6.7 mttt -110.02 -67.47 0.99 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.128 -0.983 . . . . 0.0 110.087 -179.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.952 ' O ' HG23 ' A' ' 41' ' ' VAL . 0.7 OUTLIER -118.79 -168.5 1.56 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.979 -1.075 . . . . 0.0 109.645 -179.565 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.534 HG13 ' HB2' ' A' ' 10' ' ' ALA . 65.3 t -70.41 -31.6 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.201 -0.937 . . . . 0.0 109.931 -179.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.748 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 1.7 mm-40 -71.01 -26.75 63.26 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 120.945 -1.097 . . . . 0.0 108.139 179.319 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.735 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 0.1 OUTLIER -84.51 -26.7 27.92 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 178.736 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.952 HG23 ' O ' ' A' ' 37' ' ' THR . 53.9 t -73.8 -70.04 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 178.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -50.14 -29.08 8.4 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 178.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.748 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -64.48 -50.66 66.57 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.389 -0.819 . . . . 0.0 108.923 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.786 ' O ' HD12 ' A' ' 48' ' ' ILE . 5.9 mt -61.09 -46.58 90.05 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.314 -0.867 . . . . 0.0 109.922 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.577 ' HA ' HD13 ' A' ' 48' ' ' ILE . 0.2 OUTLIER -56.09 -40.9 74.37 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.118 -0.989 . . . . 0.0 109.805 -179.596 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.1 m-20 -76.43 -18.74 58.67 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.149 -0.97 . . . . 0.0 109.388 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.404 ' O ' ' CB ' ' A' ' 51' ' ' ALA . 8.6 tp10 -73.17 -19.89 61.02 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.259 -0.901 . . . . 0.0 109.407 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.867 HG21 HD13 ' A' ' 23' ' ' ILE . 2.9 mp -68.62 -27.76 37.47 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 179.075 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.503 ' HB2' ' HE2' ' A' ' 50' ' ' LYS . 2.3 mm? -58.24 -38.3 76.59 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.612 -0.68 . . . . 0.0 109.951 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.503 ' HE2' ' HB2' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -114.69 0.16 13.79 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.929 -1.107 . . . . 0.0 110.201 -179.432 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.404 ' CB ' ' O ' ' A' ' 47' ' ' GLU . . . -100.62 -12.17 19.43 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 121.182 -0.949 . . . . 0.0 109.172 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.724 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 0.0 OUTLIER -154.47 -171.61 3.92 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.429 -0.794 . . . . 0.0 108.886 -179.723 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.724 ' HB3' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 117.945 -1.026 . . . . 0.0 109.585 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.431 HD21 HG22 ' A' ' 38' ' ' VAL . 7.4 p30 . . . . . 0 N--CA 1.488 1.427 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.693 ' HB3' HG11 ' A' ' 41' ' ' VAL . . . -80.44 0.11 34.85 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.487 -0.758 . . . . 0.0 109.255 179.397 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.481 ' HG2' HG22 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -51.31 -88.38 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.961 -1.087 . . . . 0.0 109.49 -179.686 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' A' ' 16' ' ' ALA . 19.9 tt0 -67.08 -10.73 53.08 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.064 -1.022 . . . . 0.0 109.907 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.56 -72.31 0.19 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.083 -1.011 . . . . 0.0 109.259 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.563 ' O ' HD23 ' A' ' 18' ' ' LEU . . . -64.16 -35.72 81.72 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.409 -0.807 . . . . 0.0 109.858 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 1.054 HG23 ' CE1' ' A' ' 29' ' ' PHE . 33.8 mt -61.2 -28.55 44.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 CA-C-O 121.774 0.797 . . . . 0.0 109.389 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.435 ' HB2' ' O ' ' A' ' 12' ' ' GLU . . . -66.77 -4.15 8.41 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.823 -0.548 . . . . 0.0 110.893 -178.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.561 ' C ' HD22 ' A' ' 18' ' ' LEU . 12.1 tt0 -116.12 -2.8 12.14 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 120.938 -1.101 . . . . 0.0 109.874 -179.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.613 ' N ' HD22 ' A' ' 18' ' ' LEU . 3.6 mm? -99.59 -40.14 7.95 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.945 -1.097 . . . . 0.0 109.707 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.8 ttpp -53.76 -23.81 13.07 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.225 -0.922 . . . . 0.0 109.601 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.77 -22.39 16.43 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.224 -0.922 . . . . 0.0 109.712 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.02 -7.41 28.88 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.179 -0.951 . . . . 0.0 109.534 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.72 -9.3 58.52 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.256 -1.537 . . . . 0.0 109.256 -179.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.513 ' O ' HG23 ' A' ' 24' ' ' THR . 4.9 mm -69.15 149.05 11.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.302 -1.117 . . . . 0.0 109.583 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.513 HG23 ' O ' ' A' ' 23' ' ' ILE . 1.4 p -155.88 20.13 0.38 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.315 -0.866 . . . . 0.0 109.346 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.0 m -80.17 142.17 34.99 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.361 -0.837 . . . . 0.0 109.428 179.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.489 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 1.8 p30 -88.96 -11.77 43.46 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.309 -0.869 . . . . 0.0 109.561 -179.748 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.511 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 5.8 t80 -75.7 -12.56 60.22 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.208 -0.933 . . . . 0.0 109.121 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.64 ' CG ' ' CG1' ' A' ' 48' ' ' ILE . 24.0 m-85 -100.77 -43.2 6.19 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.33 -0.857 . . . . 0.0 109.204 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 1.054 ' CE1' HG23 ' A' ' 15' ' ' ILE . 5.2 m-85 -71.87 -45.17 62.27 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.503 -0.748 . . . . 0.0 109.765 -179.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.489 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 0.1 OUTLIER -65.27 -33.57 76.3 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.117 -0.989 . . . . 0.0 109.141 179.96 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -75.32 -11.72 60.12 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.38 -0.825 . . . . 0.0 109.184 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.825 HD11 ' HD2' ' A' ' 45' ' ' LYS . 4.3 mm -74.4 -25.2 19.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.343 -0.848 . . . . 0.0 109.367 179.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -80.32 -31.19 38.16 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.185 -0.947 . . . . 0.0 109.252 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.466 ' O ' ' C ' ' A' ' 35' ' ' ALA . 15.6 mtpp -77.12 -17.2 58.82 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.22 -0.925 . . . . 0.0 109.57 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.855 ' CB ' HG22 ' A' ' 41' ' ' VAL . . . -36.97 155.17 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 121.513 0.673 . . . . 0.0 110.497 -179.332 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.8 mmtm -95.6 -66.63 0.9 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.433 -0.792 . . . . 0.0 109.682 -179.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.802 ' O ' HG23 ' A' ' 41' ' ' VAL . 38.2 p -116.44 178.22 4.41 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.149 -0.969 . . . . 0.0 109.198 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.431 HG22 HD21 ' A' ' 9' ' ' ASN . 26.3 t -63.29 -42.96 98.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.192 -0.942 . . . . 0.0 109.46 179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.569 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 4.4 mm-40 -62.51 -23.07 66.75 Favored 'General case' 0 C--N 1.298 -1.661 0 O-C-N 121.219 -0.926 . . . . 0.0 109.035 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.498 ' HB2' ' H ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -85.71 -30.24 23.3 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.32 -0.862 . . . . 0.0 108.992 179.651 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.855 HG22 ' CB ' ' A' ' 35' ' ' ALA . 12.8 t -71.78 -61.58 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.434 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 179.005 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -57.72 -33.14 68.11 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.727 -0.608 . . . . 0.0 109.448 179.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.569 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -69.9 -31.74 69.69 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.323 -0.861 . . . . 0.0 109.753 -179.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.885 ' O ' HD12 ' A' ' 44' ' ' LEU . 0.2 OUTLIER -78.46 -24.75 45.87 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 121.105 -0.997 . . . . 0.0 109.346 -179.828 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.825 ' HD2' HD11 ' A' ' 32' ' ' ILE . 0.2 OUTLIER -80.5 -30.8 37.29 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.115 -0.991 . . . . 0.0 110.242 -179.314 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -79.87 -15.9 56.45 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 120.992 -1.067 . . . . 0.0 109.982 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 5.8 pt-20 -82.83 -6.98 59.68 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.058 -1.026 . . . . 0.0 109.521 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.64 ' CG1' ' CG ' ' A' ' 28' ' ' TYR . 1.6 mp -71.74 -48.42 51.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.473 0 N-CA-C 107.81 -1.182 . . . . 0.0 107.81 178.531 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.437 ' O ' ' C ' ' A' ' 53' ' ' ALA . 1.2 tp -50.2 -20.74 1.1 Allowed 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.297 -0.877 . . . . 0.0 109.793 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.421 ' O ' ' N ' ' A' ' 52' ' ' HIS . 0.0 OUTLIER -105.84 -74.49 0.65 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.991 -1.068 . . . . 0.0 109.877 -179.704 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -43.75 -22.62 0.05 Allowed 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.526 -0.734 . . . . 0.0 111.081 -179.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.521 ' CB ' ' OH ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -126.91 -8.48 6.05 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.935 -1.103 . . . . 0.0 110.578 -178.397 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.437 ' C ' ' O ' ' A' ' 49' ' ' LEU . . . . . . . . 0 N--CA 1.491 1.587 0 O-C-N 120.943 -1.098 . . . . 0.0 109.643 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -81.03 -13.55 58.72 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.096 -1.003 . . . . 0.0 109.194 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.498 ' HE3' ' CG ' ' A' ' 12' ' ' GLU . 0.0 OUTLIER -53.73 -92.26 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.365 -0.834 . . . . 0.0 110.163 -179.289 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.539 ' HA ' ' HB ' ' A' ' 15' ' ' ILE . 26.0 mt-10 -47.04 -23.57 0.5 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.294 -0.879 . . . . 0.0 110.342 -179.109 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -56.35 -52.1 65.83 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.17 -0.956 . . . . 0.0 108.958 179.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 1.03 ' O ' HD13 ' A' ' 18' ' ' LEU . . . -78.14 -47.92 17.1 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.281 -0.887 . . . . 0.0 109.238 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.939 ' HA ' HD22 ' A' ' 18' ' ' LEU . 55.0 mt -46.34 -30.15 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 O-C-N 121.324 -0.86 . . . . 0.0 109.481 -179.801 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.4 -47.25 70.84 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.411 ' O ' ' HB2' ' A' ' 21' ' ' ALA . 11.4 mt-10 -79.32 4.75 14.29 Favored 'General case' 0 C--N 1.296 -1.755 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.271 178.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 1.03 HD13 ' O ' ' A' ' 14' ' ' ALA . 5.2 mp -91.57 -46.78 7.77 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.181 -0.95 . . . . 0.0 110.197 -178.191 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.8 ttpt -58.77 -27.62 65.16 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.054 -1.029 . . . . 0.0 109.179 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.0 tttt -95.01 -14.49 24.29 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.398 -0.813 . . . . 0.0 109.116 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.411 ' HB2' ' O ' ' A' ' 17' ' ' GLU . . . -63.58 -54.73 31.47 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.312 -0.868 . . . . 0.0 109.627 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 151.01 -14.16 0.86 Allowed Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.924 -1.271 . . . . 0.0 109.924 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.74 HD13 HG21 ' A' ' 48' ' ' ILE . 1.2 mt -103.65 161.24 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 120.988 -1.301 . . . . 0.0 109.482 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.4 p -147.81 15.97 1.09 Allowed 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 179.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.72 174.03 0.07 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.366 -0.834 . . . . 0.0 109.429 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.51 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 1.1 m-20 -112.13 -16.02 13.12 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.346 -0.846 . . . . 0.0 109.353 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.582 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 2.8 t80 -81.27 -20.78 40.17 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 120.869 -1.144 . . . . 0.0 108.864 179.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 1.048 ' CE2' HG23 ' A' ' 48' ' ' ILE . 18.8 m-30 -93.16 -4.75 51.58 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.372 -0.83 . . . . 0.0 109.351 179.482 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.687 ' CE2' ' HB3' ' A' ' 18' ' ' LEU . 23.5 m-85 -115.71 -55.64 2.41 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.475 -0.765 . . . . 0.0 109.57 -179.553 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.51 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 1.0 OUTLIER -64.12 -36.34 83.7 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.548 -0.72 . . . . 0.0 109.749 179.74 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.582 ' HB3' ' O ' ' A' ' 27' ' ' PHE . . . -80.88 -0.11 37.63 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.256 -0.903 . . . . 0.0 109.354 -179.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.495 ' CG2' ' HA ' ' A' ' 11' ' ' LYS . 15.6 mm -62.41 -55.55 23.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.445 -0.784 . . . . 0.0 109.606 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.5 p30 -64.26 -23.41 67.29 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.257 -0.902 . . . . 0.0 109.269 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.453 ' HB2' ' O ' ' A' ' 31' ' ' ALA . 0.4 OUTLIER -61.63 -28.28 69.26 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.165 -0.959 . . . . 0.0 109.191 179.615 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.625 ' HB3' HG22 ' A' ' 41' ' ' VAL . . . -41.54 159.04 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.424 -0.798 . . . . 0.0 109.917 -179.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 9.8 mtpt -92.04 -61.84 1.54 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.433 -0.792 . . . . 0.0 109.413 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.469 ' OG1' ' N ' ' A' ' 38' ' ' VAL . 0.4 OUTLIER -117.06 178.47 4.34 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.575 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.469 ' N ' ' OG1' ' A' ' 37' ' ' THR . 96.4 t -56.78 -52.98 47.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.094 -1.004 . . . . 0.0 109.143 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.744 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 10.6 pt-20 -48.42 -27.98 2.97 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.352 -0.843 . . . . 0.0 108.934 179.521 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.422 ' HB2' ' O ' ' A' ' 37' ' ' THR . 19.7 mm-40 -79.1 -39.17 34.41 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.329 -0.857 . . . . 0.0 108.852 179.582 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.625 HG22 ' HB3' ' A' ' 35' ' ' ALA . 21.6 t -64.27 -64.62 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 178.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -55.16 -36.19 65.57 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.432 -0.793 . . . . 0.0 109.204 179.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.744 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -59.03 -39.73 82.83 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.381 -0.824 . . . . 0.0 109.08 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.448 HD23 ' HA ' ' A' ' 44' ' ' LEU . 8.5 mt -53.07 -44.55 67.57 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.337 -0.852 . . . . 0.0 109.831 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.846 ' HD3' HD11 ' A' ' 18' ' ' LEU . 4.7 tptp -62.74 -45.34 93.17 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.043 -1.036 . . . . 0.0 109.752 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.452 ' OD1' ' HA ' ' A' ' 43' ' ' ALA . 1.9 m120 -66.49 -19.96 65.92 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.421 -0.799 . . . . 0.0 109.755 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.901 ' O ' ' HB3' ' A' ' 51' ' ' ALA . 0.0 OUTLIER -86.67 11.93 11.81 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.163 -0.961 . . . . 0.0 109.326 179.797 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 1.048 HG23 ' CE2' ' A' ' 28' ' ' TYR . 11.8 mm -96.55 -51.99 9.88 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.566 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 178.532 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.429 HD23 ' N ' ' A' ' 49' ' ' LEU . 7.8 mt -52.96 -22.97 6.29 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 121.357 -0.839 . . . . 0.0 108.883 178.601 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.4 mmpt? -107.68 -45.83 3.94 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.132 -0.98 . . . . 0.0 109.532 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.901 ' HB3' ' O ' ' A' ' 47' ' ' GLU . . . -92.02 44.22 1.16 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.223 -0.923 . . . . 0.0 109.429 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.72 ' CG ' HG22 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -178.2 -27.86 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.191 -0.943 . . . . 0.0 109.979 179.865 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.601 ' HB2' ' CD2' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.49 1.569 0 O-C-N 120.999 -1.063 . . . . 0.0 109.505 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.743 HD21 HG22 ' A' ' 38' ' ' VAL . 2.4 p30 . . . . . 0 N--CA 1.493 1.724 0 CA-C-O 120.93 0.395 . . . . 0.0 110.257 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.485 ' O ' ' C ' ' A' ' 11' ' ' LYS . . . -80.83 -31.64 35.46 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.878 -1.139 . . . . 0.0 110.115 -179.571 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.693 ' O ' HD12 ' A' ' 15' ' ' ILE . 0.0 OUTLIER -33.29 -55.88 0.41 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.533 -0.73 . . . . 0.0 111.609 -179.138 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -74.67 -50.97 15.67 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 120.868 -1.145 . . . . 0.0 111.893 -177.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -47.76 -56.97 6.18 Favored 'General case' 0 C--N 1.299 -1.626 0 O-C-N 120.555 -1.341 . . . . 0.0 110.142 -178.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.432 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . -69.62 -58.28 4.13 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.147 -0.971 . . . . 0.0 110.621 -179.358 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.693 HD12 ' O ' ' A' ' 11' ' ' LYS . 65.5 mt -42.02 -30.64 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.041 -1.037 . . . . 0.0 109.607 -179.448 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.7 -51.56 40.34 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.419 -0.801 . . . . 0.0 109.438 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.44 ' O ' ' CG ' ' A' ' 17' ' ' GLU . 19.9 tt0 -70.24 -5.52 28.2 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.393 -0.817 . . . . 0.0 109.405 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.768 HD13 ' O ' ' A' ' 18' ' ' LEU . 1.3 tm? -93.68 -39.8 10.59 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.39 -0.819 . . . . 0.0 109.751 -179.56 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.5 ' HD3' HG22 ' A' ' 24' ' ' THR . 0.4 OUTLIER -67.59 -23.07 65.34 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.298 -0.877 . . . . 0.0 109.733 -179.463 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.19 -26.07 16.13 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.142 -0.974 . . . . 0.0 109.381 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.26 -37.2 54.71 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.271 -0.893 . . . . 0.0 109.297 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 130.2 11.11 2.59 Favored Glycine 0 N--CA 1.491 2.305 0 C-N-CA 119.939 -1.124 . . . . 0.0 110.393 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.967 HG21 ' CE1' ' A' ' 52' ' ' HIS . 0.0 OUTLIER -127.18 154.71 37.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 120.928 -1.337 . . . . 0.0 109.708 179.813 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.5 HG22 ' HD3' ' A' ' 19' ' ' LYS . 18.0 p -140.42 19.63 2.39 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.381 -0.824 . . . . 0.0 109.021 179.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.1 t -58.01 124.28 18.78 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.377 -0.827 . . . . 0.0 109.717 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -80.06 -1.87 41.85 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.239 -0.913 . . . . 0.0 109.405 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -73.69 -33.61 64.49 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.37 -0.831 . . . . 0.0 109.275 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.959 ' CE2' HG23 ' A' ' 48' ' ' ILE . 21.9 m-85 -80.59 -44.98 18.09 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.328 -0.857 . . . . 0.0 109.414 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.627 ' CD1' HG12 ' A' ' 15' ' ' ILE . 18.3 m-30 -62.8 -53.34 55.8 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.315 -0.866 . . . . 0.0 109.859 -179.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.428 ' O ' ' OD1' ' A' ' 33' ' ' ASN . 12.0 t-20 -54.54 -41.83 70.2 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.153 -0.967 . . . . 0.0 109.044 179.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.73 -25.22 63.74 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.498 -0.751 . . . . 0.0 109.451 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.853 HG23 HG13 ' A' ' 41' ' ' VAL . 5.3 mt -64.43 -46.2 93.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.268 -0.895 . . . . 0.0 109.344 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.428 ' OD1' ' O ' ' A' ' 30' ' ' ASN . 1.2 p-10 -71.87 -10.47 59.81 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.03 -1.044 . . . . 0.0 109.066 179.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.405 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -96.97 -20.7 17.9 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.294 -0.879 . . . . 0.0 109.363 179.938 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.958 ' HB1' ' HB3' ' A' ' 40' ' ' GLU . . . -46.75 169.66 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.28 -0.887 . . . . 0.0 109.458 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.7 mtmt -84.82 -58.91 2.52 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.218 -0.926 . . . . 0.0 109.281 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.652 HG22 ' OE2' ' A' ' 40' ' ' GLU . 15.1 t -131.2 -174.16 3.31 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.254 -0.904 . . . . 0.0 109.297 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.743 HG22 HD21 ' A' ' 9' ' ' ASN . 54.9 t -60.71 -39.99 83.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.064 -1.022 . . . . 0.0 109.256 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.564 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 3.5 mt-10 -56.2 -28.76 59.46 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 179.159 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.958 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 0.4 OUTLIER -79.62 -31.41 41.64 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 179.037 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.853 HG13 HG23 ' A' ' 32' ' ' ILE . 16.3 t -66.73 -68.05 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 178.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 45.7 m-20 -53.16 -33.92 54.63 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.616 -0.678 . . . . 0.0 109.635 179.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.564 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -67.39 -34.95 78.33 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.339 -0.851 . . . . 0.0 110.31 -179.267 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 12.4 mt -76.95 -38.81 52.59 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.029 -1.044 . . . . 0.0 110.065 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.81 ' HG3' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -61.28 -29.57 69.94 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.169 -0.957 . . . . 0.0 109.943 -179.521 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 24.1 m-20 -71.24 -25.56 62.53 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.188 -0.945 . . . . 0.0 109.287 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.588 ' O ' ' HB3' ' A' ' 51' ' ' ALA . 2.8 tt0 -83.43 9.04 12.03 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.233 -0.917 . . . . 0.0 109.04 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.959 HG23 ' CE2' ' A' ' 28' ' ' TYR . 43.9 mt -88.34 -43.18 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 179.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.404 ' HA ' HD23 ' A' ' 49' ' ' LEU . 0.8 OUTLIER -69.94 -10.93 60.29 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.594 -0.692 . . . . 0.0 110.401 -179.89 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -120.38 -31.55 4.32 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.695 -1.253 . . . . 0.0 110.835 -179.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.588 ' HB3' ' O ' ' A' ' 47' ' ' GLU . . . -79.56 -20.07 47.91 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.881 -1.137 . . . . 0.0 110.617 -179.058 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.967 ' CE1' HG21 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -125.83 -16.79 5.58 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.955 -1.091 . . . . 0.0 109.9 -179.474 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.533 0 O-C-N 121.037 -1.039 . . . . 0.0 109.371 179.595 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.552 ' ND2' ' N ' ' A' ' 9' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.689 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.57 ' O ' ' HB3' ' A' ' 14' ' ' ALA . . . -70.68 -3.65 19.57 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.252 -0.905 . . . . 0.0 109.405 179.426 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.75 ' HD2' HG22 ' A' ' 32' ' ' ILE . 0.7 OUTLIER -54.47 -53.28 56.43 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.064 -1.022 . . . . 0.0 109.94 -179.823 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -88.83 -42.1 12.08 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.049 -1.032 . . . . 0.0 109.626 -179.648 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.91 -16.26 28.21 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.018 -1.051 . . . . 0.0 108.747 179.44 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.57 ' HB3' ' O ' ' A' ' 10' ' ' ALA . . . -102.99 -41.46 6.11 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.355 -0.84 . . . . 0.0 108.866 179.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.575 ' CG1' ' CD1' ' A' ' 32' ' ' ILE . 22.7 mt -52.88 -33.61 19.31 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 179.147 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.87 -38.88 79.99 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 179.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.534 ' O ' ' CG ' ' A' ' 17' ' ' GLU . 15.6 tt0 -90.22 4.22 51.22 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 179.228 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.602 HD23 ' HE3' ' A' ' 45' ' ' LYS . 20.1 mt -96.11 -55.33 3.0 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.262 -0.899 . . . . 0.0 108.725 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 25.5 ttpt -59.05 -40.9 86.54 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.81 -26.53 68.67 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.355 -0.841 . . . . 0.0 108.948 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.464 ' HB3' ' O ' ' A' ' 18' ' ' LEU . . . -53.92 -39.34 65.75 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.328 -0.857 . . . . 0.0 109.141 179.654 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 134.8 -1.72 3.94 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.742 -1.343 . . . . 0.0 109.742 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.47 HG22 ' H ' ' A' ' 25' ' ' SER . 9.4 mt -106.74 158.99 6.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.096 -1.237 . . . . 0.0 109.63 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 5.8 p -151.17 18.4 0.76 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.414 -0.804 . . . . 0.0 108.926 179.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.47 ' H ' HG22 ' A' ' 23' ' ' ILE . 0.6 OUTLIER -62.69 -177.44 0.15 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.395 -0.816 . . . . 0.0 109.447 -179.895 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.481 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 3.4 t0 -116.18 -21.0 9.59 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.42 -0.8 . . . . 0.0 109.009 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.54 ' O ' ' CD1' ' A' ' 27' ' ' PHE . 5.7 t80 -81.04 -3.92 53.44 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 120.991 -1.068 . . . . 0.0 108.443 179.001 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.89 ' CE2' HG23 ' A' ' 48' ' ' ILE . 16.9 m-30 -109.42 -6.9 15.29 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.527 -0.733 . . . . 0.0 109.614 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.547 ' CE1' ' HB3' ' A' ' 18' ' ' LEU . 61.6 m-85 -119.38 -43.93 2.59 Favored 'General case' 0 C--N 1.298 -1.672 0 CA-C-O 121.728 0.775 . . . . 0.0 109.381 -178.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.481 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 0.8 OUTLIER -65.5 -21.06 66.58 Favored 'General case' 0 C--N 1.295 -1.765 0 O-C-N 121.738 -0.601 . . . . 0.0 109.38 179.301 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.28 -3.1 58.71 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.224 -0.922 . . . . 0.0 109.823 -179.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.75 HG22 ' HD2' ' A' ' 11' ' ' LYS . 18.1 mt -65.27 -61.6 1.62 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.394 -0.816 . . . . 0.0 109.759 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.539 ' HA ' ' CD ' ' A' ' 11' ' ' LYS . 0.4 OUTLIER -65.29 -9.46 24.42 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.196 -0.94 . . . . 0.0 109.807 -179.617 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.455 ' O ' ' O ' ' A' ' 35' ' ' ALA . 18.7 mmtm -93.62 -19.1 21.47 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.189 -0.945 . . . . 0.0 109.395 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.564 ' HB1' ' HB3' ' A' ' 40' ' ' GLU . . . -55.17 -164.52 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.413 -0.805 . . . . 0.0 109.72 -179.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.7 -63.89 1.37 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.191 -0.943 . . . . 0.0 109.715 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.596 ' O ' HG23 ' A' ' 41' ' ' VAL . 21.4 p -120.02 178.22 4.7 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.166 -0.958 . . . . 0.0 109.444 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.452 HG22 ' ND2' ' A' ' 9' ' ' ASN . 86.6 t -62.33 -43.45 98.11 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.334 -0.854 . . . . 0.0 109.157 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.706 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 0.0 OUTLIER -57.08 -26.33 60.24 Favored 'General case' 0 C--N 1.297 -1.678 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 179.135 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.564 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -80.69 -33.98 34.99 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 178.896 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.615 HG13 HG23 ' A' ' 32' ' ' ILE . 14.6 t -65.27 -64.53 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 178.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 55.9 m-80 -56.34 -31.96 64.24 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.03 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.706 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -59.5 -42.34 91.96 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.25 -0.906 . . . . 0.0 108.722 179.569 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.411 ' HB2' ' O ' ' A' ' 41' ' ' VAL . 2.3 mt -49.8 -54.57 18.37 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.407 -0.808 . . . . 0.0 109.89 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.84 ' HA ' HD12 ' A' ' 48' ' ' ILE . 17.1 tptp -49.61 -34.62 18.46 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.094 -1.004 . . . . 0.0 109.607 -179.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.407 ' HA ' HD21 ' A' ' 49' ' ' LEU . 2.8 m-20 -67.53 -48.77 66.03 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.26 -0.9 . . . . 0.0 109.428 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.45 ' O ' ' HB3' ' A' ' 51' ' ' ALA . 0.1 OUTLIER -74.27 -0.95 18.62 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.057 -1.027 . . . . 0.0 109.176 179.333 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.89 HG23 ' CE2' ' A' ' 28' ' ' TYR . 20.4 mt -87.63 -53.3 10.18 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 O-C-N 121.237 -0.914 . . . . 0.0 108.649 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.565 HD23 ' O ' ' A' ' 45' ' ' LYS . 0.6 OUTLIER -67.03 -18.7 65.49 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.046 -1.033 . . . . 0.0 108.424 179.12 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.9 -41.23 11.91 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 179.246 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.45 ' HB3' ' O ' ' A' ' 47' ' ' GLU . . . -89.56 13.7 13.32 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.706 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 0.0 OUTLIER -166.76 164.68 16.58 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 -179.731 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.706 ' HB3' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.493 1.687 0 CA-C-O 118.005 -0.998 . . . . 0.0 109.287 -179.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.581 ' OD1' HG22 ' A' ' 38' ' ' VAL . 4.5 p30 . . . . . 0 N--CA 1.486 1.367 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.77 ' HB2' HG13 ' A' ' 38' ' ' VAL . . . -81.77 -7.16 59.57 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.308 -0.87 . . . . 0.0 109.115 178.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.749 ' O ' HD12 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -37.89 -46.48 0.96 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.555 -0.716 . . . . 0.0 110.512 -179.503 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -97.93 -22.18 16.46 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.005 -1.059 . . . . 0.0 110.455 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -61.27 -41.93 97.77 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.069 -1.02 . . . . 0.0 110.483 -179.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.548 ' CB ' ' HA ' ' A' ' 42' ' ' ASN . . . -85.41 -40.31 16.59 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.03 -1.044 . . . . 0.0 109.893 -179.631 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 1.001 HG23 ' CE1' ' A' ' 29' ' ' PHE . 67.2 mt -61.08 -27.04 40.86 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.542 0 CA-C-O 121.566 0.698 . . . . 0.0 109.81 -179.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.12 -7.1 10.87 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.643 -0.661 . . . . 0.0 110.743 -178.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.465 ' OE2' ' OD1' ' A' ' 46' ' ' ASN . 2.9 pt-20 -109.35 -8.55 15.05 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 121.022 -1.049 . . . . 0.0 109.51 -179.515 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.637 HD11 HG21 ' A' ' 48' ' ' ILE . 0.6 OUTLIER -100.65 -46.81 5.06 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.19 -0.943 . . . . 0.0 110.125 179.946 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 27.8 ttmt -52.75 -39.38 62.13 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.126 -0.984 . . . . 0.0 109.934 -179.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -31.27 71.86 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.195 -0.94 . . . . 0.0 109.613 -179.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.52 -49.07 78.19 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.19 -0.944 . . . . 0.0 109.239 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 135.46 -8.88 4.34 Favored Glycine 0 N--CA 1.489 2.193 0 N-CA-C 109.661 -1.376 . . . . 0.0 109.661 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.617 HD13 ' NE2' ' A' ' 52' ' ' HIS . 48.8 mt -75.08 122.98 29.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.213 -1.169 . . . . 0.0 109.499 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -117.86 19.08 13.88 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.388 -0.82 . . . . 0.0 109.43 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.48 121.58 15.22 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.292 -0.88 . . . . 0.0 109.52 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.42 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 0.3 OUTLIER -74.41 -1.68 22.08 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.238 -0.914 . . . . 0.0 109.598 179.87 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.69 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 4.5 t80 -76.64 -14.99 59.93 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.235 -0.915 . . . . 0.0 109.175 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.714 ' HB3' HD11 ' A' ' 48' ' ' ILE . 62.3 m-85 -104.27 -33.37 8.7 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.421 -0.799 . . . . 0.0 109.073 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 1.001 ' CE1' HG23 ' A' ' 15' ' ' ILE . 8.7 m-85 -71.44 -47.37 56.2 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.362 -0.836 . . . . 0.0 108.805 179.082 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.461 ' O ' ' HD2' ' A' ' 34' ' ' LYS . 0.1 OUTLIER -61.33 -29.77 70.1 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.374 -0.829 . . . . 0.0 109.561 179.821 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.6 -22.4 50.91 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.268 -0.895 . . . . 0.0 109.462 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.71 HD13 ' O ' ' A' ' 28' ' ' TYR . 1.2 mp -65.18 -42.54 94.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.301 -0.874 . . . . 0.0 108.932 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 31.2 t30 -80.81 8.29 8.52 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.168 -0.957 . . . . 0.0 110.222 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.479 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.2 OUTLIER -122.14 -14.47 7.95 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.027 -1.046 . . . . 0.0 110.034 -179.746 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.803 ' HB2' HD12 ' A' ' 44' ' ' LEU . . . -47.65 -102.54 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.36 -0.838 . . . . 0.0 110.599 -179.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -171.05 -68.71 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.803 -1.185 . . . . 0.0 109.565 -179.311 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.938 ' O ' HG23 ' A' ' 41' ' ' VAL . 33.3 p -123.41 -167.72 1.66 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.313 -0.867 . . . . 0.0 109.399 -179.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.77 HG13 ' HB2' ' A' ' 10' ' ' ALA . 26.1 t -64.85 -53.9 36.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.152 -0.968 . . . . 0.0 109.372 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.56 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 9.2 pt-20 -52.97 -27.32 18.51 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.273 -0.892 . . . . 0.0 109.469 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.615 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 2.8 mm-40 -81.08 -33.09 33.63 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.167 -0.958 . . . . 0.0 109.001 179.507 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.938 HG23 ' O ' ' A' ' 37' ' ' THR . 15.6 t -70.61 -62.35 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.391 -0.818 . . . . 0.0 108.959 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.548 ' HA ' ' CB ' ' A' ' 14' ' ' ALA . 69.1 m-80 -57.12 -31.7 65.58 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.467 -0.771 . . . . 0.0 109.61 179.54 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.56 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -67.36 -40.47 85.8 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.181 -0.949 . . . . 0.0 109.058 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.803 HD12 ' HB2' ' A' ' 35' ' ' ALA . 6.0 mt -61.91 -48.52 80.08 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.313 -0.867 . . . . 0.0 110.704 -179.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.645 ' HD2' HD11 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -65.73 -24.94 67.08 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.868 -1.145 . . . . 0.0 110.356 -178.898 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.465 ' OD1' ' OE2' ' A' ' 17' ' ' GLU . 41.1 m-20 -80.94 -25.1 37.66 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.964 -1.085 . . . . 0.0 110.398 -179.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.434 ' O ' ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -77.69 -18.97 56.08 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.986 -1.072 . . . . 0.0 110.412 -179.365 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.714 HD11 ' HB3' ' A' ' 28' ' ' TYR . 1.1 mt -66.14 -29.06 45.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.084 -1.01 . . . . 0.0 108.989 179.528 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.466 ' O ' ' OXT' ' A' ' 53' ' ' ALA . 1.4 mm? -60.34 -25.66 65.99 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.037 -1.039 . . . . 0.0 109.19 179.373 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.59 6.37 5.67 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.062 -1.024 . . . . 0.0 109.87 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.445 ' HB3' ' HA ' ' A' ' 48' ' ' ILE . . . -101.0 -19.52 15.8 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.283 -0.886 . . . . 0.0 109.496 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.617 ' NE2' HD13 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -143.36 8.55 1.59 Allowed 'General case' 0 C--N 1.303 -1.454 0 C-N-CA 119.573 -0.851 . . . . 0.0 110.156 -178.398 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.466 ' OXT' ' O ' ' A' ' 49' ' ' LEU . . . . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 117.999 -1.0 . . . . 0.0 109.596 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.827 ' OD1' HG22 ' A' ' 38' ' ' VAL . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 121.278 0.561 . . . . 0.0 109.799 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -81.15 10.98 4.56 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.251 -0.906 . . . . 0.0 109.709 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.488 ' O ' HG13 ' A' ' 15' ' ' ILE . 0.1 OUTLIER -50.98 -78.15 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.028 -1.045 . . . . 0.0 110.505 -179.244 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -88.16 -18.34 28.98 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.011 -1.056 . . . . 0.0 110.94 -178.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -61.08 -39.48 90.06 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.826 -1.171 . . . . 0.0 109.308 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.522 ' O ' HD23 ' A' ' 18' ' ' LEU . . . -85.86 -45.93 11.09 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.27 -0.894 . . . . 0.0 109.254 179.724 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.808 HG23 ' CE1' ' A' ' 29' ' ' PHE . 95.2 mt -50.49 -29.23 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.535 -0.728 . . . . 0.0 110.288 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.3 -39.05 89.04 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.407 -0.808 . . . . 0.0 110.145 -178.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.416 ' C ' HD22 ' A' ' 18' ' ' LEU . 12.8 tt0 -83.37 -2.02 54.77 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.411 -0.806 . . . . 0.0 110.969 -178.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.522 HD23 ' O ' ' A' ' 14' ' ' ALA . 4.1 mm? -98.1 -38.01 9.51 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.814 -1.179 . . . . 0.0 110.066 -179.685 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.66 -38.92 49.12 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.237 -0.914 . . . . 0.0 109.736 -179.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.9 ttpt -71.51 -32.78 68.59 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.015 -1.053 . . . . 0.0 109.263 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.62 -22.21 32.44 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.259 -0.901 . . . . 0.0 109.582 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.444 ' O ' ' N ' ' A' ' 24' ' ' THR . . . 106.26 -41.14 2.25 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.536 HD13 ' CG2' ' A' ' 48' ' ' ILE . 46.8 mt -52.01 94.2 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.3 -1.118 . . . . 0.0 109.397 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.444 ' N ' ' O ' ' A' ' 22' ' ' GLY . 0.8 OUTLIER -97.27 19.8 12.53 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.22 -0.925 . . . . 0.0 109.848 -179.843 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.98 150.85 32.14 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.119 -0.988 . . . . 0.0 109.752 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -96.77 -8.18 31.86 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.244 -0.91 . . . . 0.0 109.276 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.514 ' O ' ' CD1' ' A' ' 27' ' ' PHE . 8.4 t80 -80.65 -8.8 59.75 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.038 -1.039 . . . . 0.0 109.476 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.656 ' CE2' HG23 ' A' ' 48' ' ' ILE . 18.6 m-30 -106.18 -15.33 14.89 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.384 -0.823 . . . . 0.0 109.207 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.808 ' CE1' HG23 ' A' ' 15' ' ' ILE . 10.7 m-30 -104.66 -49.75 3.46 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.577 -0.702 . . . . 0.0 109.376 -179.783 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -64.61 -41.23 96.34 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.244 -0.91 . . . . 0.0 109.35 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.7 1.27 20.45 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.228 -0.92 . . . . 0.0 109.775 -179.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.613 ' HA ' HD21 ' A' ' 44' ' ' LEU . 0.1 OUTLIER -72.96 -41.45 60.13 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.154 -0.966 . . . . 0.0 109.017 179.914 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 23.0 p30 -80.19 -0.78 37.66 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.339 -0.851 . . . . 0.0 109.576 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.497 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -107.03 -16.54 14.41 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.264 -0.898 . . . . 0.0 109.752 -179.563 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.634 ' HB1' ' OE1' ' A' ' 40' ' ' GLU . . . -39.61 -98.91 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.641 -0.662 . . . . 0.0 110.624 -179.273 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.518 ' CG ' ' O ' ' A' ' 35' ' ' ALA . 5.3 mttt -171.15 -69.28 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.993 -1.067 . . . . 0.0 109.027 -179.235 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.855 ' O ' HG23 ' A' ' 41' ' ' VAL . 5.1 t -127.94 -177.65 4.21 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.827 HG22 ' OD1' ' A' ' 9' ' ' ASN . 4.6 t -61.53 -48.87 86.79 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 O-C-N 120.909 -1.119 . . . . 0.0 109.661 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.554 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 1.1 tt0 -61.35 -18.47 58.81 Favored 'General case' 0 C--N 1.296 -1.749 0 O-C-N 121.087 -1.008 . . . . 0.0 109.103 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.634 ' OE1' ' HB1' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -90.78 -26.15 19.61 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.208 -0.932 . . . . 0.0 109.019 179.657 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.855 HG23 ' O ' ' A' ' 37' ' ' THR . 20.2 t -76.09 -54.75 12.92 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.398 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 179.007 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -66.68 -28.49 68.49 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.514 -0.741 . . . . 0.0 109.493 179.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.554 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -76.99 -23.97 52.26 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.201 -0.937 . . . . 0.0 109.678 -179.68 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.681 ' C ' HD12 ' A' ' 44' ' ' LEU . 0.3 OUTLIER -78.75 -41.23 31.24 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.162 -0.961 . . . . 0.0 109.86 -179.581 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.83 ' HA ' HD13 ' A' ' 48' ' ' ILE . 6.4 mmtt -61.58 -35.17 77.05 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.959 -1.088 . . . . 0.0 109.592 -179.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.2 m-20 -70.39 -23.5 62.78 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.083 -1.01 . . . . 0.0 108.457 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.552 ' O ' ' HB3' ' A' ' 51' ' ' ALA . 2.2 tt0 -78.85 1.56 23.0 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.5 -0.75 . . . . 0.0 109.038 179.183 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.83 HD13 ' HA ' ' A' ' 45' ' ' LYS . 1.7 mp -79.33 -33.16 15.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.545 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 23.1 tp -69.98 -30.86 68.3 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.426 -0.796 . . . . 0.0 109.938 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.6 mttt -102.79 -14.89 16.43 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.025 -1.047 . . . . 0.0 110.01 -179.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.552 ' HB3' ' O ' ' A' ' 47' ' ' GLU . . . -100.77 19.69 16.67 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.154 -0.966 . . . . 0.0 109.72 -179.768 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -165.52 -44.26 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.272 -0.892 . . . . 0.0 109.153 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.545 ' HB3' ' O ' ' A' ' 49' ' ' LEU . . . . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 117.953 -1.023 . . . . 0.0 109.558 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.6 ' ND2' HG22 ' A' ' 38' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.425 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.43 ' HB3' HG13 ' A' ' 38' ' ' VAL . . . -54.45 -18.3 4.09 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.333 -0.854 . . . . 0.0 109.687 179.782 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.462 ' O ' HG13 ' A' ' 15' ' ' ILE . 0.4 OUTLIER -57.82 -71.46 0.11 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.237 -0.915 . . . . 0.0 110.181 -179.471 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -64.29 -28.54 69.79 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.002 -1.061 . . . . 0.0 110.013 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -61.77 -31.87 72.1 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 120.975 -1.078 . . . . 0.0 109.125 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.28 -58.25 2.83 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.312 -0.868 . . . . 0.0 108.775 179.323 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.597 HG23 ' CE1' ' A' ' 29' ' ' PHE . 8.3 mt -43.33 -35.22 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 O-C-N 121.531 -0.731 . . . . 0.0 110.413 179.717 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -77.15 29.26 0.14 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.294 -0.879 . . . . 0.0 110.652 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -151.66 -36.62 0.13 Allowed 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 179.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.619 HD12 ' HE3' ' A' ' 45' ' ' LYS . 14.9 mt -78.72 -31.31 46.34 Favored 'General case' 0 C--N 1.306 -1.287 0 O-C-N 121.64 -0.662 . . . . 0.0 109.558 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.9 tttt -58.95 -21.53 58.5 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.131 -0.981 . . . . 0.0 109.674 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 41.1 mtmt -84.03 -25.91 29.51 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.289 -0.882 . . . . 0.0 109.527 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.32 -4.06 13.11 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.27 -0.894 . . . . 0.0 109.773 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 102.36 -34.73 5.49 Favored Glycine 0 N--CA 1.488 2.149 0 N-CA-C 108.966 -1.654 . . . . 0.0 108.966 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.472 ' O ' ' CG2' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -46.9 117.67 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 O-C-N 121.44 -1.035 . . . . 0.0 108.864 179.735 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.39 6.77 6.36 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.08 -1.013 . . . . 0.0 110.042 -179.661 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -54.01 121.1 7.35 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.237 -0.914 . . . . 0.0 109.222 179.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.471 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 33.3 m-20 -73.51 -1.4 18.4 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.083 -1.01 . . . . 0.0 109.641 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.466 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 3.2 t80 -80.82 -39.79 26.02 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.034 -1.041 . . . . 0.0 109.247 179.884 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 1.079 ' CE2' HG23 ' A' ' 48' ' ' ILE . 21.7 m-30 -74.83 -25.03 58.72 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.472 -0.768 . . . . 0.0 110.129 -179.467 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.597 ' CE1' HG23 ' A' ' 15' ' ' ILE . 11.7 m-85 -94.97 -49.93 5.33 Favored 'General case' 0 C--N 1.297 -1.677 0 O-C-N 121.271 -0.893 . . . . 0.0 110.205 -178.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.471 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 66.3 m-20 -61.0 -35.77 77.72 Favored 'General case' 0 C--N 1.297 -1.704 0 O-C-N 121.152 -0.968 . . . . 0.0 109.476 179.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.432 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . . . -85.26 -4.39 59.14 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.256 -0.903 . . . . 0.0 110.328 -179.033 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.551 ' CD1' ' HE2' ' A' ' 45' ' ' LYS . 0.4 OUTLIER -62.59 -44.82 99.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.074 -1.016 . . . . 0.0 109.554 -179.67 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -77.82 -5.63 51.46 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.14 -0.975 . . . . 0.0 109.489 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.452 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -77.99 -22.86 48.72 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.244 -0.91 . . . . 0.0 109.607 -179.92 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.901 ' HB1' ' HB3' ' A' ' 40' ' ' GLU . . . -51.53 -175.47 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.216 -0.928 . . . . 0.0 109.973 -179.683 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.446 ' H ' ' CB ' ' A' ' 40' ' ' GLU . 0.5 OUTLIER -106.58 -54.04 2.53 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.498 -0.751 . . . . 0.0 109.096 179.824 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.686 ' O ' HG23 ' A' ' 41' ' ' VAL . 51.9 p -123.61 -172.95 2.63 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.312 -0.868 . . . . 0.0 109.24 179.752 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.6 HG22 ' ND2' ' A' ' 9' ' ' ASN . 67.4 t -66.91 -26.17 36.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.111 -0.993 . . . . 0.0 109.474 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.722 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 63.7 mt-10 -73.12 -29.18 62.71 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 179.381 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.901 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 2.9 mm-40 -79.23 -32.54 43.94 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 178.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.686 HG23 ' O ' ' A' ' 37' ' ' THR . 21.1 t -68.61 -68.37 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -51.3 -28.27 11.63 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 179.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.722 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -64.21 -50.34 68.45 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.43 -0.794 . . . . 0.0 109.031 179.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.9 mt -54.98 -44.0 74.05 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.29 -0.882 . . . . 0.0 109.881 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.655 ' NZ ' HD11 ' A' ' 48' ' ' ILE . 0.3 OUTLIER -57.64 -40.53 79.45 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.16 -0.963 . . . . 0.0 109.162 179.862 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.5 m-20 -69.65 -21.87 63.5 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.263 -0.898 . . . . 0.0 109.622 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.67 ' O ' ' HB3' ' A' ' 51' ' ' ALA . 1.4 mt-10 -82.96 10.27 8.27 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.212 -0.93 . . . . 0.0 109.314 179.488 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 1.079 HG23 ' CE2' ' A' ' 28' ' ' TYR . 62.0 mt -90.03 -45.02 15.1 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 179.154 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 7.4 mp -61.72 -21.48 64.53 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.436 -0.79 . . . . 0.0 109.681 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -106.42 -43.22 4.82 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.902 -1.124 . . . . 0.0 109.906 -179.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.67 ' HB3' ' O ' ' A' ' 47' ' ' GLU . . . -84.71 43.15 0.96 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.163 -0.961 . . . . 0.0 109.134 179.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.725 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 0.4 OUTLIER 163.14 157.03 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 -179.54 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.725 ' HB3' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 118.037 -0.982 . . . . 0.0 109.425 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.484 HD22 HG22 ' A' ' 38' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -81.87 29.73 0.39 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.184 -0.947 . . . . 0.0 110.396 179.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.768 ' O ' HD12 ' A' ' 15' ' ' ILE . 0.4 OUTLIER -63.81 -42.86 97.59 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 120.788 -1.195 . . . . 0.0 109.915 -179.715 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.519 ' O ' ' HB2' ' A' ' 16' ' ' ALA . 1.5 tt0 -96.01 -26.04 15.7 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.048 -1.033 . . . . 0.0 110.437 -179.241 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -65.83 -56.43 11.93 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.822 -1.174 . . . . 0.0 110.146 -179.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.64 ' HB1' ' HD2' ' A' ' 45' ' ' LYS . . . -69.77 -46.78 65.03 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.203 -0.936 . . . . 0.0 110.009 -179.531 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 1.052 HG23 ' CZ ' ' A' ' 29' ' ' PHE . 46.0 mt -57.85 -29.59 35.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 CA-C-O 121.718 0.77 . . . . 0.0 109.652 -179.699 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.519 ' HB2' ' O ' ' A' ' 12' ' ' GLU . . . -61.79 -6.8 2.92 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.51 -0.744 . . . . 0.0 111.284 -178.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.589 ' HB3' ' HZ2' ' A' ' 45' ' ' LYS . 28.6 tt0 -105.39 -22.61 12.99 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 120.906 -1.121 . . . . 0.0 109.996 -179.365 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.987 HD21 HD12 ' A' ' 48' ' ' ILE . 0.7 OUTLIER -76.78 -35.98 57.31 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.924 -1.11 . . . . 0.0 109.449 -179.87 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.7 ttmt -50.34 -35.12 26.35 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.323 -0.861 . . . . 0.0 109.843 -179.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.85 -21.77 21.29 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.141 -0.974 . . . . 0.0 109.746 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.27 -28.13 69.52 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.154 -0.966 . . . . 0.0 109.17 179.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 115.61 -16.93 16.37 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.668 HD13 HG21 ' A' ' 48' ' ' ILE . 67.4 mt -84.19 115.13 25.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.198 -1.178 . . . . 0.0 109.798 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.414 ' O ' ' C ' ' A' ' 25' ' ' SER . 0.0 OUTLIER -117.47 0.45 12.15 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.187 -0.946 . . . . 0.0 109.302 179.36 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.414 ' C ' ' O ' ' A' ' 24' ' ' THR . 49.6 m -44.75 157.44 0.07 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.177 -0.952 . . . . 0.0 109.45 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.463 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 4.8 p-10 -104.11 -7.17 20.42 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.22 -0.925 . . . . 0.0 109.866 -179.621 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.563 ' O ' ' CG ' ' A' ' 27' ' ' PHE . 27.0 t80 -80.54 1.3 30.13 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.982 -1.073 . . . . 0.0 109.55 -179.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.961 ' CE2' HG23 ' A' ' 48' ' ' ILE . 15.6 m-85 -117.34 -50.66 2.54 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 179.205 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 1.052 ' CZ ' HG23 ' A' ' 15' ' ' ILE . 1.2 m-30 -66.41 -38.83 88.34 Favored 'General case' 0 C--N 1.302 -1.48 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.121 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.463 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 12.0 m-20 -69.76 -34.33 73.64 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.209 -0.932 . . . . 0.0 108.833 179.435 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.91 -15.42 58.35 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.476 -0.765 . . . . 0.0 109.471 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 1.111 HG23 HG13 ' A' ' 41' ' ' VAL . 1.3 mm -53.12 -27.72 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.251 -0.905 . . . . 0.0 108.968 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.457 ' OD1' ' O ' ' A' ' 30' ' ' ASN . 2.2 p-10 -80.38 -33.32 37.24 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.031 -1.043 . . . . 0.0 109.486 179.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.46 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -54.71 -27.98 44.61 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.245 -0.909 . . . . 0.0 109.428 179.986 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.716 ' HB2' HD12 ' A' ' 44' ' ' LEU . . . -44.99 169.27 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.288 -0.883 . . . . 0.0 109.476 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.3 mttp -99.0 -47.0 5.4 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.319 -0.863 . . . . 0.0 109.455 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.627 ' O ' HG23 ' A' ' 41' ' ' VAL . 70.6 p -126.73 -163.08 1.2 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.208 -0.932 . . . . 0.0 109.388 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.484 HG22 HD22 ' A' ' 9' ' ' ASN . 87.3 t -70.56 -54.98 15.96 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 O-C-N 121.301 -0.874 . . . . 0.0 109.317 179.818 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.685 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 3.2 tt0 -53.33 -27.94 26.02 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.275 -0.891 . . . . 0.0 109.228 179.755 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.596 ' HB2' ' HB1' ' A' ' 35' ' ' ALA . 4.8 mm-40 -79.07 -35.38 42.54 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 179.295 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 1.111 HG13 HG23 ' A' ' 32' ' ' ILE . 55.4 t -65.76 -67.18 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 178.685 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.484 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 7.4 m-20 -53.9 -30.71 47.29 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.674 -0.641 . . . . 0.0 109.537 179.228 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.685 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -66.14 -39.89 90.2 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.215 -0.928 . . . . 0.0 109.457 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.716 HD12 ' HB2' ' A' ' 35' ' ' ALA . 4.0 mt -61.67 -43.11 99.48 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.262 -0.899 . . . . 0.0 110.699 -179.451 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.942 ' HE2' HD13 ' A' ' 18' ' ' LEU . 0.0 OUTLIER -67.32 -43.51 81.42 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.846 -1.159 . . . . 0.0 109.883 -179.163 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.475 ' N ' ' CG ' ' A' ' 45' ' ' LYS . 28.0 m-20 -69.35 -21.47 63.81 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.108 -0.995 . . . . 0.0 108.69 179.626 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.426 ' HB2' ' O ' ' A' ' 43' ' ' ALA . 1.3 tm-20 -73.32 -12.71 60.93 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.987 HD12 HD21 ' A' ' 18' ' ' LEU . 53.9 mt -65.81 -41.08 89.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 179.082 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.2 mp -50.76 -29.47 11.56 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.78 -0.575 . . . . 0.0 110.353 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.45 ' O ' ' CD ' ' A' ' 50' ' ' LYS . 0.1 OUTLIER -111.99 -13.89 13.54 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.778 -1.201 . . . . 0.0 110.675 -179.228 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -100.9 20.49 15.32 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 179.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.879 ' CD2' HG22 ' A' ' 48' ' ' ILE . 0.0 OUTLIER 173.47 155.21 0.11 Allowed 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.84 -1.171 . . . . 0.0 107.84 -179.248 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.715 ' HB3' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.492 1.654 0 CA-C-O 117.943 -1.027 . . . . 0.0 109.252 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.785 HD21 HG22 ' A' ' 38' ' ' VAL . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 121.143 0.497 . . . . 0.0 110.032 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.76 ' HB3' HG11 ' A' ' 41' ' ' VAL . . . -80.22 -9.54 59.73 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.218 -0.926 . . . . 0.0 110.401 -179.213 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.468 ' O ' HG13 ' A' ' 15' ' ' ILE . 36.4 mtpt -45.26 -69.89 0.12 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.118 -0.989 . . . . 0.0 110.152 -179.44 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -90.79 -20.67 22.09 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.05 -1.031 . . . . 0.0 110.322 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.82 -30.86 71.8 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 120.911 -1.118 . . . . 0.0 109.426 -179.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.549 ' O ' ' CD2' ' A' ' 18' ' ' LEU . . . -93.77 -49.04 6.03 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.685 -0.858 . . . . 0.0 108.685 179.458 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.863 HG23 ' CE1' ' A' ' 29' ' ' PHE . 70.0 mt -53.65 -27.32 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 CA-C-O 121.547 0.689 . . . . 0.0 110.65 179.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.4 -3.05 1.21 Allowed 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.444 -0.785 . . . . 0.0 111.351 -178.39 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -122.31 -3.6 8.94 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 120.683 -1.261 . . . . 0.0 110.201 -179.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.808 ' N ' HD22 ' A' ' 18' ' ' LEU . 2.5 mm? -99.71 -38.53 8.66 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.036 -1.04 . . . . 0.0 109.562 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.7 tptp -50.91 -45.07 60.24 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.245 -0.909 . . . . 0.0 109.148 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.93 -31.27 72.1 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.232 -0.917 . . . . 0.0 109.548 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.97 -48.86 79.98 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.254 -0.904 . . . . 0.0 109.52 -179.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.532 ' O ' HG23 ' A' ' 24' ' ' THR . . . 136.29 -22.25 3.4 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.294 -1.522 . . . . 0.0 109.294 -179.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.582 HD13 HG21 ' A' ' 48' ' ' ILE . 53.9 mt -66.57 122.5 17.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.336 -1.097 . . . . 0.0 109.301 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.532 HG23 ' O ' ' A' ' 22' ' ' GLY . 13.7 p -128.99 1.38 5.29 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.192 -0.942 . . . . 0.0 109.845 -179.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.421 ' C ' ' O ' ' A' ' 24' ' ' THR . 18.3 t -44.22 161.2 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.178 -0.951 . . . . 0.0 108.958 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.528 ' O ' ' CB ' ' A' ' 30' ' ' ASN . 3.6 p30 -99.6 -10.89 21.48 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.129 -0.982 . . . . 0.0 109.573 -179.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.608 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 18.4 t80 -81.01 -6.38 58.72 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.029 -1.045 . . . . 0.0 109.611 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.832 ' CD1' HD11 ' A' ' 48' ' ' ILE . 23.1 m-85 -110.97 -37.11 5.47 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.205 -0.934 . . . . 0.0 108.494 179.446 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.863 ' CE1' HG23 ' A' ' 15' ' ' ILE . 3.5 m-85 -85.39 -43.53 13.57 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 179.175 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.528 ' CB ' ' O ' ' A' ' 26' ' ' ASP . 48.3 t30 -69.87 -57.87 4.55 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.4 -0.813 . . . . 0.0 108.955 179.636 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.5 -16.29 23.35 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.437 -0.79 . . . . 0.0 109.203 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.539 HG21 HD11 ' A' ' 15' ' ' ILE . 0.4 OUTLIER -54.15 -39.38 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.34 -0.85 . . . . 0.0 108.814 179.924 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.526 ' ND2' ' N ' ' A' ' 34' ' ' LYS . 0.7 OUTLIER -75.77 -35.03 60.26 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.274 -0.891 . . . . 0.0 109.094 179.618 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.526 ' N ' ' ND2' ' A' ' 33' ' ' ASN . 0.7 OUTLIER -55.41 -25.2 34.51 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.377 -0.827 . . . . 0.0 109.501 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.706 ' HB2' HD12 ' A' ' 44' ' ' LEU . . . -40.12 155.96 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.667 -0.646 . . . . 0.0 109.914 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -86.39 -70.85 0.58 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.318 -0.864 . . . . 0.0 109.535 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.654 ' O ' HG23 ' A' ' 41' ' ' VAL . 0.6 OUTLIER -108.55 -179.94 4.02 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.159 -0.963 . . . . 0.0 109.138 179.758 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.785 HG22 HD21 ' A' ' 9' ' ' ASN . 27.8 t -59.3 -37.77 70.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.23 -0.918 . . . . 0.0 109.234 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.655 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 43.4 mt-10 -63.51 -28.48 69.98 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 121.281 -0.887 . . . . 0.0 108.747 179.378 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.502 ' OE1' ' N ' ' A' ' 40' ' ' GLU . 1.1 mp0 -79.49 -31.27 42.26 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 179.131 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.76 HG11 ' HB3' ' A' ' 10' ' ' ALA . 12.7 t -67.21 -66.67 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.343 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 178.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -55.46 -35.29 65.32 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 179.182 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.655 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -62.05 -35.82 79.78 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.283 -0.885 . . . . 0.0 109.164 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.706 HD12 ' HB2' ' A' ' 35' ' ' ALA . 3.7 mt -59.44 -52.15 66.85 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.433 -0.792 . . . . 0.0 110.314 -179.758 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.524 ' HA ' HD13 ' A' ' 48' ' ' ILE . 43.0 mmtt -64.39 -25.67 68.13 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.106 -0.997 . . . . 0.0 109.998 -179.119 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.4 m-20 -76.46 -18.07 58.98 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.054 -1.029 . . . . 0.0 109.621 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.534 ' O ' ' CB ' ' A' ' 51' ' ' ALA . 0.0 OUTLIER -90.18 -12.79 37.1 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.186 -0.946 . . . . 0.0 109.294 179.76 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.832 HD11 ' CD1' ' A' ' 28' ' ' TYR . 1.2 mp -73.3 -35.38 46.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 179.529 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 5.7 tp -61.82 -24.03 66.62 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.074 -1.016 . . . . 0.0 110.081 -179.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 26.1 mttt -121.76 -1.72 9.42 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.818 -1.176 . . . . 0.0 110.076 -179.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.534 ' CB ' ' O ' ' A' ' 47' ' ' GLU . . . -101.11 -28.11 12.88 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.111 -0.993 . . . . 0.0 109.886 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.533 ' CD2' HG23 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -131.96 -0.03 3.82 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.094 -1.004 . . . . 0.0 109.87 -179.334 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.656 0 CA-C-O 118.027 -0.987 . . . . 0.0 109.572 179.769 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.58 ' ND2' ' N ' ' A' ' 9' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.494 1.771 0 CA-C-O 121.179 0.514 . . . . 0.0 110.632 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.54 ' HA ' ' HB2' ' A' ' 13' ' ' ASP . . . -69.8 0.2 6.1 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.177 -0.952 . . . . 0.0 110.818 -179.085 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.547 ' HG2' ' CG2' ' A' ' 32' ' ' ILE . 0.1 OUTLIER -44.63 -74.05 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.464 0 O-C-N 120.819 -1.176 . . . . 0.0 110.571 -179.712 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.49 ' HA ' ' HB ' ' A' ' 15' ' ' ILE . 76.0 mt-10 -75.76 -5.77 47.38 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.962 -1.086 . . . . 0.0 110.307 -179.103 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.54 ' HB2' ' HA ' ' A' ' 10' ' ' ALA . 1.0 OUTLIER -70.37 -44.82 67.3 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.208 -0.933 . . . . 0.0 109.333 179.8 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.408 ' CB ' ' HD3' ' A' ' 45' ' ' LYS . . . -87.25 -31.7 20.12 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.329 -0.857 . . . . 0.0 109.284 179.686 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.922 HG23 ' CE1' ' A' ' 29' ' ' PHE . 31.4 mt -62.39 -28.84 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 CA-C-O 121.917 0.865 . . . . 0.0 109.051 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.29 -10.96 12.53 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.808 -0.557 . . . . 0.0 110.145 -179.087 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -101.27 -18.66 16.01 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.299 -0.876 . . . . 0.0 109.526 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.59 ' HG ' ' CE ' ' A' ' 45' ' ' LYS . 4.2 mm? -90.02 -56.07 3.37 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.278 -0.889 . . . . 0.0 109.824 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.6 tttp -49.5 -29.59 6.96 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.4 -0.813 . . . . 0.0 109.908 -179.288 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.0 tttp -86.7 -29.53 22.36 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.1 -1.0 . . . . 0.0 109.715 -179.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.23 -33.99 75.41 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.27 -0.894 . . . . 0.0 109.713 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.721 ' O ' HG23 ' A' ' 24' ' ' THR . . . 131.04 -45.15 1.15 Allowed Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.414 -1.475 . . . . 0.0 109.414 -179.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.476 HD13 ' CG2' ' A' ' 48' ' ' ILE . 66.0 mt -45.62 136.6 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.272 -1.134 . . . . 0.0 109.517 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.721 HG23 ' O ' ' A' ' 22' ' ' GLY . 64.1 p -137.74 25.22 2.84 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.249 -0.907 . . . . 0.0 109.457 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 9.8 t -65.11 156.63 30.96 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.281 -0.887 . . . . 0.0 109.329 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.48 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 68.7 m-20 -96.45 -6.98 36.03 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.223 -0.923 . . . . 0.0 109.597 -179.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.528 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 8.6 t80 -81.83 -19.27 41.43 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 120.971 -1.081 . . . . 0.0 109.013 179.625 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.629 ' CD2' HG12 ' A' ' 48' ' ' ILE . 22.2 m-30 -97.16 -11.82 23.84 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.39 -0.819 . . . . 0.0 109.615 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.922 ' CE1' HG23 ' A' ' 15' ' ' ILE . 9.8 m-85 -112.55 -49.96 2.92 Favored 'General case' 0 C--N 1.297 -1.697 0 O-C-N 121.296 -0.877 . . . . 0.0 109.45 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.48 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 8.5 t30 -62.19 -40.55 96.43 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.581 -0.699 . . . . 0.0 109.285 179.501 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.16 -1.2 43.64 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.39 -0.819 . . . . 0.0 109.886 -179.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.646 ' HA ' HD21 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -76.45 -55.93 9.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.108 -0.995 . . . . 0.0 109.611 -179.659 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.597 ' N ' HG22 ' A' ' 32' ' ' ILE . 6.8 t-20 -69.24 -6.42 29.07 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.136 -0.977 . . . . 0.0 109.193 179.77 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.48 ' O ' ' O ' ' A' ' 35' ' ' ALA . 4.2 mttt -103.38 -20.63 14.01 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.255 -0.903 . . . . 0.0 109.636 -179.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.515 ' HB3' HG22 ' A' ' 41' ' ' VAL . . . -40.29 164.09 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.747 0 CA-C-O 121.625 0.726 . . . . 0.0 110.175 -179.568 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.6 mttp -51.4 -78.93 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.336 -0.852 . . . . 0.0 110.165 -179.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.873 HG21 ' OE2' ' A' ' 39' ' ' GLU . 4.8 t -128.76 -154.09 0.61 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.186 -0.946 . . . . 0.0 109.724 -179.555 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.665 ' N ' HG23 ' A' ' 37' ' ' THR . 12.3 t -75.79 -53.9 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 O-C-N 121.119 -0.988 . . . . 0.0 109.845 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.873 ' OE2' HG21 ' A' ' 37' ' ' THR . 1.3 pt-20 -55.36 -22.6 20.21 Favored 'General case' 0 C--N 1.296 -1.732 0 O-C-N 121.007 -1.058 . . . . 0.0 108.575 179.542 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.459 ' O ' ' HB3' ' A' ' 44' ' ' LEU . 20.0 tp10 -84.9 -32.82 22.94 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.796 HG23 ' O ' ' A' ' 37' ' ' THR . 53.9 t -66.62 -59.96 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.432 ' O ' ' OD1' ' A' ' 46' ' ' ASN . 35.9 m-80 -58.75 -34.93 71.95 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.474 -0.766 . . . . 0.0 109.735 179.574 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.85 -26.64 61.54 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.156 -0.965 . . . . 0.0 109.631 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.712 ' O ' HD12 ' A' ' 44' ' ' LEU . 0.3 OUTLIER -75.83 -30.15 58.86 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.139 -0.976 . . . . 0.0 108.464 179.502 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.59 ' CE ' ' HG ' ' A' ' 18' ' ' LEU . 0.0 OUTLIER -64.62 -26.21 68.3 Favored 'General case' 0 N--CA 1.487 1.408 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.369 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . 0.432 ' OD1' ' O ' ' A' ' 42' ' ' ASN . 23.1 m120 -80.18 -15.86 56.11 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.554 -0.716 . . . . 0.0 109.813 -179.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -83.01 -7.61 59.65 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.201 -0.937 . . . . 0.0 109.82 -179.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.629 HG12 ' CD2' ' A' ' 28' ' ' TYR . 2.4 mp -74.82 -46.67 40.46 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 O-C-N 120.966 -1.084 . . . . 0.0 108.586 179.348 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.2 mp -54.09 -40.12 66.97 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.311 -0.868 . . . . 0.0 109.105 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.6 tmtt? -80.4 -73.14 0.38 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.162 -0.962 . . . . 0.0 108.548 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.463 ' O ' ' HB3' ' A' ' 52' ' ' HIS . . . -55.88 161.46 2.23 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.075 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.625 ' CG ' ' O ' ' A' ' 52' ' ' HIS . 0.4 OUTLIER 64.73 10.46 6.04 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 120.911 -1.118 . . . . 0.0 108.964 179.674 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.453 0 O-C-N 120.963 -1.086 . . . . 0.0 109.455 179.722 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.816 ' ND2' HG22 ' A' ' 38' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.591 0 CA-C-O 121.353 0.597 . . . . 0.0 109.619 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.654 ' HB3' HG11 ' A' ' 41' ' ' VAL . . . -80.78 0.82 33.09 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.262 -0.899 . . . . 0.0 109.617 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 5.4 mtpm? -62.52 -88.01 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.171 -0.956 . . . . 0.0 109.969 -179.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.431 ' O ' ' HB2' ' A' ' 16' ' ' ALA . 4.7 tt0 -57.83 -17.15 14.32 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.159 -0.963 . . . . 0.0 110.077 -179.3 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.457 ' HB2' ' HA ' ' A' ' 10' ' ' ALA . 61.8 m-20 -59.94 -73.61 0.09 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.097 -1.002 . . . . 0.0 109.475 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.545 ' O ' HD12 ' A' ' 18' ' ' LEU . . . -68.47 -42.36 78.84 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.228 -0.92 . . . . 0.0 109.461 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.748 HG23 ' CE1' ' A' ' 29' ' ' PHE . 10.6 mt -49.86 -30.82 6.33 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.524 0 O-C-N 121.206 -0.934 . . . . 0.0 109.033 179.796 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.431 ' HB2' ' O ' ' A' ' 12' ' ' GLU . . . -66.4 -38.74 88.17 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.633 -0.667 . . . . 0.0 110.582 -178.43 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.3 tp10 -76.21 -25.0 54.67 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.179 -0.951 . . . . 0.0 110.763 -178.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.581 HD13 ' HB3' ' A' ' 45' ' ' LYS . 0.9 OUTLIER -88.69 -30.21 19.29 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 120.929 -1.107 . . . . 0.0 110.37 -178.945 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.6 -29.67 68.14 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.305 -0.872 . . . . 0.0 109.504 -179.516 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -86.29 -26.37 24.98 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.335 -0.853 . . . . 0.0 109.211 179.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.31 -30.57 69.59 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.236 -0.915 . . . . 0.0 109.316 179.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 121.19 -28.99 5.88 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.779 -1.328 . . . . 0.0 109.779 179.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.557 HD13 HG21 ' A' ' 48' ' ' ILE . 26.8 mt -48.87 110.51 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.153 -1.204 . . . . 0.0 109.485 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -105.99 -7.12 18.28 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.213 -0.929 . . . . 0.0 109.4 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -48.12 118.62 2.47 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.25 -0.906 . . . . 0.0 109.182 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.505 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 0.3 OUTLIER -80.05 6.45 11.46 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.336 -0.853 . . . . 0.0 109.644 -179.868 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.442 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 20.4 t80 -78.85 -22.58 45.89 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.107 -0.996 . . . . 0.0 109.462 -179.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.863 ' CE2' HG23 ' A' ' 48' ' ' ILE . 22.6 m-85 -94.75 -45.2 7.44 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.179 -0.95 . . . . 0.0 108.821 179.464 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.748 ' CE1' HG23 ' A' ' 15' ' ' ILE . 14.4 m-85 -61.03 -50.95 71.26 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 179.08 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.505 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 1.9 t30 -60.34 -31.32 70.2 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.419 -0.801 . . . . 0.0 108.901 179.615 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.04 -22.08 53.52 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.453 -0.779 . . . . 0.0 109.682 -179.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.714 HD11 ' HG2' ' A' ' 45' ' ' LYS . 0.8 OUTLIER -68.28 -34.09 64.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.212 -0.93 . . . . 0.0 108.837 179.914 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -75.91 -4.54 41.49 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.213 -0.929 . . . . 0.0 109.021 179.366 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.448 ' O ' ' C ' ' A' ' 35' ' ' ALA . 6.5 mmmt -108.83 -17.78 13.85 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.212 -0.93 . . . . 0.0 109.531 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.538 ' HB2' HD12 ' A' ' 44' ' ' LEU . . . -38.45 154.82 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.71 -0.619 . . . . 0.0 110.127 -179.711 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.408 ' CE ' ' HA ' ' A' ' 36' ' ' LYS . 0.5 OUTLIER -87.74 -73.09 0.49 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.295 -0.878 . . . . 0.0 109.954 -179.791 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.668 ' O ' HG23 ' A' ' 41' ' ' VAL . 0.8 OUTLIER -105.89 -177.38 3.35 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.152 -0.968 . . . . 0.0 109.365 -179.741 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.816 HG22 ' ND2' ' A' ' 9' ' ' ASN . 92.4 t -67.44 -30.05 47.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.134 -0.979 . . . . 0.0 109.028 179.649 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.56 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 3.0 pt-20 -71.33 -25.29 62.34 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 178.254 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.532 ' N ' ' HG3' ' A' ' 39' ' ' GLU . 4.5 mm-40 -80.97 -30.74 35.05 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 178.592 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.668 HG23 ' O ' ' A' ' 37' ' ' THR . 48.7 t -67.41 -61.16 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 179.038 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 58.1 m-80 -62.05 -29.4 70.27 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.589 -0.695 . . . . 0.0 109.306 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.56 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -71.17 -29.4 65.15 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.259 -0.901 . . . . 0.0 109.497 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.538 HD12 ' HB2' ' A' ' 35' ' ' ALA . 7.4 mt -75.1 -47.94 26.23 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.117 -0.989 . . . . 0.0 110.947 -179.228 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.714 ' HG2' HD11 ' A' ' 32' ' ' ILE . 0.3 OUTLIER -75.29 -43.45 51.09 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.861 -1.15 . . . . 0.0 110.081 -178.888 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -68.32 -21.08 64.77 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.029 -1.045 . . . . 0.0 109.436 179.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.481 ' HG2' ' HB2' ' A' ' 51' ' ' ALA . 14.6 tt0 -79.79 -7.11 58.47 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.176 -0.952 . . . . 0.0 109.674 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.91 HG22 ' CD2' ' A' ' 52' ' ' HIS . 83.3 mt -68.95 -41.67 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 178.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 49' ' ' LEU . 12.7 mt -47.32 -32.33 4.66 Favored 'General case' 0 C--N 1.302 -1.472 0 C-N-CA 119.688 -0.805 . . . . 0.0 109.435 179.613 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.7 mttm -115.66 -3.61 12.28 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.977 -1.077 . . . . 0.0 110.177 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.481 ' HB2' ' HG2' ' A' ' 47' ' ' GLU . . . -100.58 -2.55 32.58 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.126 -0.984 . . . . 0.0 109.218 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.91 ' CD2' HG22 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -160.89 -164.97 1.28 Allowed 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.343 -0.848 . . . . 0.0 108.957 -179.614 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.604 ' N ' ' CG ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.49 1.542 0 O-C-N 121.11 -0.994 . . . . 0.0 109.277 -179.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.848 HD21 HG22 ' A' ' 38' ' ' VAL . 4.5 p30 . . . . . 0 N--CA 1.486 1.358 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.424 ' N ' ' CG ' ' A' ' 9' ' ' ASN . . . -81.56 -11.82 59.01 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 178.041 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.547 ' O ' HD12 ' A' ' 15' ' ' ILE . 1.3 ttpt -43.82 -64.22 0.7 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.459 -0.776 . . . . 0.0 110.926 -179.424 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -95.95 -22.83 17.16 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.895 -1.128 . . . . 0.0 111.18 -178.428 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -61.28 -28.78 69.43 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.794 -1.191 . . . . 0.0 109.876 -179.469 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.615 ' O ' HD23 ' A' ' 18' ' ' LEU . . . -96.65 -43.62 7.48 Favored 'General case' 0 C--N 1.301 -1.5 0 O-C-N 121.096 -1.003 . . . . 0.0 108.853 179.549 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.641 HG23 ' CE1' ' A' ' 29' ' ' PHE . 88.0 mt -54.31 -28.72 18.69 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 O-C-N 121.66 -0.65 . . . . 0.0 109.705 179.815 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.483 ' HA ' ' CE ' ' A' ' 19' ' ' LYS . . . -64.06 -37.51 87.71 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.42 -0.8 . . . . 0.0 109.639 -179.03 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.574 ' O ' ' HB2' ' A' ' 21' ' ' ALA . 0.5 OUTLIER -86.86 9.6 18.7 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.386 -0.822 . . . . 0.0 109.913 -179.48 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.615 HD23 ' O ' ' A' ' 14' ' ' ALA . 0.5 OUTLIER -101.04 -47.93 4.59 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.249 -0.907 . . . . 0.0 109.627 -179.766 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.483 ' CE ' ' HA ' ' A' ' 16' ' ' ALA . 2.1 ptpt -59.43 -28.76 67.24 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.457 -0.777 . . . . 0.0 109.345 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.06 -16.79 23.5 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.41 -0.807 . . . . 0.0 108.966 179.664 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . 0.574 ' HB2' ' O ' ' A' ' 17' ' ' GLU . . . -69.09 -29.92 68.11 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.334 -0.854 . . . . 0.0 109.532 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 126.87 -12.76 6.85 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.768 -1.333 . . . . 0.0 109.768 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.651 HD12 HG21 ' A' ' 48' ' ' ILE . 0.2 OUTLIER -101.97 123.05 54.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.101 -1.235 . . . . 0.0 109.696 -179.792 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -122.89 28.62 7.16 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.3 -0.875 . . . . 0.0 108.986 179.468 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.98 177.81 2.48 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.363 -0.836 . . . . 0.0 109.64 -179.748 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.476 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 9.0 m-20 -122.22 0.78 9.62 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.26 -0.9 . . . . 0.0 109.659 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.591 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 2.3 t80 -81.15 -40.41 24.02 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.159 -0.963 . . . . 0.0 109.569 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.605 ' CE2' HG23 ' A' ' 48' ' ' ILE . 21.5 m-85 -78.34 -31.05 48.42 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.351 -0.843 . . . . 0.0 110.198 -179.008 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.641 ' CE1' HG23 ' A' ' 15' ' ' ILE . 6.7 m-30 -75.53 -49.24 19.27 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.282 -0.886 . . . . 0.0 109.924 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.476 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 0.4 OUTLIER -59.37 -25.65 64.42 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.156 -0.965 . . . . 0.0 110.175 -179.504 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -87.15 -16.18 36.19 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.97 -1.081 . . . . 0.0 110.44 -179.029 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 1.036 HD11 ' HD2' ' A' ' 45' ' ' LYS . 0.6 OUTLIER -64.8 -38.16 82.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.096 -1.002 . . . . 0.0 109.873 -179.596 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 45.9 p-10 -79.74 -8.65 59.37 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.023 -1.048 . . . . 0.0 110.348 -179.238 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.437 ' O ' ' C ' ' A' ' 35' ' ' ALA . 3.5 mtmt -99.64 -17.16 17.93 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.962 -1.086 . . . . 0.0 109.976 -179.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.737 ' HB3' HG22 ' A' ' 41' ' ' VAL . . . -43.14 154.54 0.07 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.23 -0.919 . . . . 0.0 109.554 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.502 ' HB2' ' HG3' ' A' ' 40' ' ' GLU . 0.1 OUTLIER -73.09 -59.49 2.68 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.077 -1.014 . . . . 0.0 109.634 -179.775 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.859 ' O ' HG23 ' A' ' 41' ' ' VAL . 70.2 p -124.01 -167.0 1.57 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.09 -1.006 . . . . 0.0 109.754 -179.834 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.848 HG22 HD21 ' A' ' 9' ' ' ASN . 16.0 t -66.63 -52.09 49.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.406 -0.809 . . . . 0.0 109.587 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.765 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 11.7 pt-20 -52.36 -26.51 12.55 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 179.597 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.502 ' HG3' ' HB2' ' A' ' 36' ' ' LYS . 27.6 mm-40 -80.45 -35.6 34.7 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.321 -0.862 . . . . 0.0 108.763 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.859 HG23 ' O ' ' A' ' 37' ' ' THR . 7.0 t -67.88 -66.88 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 179.051 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -53.85 -28.6 36.9 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.565 -0.709 . . . . 0.0 109.375 179.391 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.765 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -66.88 -46.18 75.77 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.287 -0.883 . . . . 0.0 109.605 -179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.1 mt -57.85 -37.14 73.34 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.244 -0.91 . . . . 0.0 109.985 -179.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 1.036 ' HD2' HD11 ' A' ' 32' ' ' ILE . 0.2 OUTLIER -63.4 -34.01 76.79 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.087 -1.008 . . . . 0.0 109.5 -179.847 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 8.4 m-20 -77.77 -30.23 51.31 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.196 -0.94 . . . . 0.0 109.504 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -57.09 -23.33 46.14 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.338 -0.851 . . . . 0.0 109.165 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.651 HG21 HD12 ' A' ' 23' ' ' ILE . 41.4 mt -66.64 -45.7 87.78 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 179.518 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.443 HD12 ' HA ' ' A' ' 49' ' ' LEU . 1.2 mp -48.17 -36.78 14.22 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.178 -0.951 . . . . 0.0 108.558 179.046 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.6 mttt -90.53 -80.78 0.32 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.42 -0.8 . . . . 0.0 108.917 179.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.499 ' O ' ' HB3' ' A' ' 52' ' ' HIS . . . -54.81 151.57 8.32 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 178.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.557 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 0.5 OUTLIER 64.95 165.7 0.16 Allowed 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.658 -1.276 . . . . 0.0 107.784 -179.276 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.557 ' HB3' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 118.045 -0.979 . . . . 0.0 109.414 -179.559 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.53 ' ND2' ' N ' ' A' ' 9' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.664 0 CA-C-O 121.017 0.436 . . . . 0.0 110.061 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.604 ' CB ' HG13 ' A' ' 38' ' ' VAL . . . -55.77 -16.82 4.87 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 120.979 -1.076 . . . . 0.0 109.619 -179.883 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.543 ' HG2' HG21 ' A' ' 32' ' ' ILE . 2.5 tttp -40.85 -35.47 0.51 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.196 -0.94 . . . . 0.0 110.241 -179.734 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -88.07 -32.6 18.65 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.109 -0.994 . . . . 0.0 110.038 -179.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.82 -56.23 21.57 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.154 -0.966 . . . . 0.0 109.399 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.461 ' HB1' ' HG2' ' A' ' 45' ' ' LYS . . . -62.68 -55.7 24.47 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.294 -0.879 . . . . 0.0 110.149 -179.774 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.777 ' CG1' HD13 ' A' ' 32' ' ' ILE . 73.0 mt -53.41 -30.85 18.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.151 -0.968 . . . . 0.0 109.48 -179.819 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.29 -38.73 88.44 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.462 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 2.4 pt-20 -83.57 1.88 39.94 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 109.111 -0.699 . . . . 0.0 109.111 179.634 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.702 HD13 ' O ' ' A' ' 18' ' ' LEU . 1.1 tm? -97.86 -53.64 3.34 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.286 -0.884 . . . . 0.0 109.377 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.425 ' O ' ' HG2' ' A' ' 19' ' ' LYS . 5.7 ttmt -56.71 -18.2 11.6 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.32 -0.863 . . . . 0.0 109.294 -179.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.4 ttmt -96.16 -26.15 15.57 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.315 -0.865 . . . . 0.0 109.264 179.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.33 -49.74 75.18 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.257 -0.902 . . . . 0.0 109.557 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 138.86 -3.57 2.86 Favored Glycine 0 N--CA 1.49 2.236 0 C-N-CA 119.665 -1.255 . . . . 0.0 110.133 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.649 HG21 ' CE1' ' A' ' 52' ' ' HIS . 0.0 OUTLIER -100.18 149.26 6.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 120.867 -1.372 . . . . 0.0 109.574 179.846 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -133.23 11.58 4.19 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.432 -0.792 . . . . 0.0 109.234 179.755 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.34 139.88 58.53 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.234 -0.916 . . . . 0.0 109.447 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.401 ' N ' ' OD1' ' A' ' 26' ' ' ASP . 1.3 m-20 -87.64 6.07 36.45 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.313 -0.867 . . . . 0.0 109.784 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.688 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 8.3 t80 -80.26 -17.23 52.78 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.119 -0.988 . . . . 0.0 109.321 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.826 ' HB3' HD11 ' A' ' 48' ' ' ILE . 18.1 m-85 -101.36 -28.46 12.59 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.226 -0.921 . . . . 0.0 109.12 179.687 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 0.844 ' HA ' HD12 ' A' ' 32' ' ' ILE . 9.5 m-85 -83.07 -47.05 12.08 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.474 -0.766 . . . . 0.0 109.193 179.536 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 40.7 m-20 -60.78 -36.63 79.48 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.479 -0.763 . . . . 0.0 109.406 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.6 -13.7 59.84 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.342 -0.849 . . . . 0.0 109.691 -179.55 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.844 HD12 ' HA ' ' A' ' 29' ' ' PHE . 4.3 mt -68.01 -48.61 73.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.268 -0.895 . . . . 0.0 109.351 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.52 ' HB2' ' CE ' ' A' ' 11' ' ' LYS . 8.4 t30 -64.92 -22.53 67.01 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.218 -0.926 . . . . 0.0 109.624 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.473 ' O ' ' O ' ' A' ' 35' ' ' ALA . 5.7 mptp? -96.54 -14.71 22.07 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.178 -0.951 . . . . 0.0 109.744 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.907 ' HB3' HG22 ' A' ' 41' ' ' VAL . . . -43.61 168.68 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.315 -0.865 . . . . 0.0 109.795 -179.67 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.4 ' HB2' ' HG2' ' A' ' 40' ' ' GLU . 1.7 tttm -77.3 -78.73 0.12 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.211 -0.931 . . . . 0.0 109.582 -179.965 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.961 ' O ' HG23 ' A' ' 41' ' ' VAL . 14.8 t -121.54 -174.34 2.84 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.233 -0.917 . . . . 0.0 108.868 179.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.604 HG13 ' CB ' ' A' ' 10' ' ' ALA . 24.9 t -59.79 -57.31 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.105 -0.997 . . . . 0.0 109.436 179.828 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.556 ' O ' ' CB ' ' A' ' 43' ' ' ALA . 73.2 mm-40 -51.37 -19.51 1.36 Allowed 'General case' 0 C--N 1.295 -1.797 0 O-C-N 120.974 -1.079 . . . . 0.0 109.414 -179.639 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.495 ' HA ' ' OE1' ' A' ' 40' ' ' GLU . 4.6 tp10 -90.5 -33.24 16.02 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.924 -1.11 . . . . 0.0 109.181 179.596 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.961 HG23 ' O ' ' A' ' 37' ' ' THR . 2.2 t -76.7 -66.27 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.456 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 178.372 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.407 ' OD1' ' C ' ' A' ' 42' ' ' ASN . 0.0 OUTLIER -46.94 -40.73 14.82 Favored 'General case' 0 C--N 1.296 -1.738 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.19 178.317 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.556 ' CB ' ' O ' ' A' ' 39' ' ' GLU . . . -68.49 -37.37 80.05 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.263 -0.898 . . . . 0.0 109.748 179.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.726 ' O ' HD12 ' A' ' 44' ' ' LEU . 0.3 OUTLIER -65.28 -30.56 71.44 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.152 -0.967 . . . . 0.0 109.051 -179.916 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.794 ' CE ' HD11 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -63.39 -43.94 96.13 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.179 -0.95 . . . . 0.0 109.181 179.641 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -75.76 -13.93 60.31 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.426 -0.796 . . . . 0.0 109.537 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -79.7 -28.33 40.64 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.29 -0.881 . . . . 0.0 109.716 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.826 HD11 ' HB3' ' A' ' 28' ' ' TYR . 14.4 mt -56.15 -41.61 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.115 -0.991 . . . . 0.0 108.725 179.429 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 49' ' ' LEU . 89.7 mt -45.24 -36.1 3.74 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.31 -0.869 . . . . 0.0 109.978 179.722 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.4 mttt -117.68 2.17 12.27 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.985 -1.072 . . . . 0.0 110.789 -179.361 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -100.83 -7.74 23.29 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.98 -1.075 . . . . 0.0 109.503 179.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.649 ' CE1' HG21 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -145.13 8.74 1.23 Allowed 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.153 -0.967 . . . . 0.0 110.232 -178.822 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.522 0 CA-C-O 117.95 -1.024 . . . . 0.0 109.449 -179.94 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.577 ' ND2' HG22 ' A' ' 38' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.494 1.735 0 CA-C-O 121.284 0.564 . . . . 0.0 110.995 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.459 ' O ' ' C ' ' A' ' 11' ' ' LYS . . . -54.93 -13.2 1.01 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.181 -0.949 . . . . 0.0 111.037 -179.076 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.743 ' O ' HD12 ' A' ' 15' ' ' ILE . 0.0 OUTLIER -36.9 -43.01 0.42 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.231 -0.918 . . . . 0.0 110.982 -179.407 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -100.63 -21.07 15.37 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.888 -1.132 . . . . 0.0 110.28 -179.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -69.21 -15.95 63.5 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.044 -1.035 . . . . 0.0 109.454 -179.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -105.75 -40.61 5.68 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.346 -0.846 . . . . 0.0 108.927 179.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 1.125 HG23 ' CZ ' ' A' ' 29' ' ' PHE . 55.2 mt -62.81 -28.6 45.27 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 O-C-N 121.494 -0.754 . . . . 0.0 109.17 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.5 -22.67 22.1 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.404 -0.81 . . . . 0.0 109.675 -179.466 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -85.26 -28.06 25.6 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.377 -0.827 . . . . 0.0 110.343 -179.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.524 ' CD1' ' HE2' ' A' ' 45' ' ' LYS . 2.2 mt -84.25 -32.33 24.51 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.14 -0.975 . . . . 0.0 110.693 -178.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -56.5 -21.64 27.36 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 120.97 -1.081 . . . . 0.0 109.736 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 6.5 tttm -100.9 -29.46 12.2 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.21 -0.931 . . . . 0.0 110.038 -179.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -69.14 -33.32 73.25 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.136 -0.978 . . . . 0.0 109.741 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 124.81 -26.58 5.62 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.356 -1.497 . . . . 0.0 109.356 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . 0.552 HG12 ' CE1' ' A' ' 52' ' ' HIS . 62.0 mt -66.2 106.44 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.368 -1.077 . . . . 0.0 109.393 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 9.6 p -128.99 17.67 6.15 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.085 -1.009 . . . . 0.0 109.56 -179.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 65.6 m -65.62 152.63 43.69 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.255 -0.903 . . . . 0.0 109.242 179.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.458 ' O ' ' CB ' ' A' ' 30' ' ' ASN . 7.9 m-20 -87.21 -3.08 59.03 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.189 -0.944 . . . . 0.0 109.787 -179.765 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.722 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 18.0 t80 -80.08 -7.5 58.91 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.155 -0.966 . . . . 0.0 109.269 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.915 ' O ' HD13 ' A' ' 32' ' ' ILE . 37.8 m-85 -118.49 -34.78 3.92 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 179.308 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' PHE . . . . . 1.125 ' CZ ' HG23 ' A' ' 15' ' ' ILE . 6.1 m-30 -78.58 -40.9 33.37 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 178.838 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.458 ' CB ' ' O ' ' A' ' 26' ' ' ASP . 19.8 t30 -68.62 -49.61 57.87 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.465 -0.772 . . . . 0.0 108.966 179.527 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . 0.407 ' HA ' ' HB2' ' A' ' 34' ' ' LYS . . . -69.06 -12.85 62.06 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.495 -0.753 . . . . 0.0 109.603 -179.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ILE . . . . . 0.915 HD13 ' O ' ' A' ' 28' ' ' TYR . 0.7 OUTLIER -73.7 -50.52 29.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.262 -0.899 . . . . 0.0 108.961 179.839 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASN . . . . . 0.53 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 17.2 p30 -79.7 -10.93 59.86 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.242 -0.911 . . . . 0.0 109.366 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.479 ' O ' ' O ' ' A' ' 35' ' ' ALA . 7.8 mmtt -91.29 -14.83 30.13 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.344 -0.848 . . . . 0.0 109.654 -179.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.479 ' O ' ' O ' ' A' ' 34' ' ' LYS . . . -55.09 -160.74 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.527 -0.733 . . . . 0.0 110.198 -179.517 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 27.8 mmtp -101.79 -62.87 1.2 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.103 -0.998 . . . . 0.0 110.401 -179.293 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.508 ' O ' HG23 ' A' ' 41' ' ' VAL . 66.6 p -125.86 178.02 5.97 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.945 -1.097 . . . . 0.0 110.082 -179.415 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.577 HG22 ' ND2' ' A' ' 9' ' ' ASN . 88.6 t -61.39 -34.46 61.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.331 -0.856 . . . . 0.0 109.331 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.13 -27.39 69.05 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 178.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.441 ' HG2' ' HB1' ' A' ' 35' ' ' ALA . 0.9 OUTLIER -79.58 -31.27 41.83 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.662 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.508 HG23 ' O ' ' A' ' 37' ' ' THR . 18.6 t -68.32 -67.53 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 178.796 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -49.56 -39.37 34.61 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.429 -0.794 . . . . 0.0 109.468 179.496 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.9 -38.96 93.01 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.294 -0.879 . . . . 0.0 109.619 -179.671 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.424 ' O ' HD12 ' A' ' 48' ' ' ILE . 7.6 mt -66.85 -46.61 74.54 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.282 -0.887 . . . . 0.0 110.258 -179.531 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.652 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.2 OUTLIER -65.61 -19.65 66.0 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.037 -1.04 . . . . 0.0 110.23 -179.243 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -79.84 -18.23 51.29 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.054 -1.029 . . . . 0.0 109.566 -179.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.539 ' O ' ' CB ' ' A' ' 51' ' ' ALA . 55.7 tt0 -90.76 -17.74 26.14 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.186 -0.946 . . . . 0.0 109.172 179.669 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.677 ' CG1' ' CD1' ' A' ' 28' ' ' TYR . 1.4 mt -68.6 -35.43 70.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.252 -0.905 . . . . 0.0 108.91 179.478 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 49' ' ' LEU . 14.5 tp -56.4 -30.05 62.29 Favored 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.162 -0.961 . . . . 0.0 109.324 179.646 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.419 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -122.28 5.87 9.68 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.197 -0.939 . . . . 0.0 109.889 -179.894 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . 0.539 ' CB ' ' O ' ' A' ' 47' ' ' GLU . . . -101.39 -46.62 4.95 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.092 -1.005 . . . . 0.0 109.466 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.6 ' HB3' ' OH ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -112.66 -19.5 12.03 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.447 -0.783 . . . . 0.0 109.661 -178.975 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.486 ' N ' ' CD2' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.489 1.512 0 CA-C-O 118.012 -0.994 . . . . 0.0 109.42 179.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.592 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.404 ' O ' HG22 ' A' ' 2' ' ' ILE . 25.5 mt -137.1 46.27 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 O-C-N 121.213 -0.929 . . . . 0.0 109.47 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.73 -26.48 68.39 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.155 -0.966 . . . . 0.0 108.43 179.512 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -50.71 -23.94 3.03 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.557 -0.715 . . . . 0.0 109.229 179.271 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.511 ' O ' ' N ' ' A' ' 7' ' ' LEU . 1.7 t90 -44.52 -62.94 1.01 Allowed 'General case' 0 C--N 1.305 -1.34 0 O-C-N 121.503 -0.748 . . . . 0.0 111.091 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.873 HD13 ' O ' ' A' ' 6' ' ' LEU . 3.4 tm? -30.47 -38.51 0.02 OUTLIER 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.932 -0.48 . . . . 0.0 110.541 -178.637 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.8 HD21 ' CG2' ' A' ' 41' ' ' VAL . 4.5 tp 69.94 -122.78 0.12 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.281 -0.887 . . . . 0.0 109.755 179.22 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.513 ' HB2' ' CD1' ' A' ' 6' ' ' LEU . 0.6 OUTLIER 66.4 36.13 5.36 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.802 -1.186 . . . . 0.0 109.6 -179.814 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.468 ' ND2' ' HG ' ' A' ' 7' ' ' LEU . 1.8 p30 -131.28 -49.2 1.0 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.273 -0.892 . . . . 0.0 109.87 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.455 ' HB3' HG21 ' A' ' 41' ' ' VAL . . . -80.43 -15.37 56.95 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.1 -1.0 . . . . 0.0 109.501 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.608 ' O ' HD12 ' A' ' 15' ' ' ILE . 0.1 OUTLIER -63.44 -32.6 74.09 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.271 -0.893 . . . . 0.0 109.91 -179.44 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.474 ' HG2' ' CE ' ' A' ' 11' ' ' LYS . 3.8 mm-40 -92.36 -44.12 8.88 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.865 -1.147 . . . . 0.0 109.627 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -65.94 -18.71 65.52 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.132 -0.98 . . . . 0.0 109.696 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.53 ' HB1' HD11 ' A' ' 18' ' ' LEU . . . -99.0 -43.83 6.54 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.313 -0.867 . . . . 0.0 109.262 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.608 HD12 ' O ' ' A' ' 11' ' ' LYS . 58.6 mt -62.83 -29.04 46.14 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.529 0 O-C-N 121.491 -0.756 . . . . 0.0 109.371 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.04 -15.55 63.65 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.499 -0.75 . . . . 0.0 110.342 -178.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 17' ' ' GLU . 32.7 tt0 -116.98 -14.41 10.62 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.074 -1.016 . . . . 0.0 109.857 -179.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.623 HD22 ' HG2' ' A' ' 45' ' ' LYS . 5.7 mt -90.21 -33.0 16.35 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.111 -0.993 . . . . 0.0 109.459 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 6.1 ptmm? -56.84 -19.54 17.98 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.14 -0.975 . . . . 0.0 108.702 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -86.95 -31.22 20.76 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.466 -0.771 . . . . 0.0 108.973 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -54.65 -20.25 7.76 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.387 -0.821 . . . . 0.0 109.389 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 116.14 -39.16 2.8 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.42 -1.472 . . . . 0.0 109.42 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.965 HD13 HG21 ' A' ' 48' ' ' ILE . 13.0 mt -54.03 107.89 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.224 -1.162 . . . . 0.0 109.332 -179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -115.2 7.51 15.32 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.259 -0.901 . . . . 0.0 109.629 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.3 t -59.95 152.98 22.29 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.15 -0.969 . . . . 0.0 109.265 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.498 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 9.4 p-10 -100.46 -9.13 22.45 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.238 -0.914 . . . . 0.0 109.578 -179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.538 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 15.1 t80 -74.83 -24.45 58.61 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.078 -1.014 . . . . 0.0 109.583 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.639 ' CG ' ' CG1' ' A' ' 48' ' ' ILE . 23.6 m-85 -94.95 -42.39 8.68 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.217 -0.927 . . . . 0.0 109.171 179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.579 ' CD1' HG12 ' A' ' 15' ' ' ILE . 5.3 m-85 -62.81 -45.87 90.59 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 121.54 -0.725 . . . . 0.0 109.734 179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.498 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 0.4 OUTLIER -65.78 -39.55 91.1 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.13 -0.981 . . . . 0.0 109.626 -179.844 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.6 -10.73 60.21 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.206 -0.934 . . . . 0.0 109.519 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.541 HD11 ' CD ' ' A' ' 45' ' ' LYS . 0.3 OUTLIER -65.94 -24.36 33.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 O-C-N 121.399 -0.813 . . . . 0.0 109.071 -179.869 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 13.8 m-20 -80.51 -37.61 31.31 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.315 -0.865 . . . . 0.0 109.764 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -57.88 -20.44 36.8 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.259 -0.901 . . . . 0.0 109.438 -179.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.72 ' HB3' HG22 ' A' ' 41' ' ' VAL . . . -47.13 155.93 0.26 Allowed 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.248 -0.908 . . . . 0.0 109.343 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.494 ' CD ' ' N ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -90.94 -55.3 3.61 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.323 -0.861 . . . . 0.0 109.382 -179.967 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.625 HG23 ' H ' ' A' ' 39' ' ' GLU . 13.7 t -125.02 -175.79 3.39 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.244 -0.91 . . . . 0.0 109.466 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 95.9 t -63.21 -30.32 49.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.049 -1.032 . . . . 0.0 109.267 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.807 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 1.9 tt0 -72.14 -21.7 61.42 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 179.456 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.591 ' HG2' HG22 ' A' ' 37' ' ' THR . 37.6 mm-40 -86.48 -31.09 21.52 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 179.39 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.8 ' CG2' HD21 ' A' ' 7' ' ' LEU . 24.5 t -72.72 -56.68 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 179.108 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 65.8 m-20 -62.86 -27.93 69.68 Favored 'General case' 0 N--CA 1.488 1.447 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 178.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.807 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -66.87 -46.74 74.01 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.485 -0.76 . . . . 0.0 109.448 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.706 ' O ' HD12 ' A' ' 48' ' ' ILE . 2.1 mt -59.2 -35.15 73.1 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.233 -0.917 . . . . 0.0 108.87 179.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.714 ' HA ' HD13 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -62.0 -40.48 95.8 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.321 -0.862 . . . . 0.0 108.973 179.494 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.481 ' O ' ' HB2' ' A' ' 49' ' ' LEU . 75.1 m-20 -65.9 -20.69 66.31 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.315 -0.865 . . . . 0.0 109.04 179.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.07 -36.31 61.77 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.298 -0.876 . . . . 0.0 109.659 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.965 HG21 HD13 ' A' ' 23' ' ' ILE . 3.7 mp -58.47 -27.41 33.39 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 O-C-N 120.959 -1.088 . . . . 0.0 108.376 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.481 ' HB2' ' O ' ' A' ' 46' ' ' ASN . 2.5 mm? -56.07 -39.0 71.42 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.435 -0.79 . . . . 0.0 109.072 179.189 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.429 ' O ' ' C ' ' A' ' 51' ' ' ALA . 0.0 OUTLIER -109.63 -62.24 1.53 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.212 -0.93 . . . . 0.0 109.818 -179.401 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.429 ' C ' ' O ' ' A' ' 50' ' ' LYS . . . -41.23 -37.81 1.01 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.295 -0.878 . . . . 0.0 109.966 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.713 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 0.0 OUTLIER -115.62 129.07 56.37 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.349 -0.845 . . . . 0.0 109.083 -179.547 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.713 ' HB3' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 118.068 -0.968 . . . . 0.0 109.307 -179.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 17.7 p . . . . . 0 N--CA 1.49 1.551 0 CA-C-O 121.367 0.603 . . . . 0.0 109.462 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -114.84 49.46 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.332 -0.855 . . . . 0.0 109.339 179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -72.11 -4.5 29.38 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.231 -0.918 . . . . 0.0 109.072 179.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.471 ' O ' ' O ' ' A' ' 5' ' ' TRP . 0.4 OUTLIER -63.66 -9.45 13.94 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 121.397 -0.814 . . . . 0.0 109.842 -179.978 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.482 ' O ' ' N ' ' A' ' 7' ' ' LEU . 1.7 t90 -52.67 -105.45 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.226 -0.921 . . . . 0.0 109.879 -179.806 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.516 HD23 ' HA ' ' A' ' 6' ' ' LEU . 4.0 mt 41.04 23.92 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.666 -1.272 . . . . 0.0 110.869 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.903 HD11 HG21 ' A' ' 41' ' ' VAL . 0.1 OUTLIER 72.9 -16.11 0.48 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 120.879 -1.138 . . . . 0.0 110.921 179.463 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.41 ' CD ' ' HD2' ' A' ' 11' ' ' LYS . 0.3 OUTLIER -61.21 88.96 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.509 0 O-C-N 120.569 -1.332 . . . . 0.0 109.679 -179.58 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.809 ' ND2' HG22 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -143.0 -65.12 0.4 Allowed 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 107.776 -1.194 . . . . 0.0 107.776 179.431 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.51 -6.92 58.92 Favored 'General case' 0 C--N 1.304 -1.397 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 178.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.418 ' HE2' ' CG ' ' A' ' 33' ' ' ASN . 13.6 tttm -61.31 -35.71 78.11 Favored 'General case' 0 N--CA 1.485 1.314 0 O-C-N 121.614 -0.678 . . . . 0.0 109.985 -179.666 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -89.25 -51.3 5.64 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.05 -1.031 . . . . 0.0 109.115 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -53.97 -21.72 8.72 Favored 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 179.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.566 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -89.51 -59.16 2.28 Favored 'General case' 0 C--N 1.306 -1.317 0 O-C-N 121.558 -0.714 . . . . 0.0 109.14 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.497 ' HA ' ' HG ' ' A' ' 18' ' ' LEU . 0.2 OUTLIER -41.09 -36.98 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.81 0 O-C-N 121.52 -0.737 . . . . 0.0 109.392 179.978 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -63.22 -48.68 77.26 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.385 -0.968 . . . . 0.0 108.385 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.587 ' C ' HD23 ' A' ' 18' ' ' LEU . 3.7 mm-40 -73.27 -12.68 60.94 Favored 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.834 -0.541 . . . . 0.0 110.79 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.838 HD23 ' N ' ' A' ' 18' ' ' LEU . 1.0 OUTLIER -88.43 -32.56 18.24 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.637 -1.29 . . . . 0.0 109.694 -179.307 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -71.29 -17.11 62.48 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.185 -0.947 . . . . 0.0 109.339 -179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.431 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 1.0 OUTLIER -96.55 -22.36 17.12 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.232 -0.918 . . . . 0.0 109.548 -179.873 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.17 -26.68 66.77 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.218 -0.926 . . . . 0.0 109.411 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 112.66 -23.78 14.52 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.48 HD12 ' NZ ' ' A' ' 45' ' ' LYS . 31.7 mt -75.09 92.57 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.288 -1.125 . . . . 0.0 109.735 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.1 p -95.66 5.5 51.28 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.126 -0.984 . . . . 0.0 109.127 179.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 2.7 t -57.18 138.34 54.75 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.318 -0.864 . . . . 0.0 109.025 179.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.472 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 5.0 m-20 -91.78 -5.77 52.93 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.218 -0.927 . . . . 0.0 109.816 -179.581 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.653 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 2.1 t80 -74.09 -16.27 61.03 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.129 -0.982 . . . . 0.0 108.591 179.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.989 ' CE2' HG23 ' A' ' 48' ' ' ILE . 21.7 m-85 -103.99 -50.15 3.45 Favored 'General case' 0 C--N 1.298 -1.667 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 179.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.65 ' CZ ' ' CB ' ' A' ' 18' ' ' LEU . 3.1 m-85 -55.89 -45.35 78.64 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.472 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 8.3 m120 -60.82 -43.97 97.51 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.251 -0.906 . . . . 0.0 109.091 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.67 -13.75 61.04 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.441 -0.787 . . . . 0.0 109.626 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.605 ' HA ' HD13 ' A' ' 44' ' ' LEU . 4.5 mt -71.15 -40.32 74.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.297 -0.877 . . . . 0.0 108.898 179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.418 ' CG ' ' HE2' ' A' ' 11' ' ' LYS . 0.9 OUTLIER -76.5 -19.62 57.8 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.205 -0.934 . . . . 0.0 109.317 179.787 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.462 ' O ' ' O ' ' A' ' 35' ' ' ALA . 2.5 mtpt -75.33 -15.66 60.47 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.391 -0.818 . . . . 0.0 109.61 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.851 ' HB1' ' HB3' ' A' ' 40' ' ' GLU . . . -40.39 162.64 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.461 -0.774 . . . . 0.0 109.882 -179.789 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.402 ' O ' HG23 ' A' ' 37' ' ' THR . 3.4 tttm -101.89 -19.86 15.1 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.424 -0.797 . . . . 0.0 109.021 179.66 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.81 ' O ' HG23 ' A' ' 41' ' ' VAL . 11.2 p -153.2 -179.76 8.0 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.446 -0.784 . . . . 0.0 109.04 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.809 HG22 ' ND2' ' A' ' 9' ' ' ASN . 18.7 t -65.04 -38.48 82.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 O-C-N 121.1 -1.0 . . . . 0.0 108.912 179.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.714 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 29.2 mt-10 -64.68 -28.49 69.64 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.254 -0.904 . . . . 0.0 108.782 179.332 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.851 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 0.3 OUTLIER -79.48 -31.18 42.29 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 108.774 -0.824 . . . . 0.0 108.774 179.485 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.903 HG21 HD11 ' A' ' 7' ' ' LEU . 12.5 t -70.49 -65.26 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 178.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 83.7 m-20 -55.7 -33.34 64.11 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.596 -0.69 . . . . 0.0 109.34 179.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.714 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -61.2 -42.25 98.26 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.321 -0.862 . . . . 0.0 109.242 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.605 HD13 ' HA ' ' A' ' 32' ' ' ILE . 0.4 OUTLIER -57.74 -50.18 74.08 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.225 -0.922 . . . . 0.0 110.04 -179.62 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.736 ' CE ' HD22 ' A' ' 18' ' ' LEU . 10.4 tptp -50.02 -29.67 9.16 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.041 -1.037 . . . . 0.0 110.499 -179.367 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 36.5 m-20 -80.02 -46.79 15.98 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.026 -1.046 . . . . 0.0 110.21 -179.236 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -54.52 -28.4 45.04 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.086 -1.009 . . . . 0.0 110.01 -179.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.989 HG23 ' CE2' ' A' ' 28' ' ' TYR . 21.1 mt -60.37 -44.38 95.88 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.546 0 O-C-N 121.016 -1.052 . . . . 0.0 109.237 179.605 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.908 ' HA ' ' HB3' ' A' ' 53' ' ' ALA . 1.0 OUTLIER -56.23 -19.06 12.27 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.536 -0.727 . . . . 0.0 110.449 -179.411 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.1 -58.41 1.89 Allowed 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.801 -1.187 . . . . 0.0 110.774 -179.102 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.497 ' O ' ' CB ' ' A' ' 52' ' ' HIS . . . -82.67 46.45 1.08 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.315 -0.865 . . . . 0.0 110.293 -179.014 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.543 ' CG ' ' N ' ' A' ' 53' ' ' ALA . 3.7 t-80 170.22 -81.83 0.0 OUTLIER 'General case' 0 C--N 1.302 -1.488 0 O-C-N 120.83 -1.169 . . . . 0.0 109.476 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.908 ' HB3' ' HA ' ' A' ' 49' ' ' LEU . . . . . . . . 0 N--CA 1.489 1.524 0 CA-C-O 118.01 -0.995 . . . . 0.0 109.456 -179.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . 0.447 HG23 ' O ' ' A' ' 1' ' ' THR . 13.5 t . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.295 0.569 . . . . 0.0 109.538 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.99 HD13 ' CZ2' ' A' ' 5' ' ' TRP . 1.2 pp -104.15 17.68 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.396 0 O-C-N 121.278 -0.889 . . . . 0.0 109.794 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.434 ' O ' ' C ' ' A' ' 4' ' ' GLN . 7.5 t70 -58.51 -13.92 6.72 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.334 -0.854 . . . . 0.0 109.559 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.434 ' C ' ' O ' ' A' ' 3' ' ' ASP . 1.4 mm-40 -39.91 -47.88 2.25 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.428 -0.795 . . . . 0.0 110.869 -179.686 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.99 ' CZ2' HD13 ' A' ' 2' ' ' ILE . 11.9 p-90 -115.48 -135.0 0.35 Allowed 'General case' 0 C--N 1.309 -1.184 0 O-C-N 120.694 -1.254 . . . . 0.0 109.147 -179.159 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.439 ' H ' ' HB2' ' A' ' 5' ' ' TRP . 0.1 OUTLIER -176.57 91.22 0.04 OUTLIER 'General case' 0 C--N 1.299 -1.604 0 O-C-N 121.096 -1.002 . . . . 0.0 109.026 -179.873 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 1.009 HD21 ' CG2' ' A' ' 41' ' ' VAL . 14.8 tp 49.77 -128.33 2.15 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 121.433 -0.792 . . . . 0.0 109.492 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.443 ' HB2' ' O ' ' A' ' 7' ' ' LEU . 1.3 mmmm 64.19 62.05 0.87 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 120.851 -1.156 . . . . 0.0 109.613 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.746 HD21 HG22 ' A' ' 38' ' ' VAL . 0.9 OUTLIER -144.97 -55.73 0.32 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.36 -0.837 . . . . 0.0 108.84 179.61 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.561 ' HB3' HG11 ' A' ' 41' ' ' VAL . . . -79.67 4.59 15.64 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.302 -0.874 . . . . 0.0 109.212 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.532 ' O ' ' CG1' ' A' ' 15' ' ' ILE . 0.5 OUTLIER -52.44 -91.81 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.252 -0.905 . . . . 0.0 110.546 -179.407 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -67.26 -22.93 65.65 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.999 -1.063 . . . . 0.0 111.06 -178.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -62.07 -63.51 1.23 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.763 -1.21 . . . . 0.0 109.508 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.526 ' HB1' ' HZ2' ' A' ' 45' ' ' LYS . . . -73.25 -47.97 38.69 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.179 -0.95 . . . . 0.0 109.12 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.991 HG23 ' CE1' ' A' ' 29' ' ' PHE . 70.5 mt -47.1 -30.47 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.491 -0.756 . . . . 0.0 109.756 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -64.47 -52.21 59.09 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.468 -0.77 . . . . 0.0 109.856 -179.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -49.9 -32.15 13.89 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.246 -0.909 . . . . 0.0 110.123 -179.679 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.627 HD12 ' N ' ' A' ' 18' ' ' LEU . 10.0 mp -90.37 -24.94 20.66 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.43 -0.794 . . . . 0.0 110.263 -178.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.2 tttt -64.03 -22.3 66.87 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.339 -0.85 . . . . 0.0 110.02 -179.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.42 -13.21 41.03 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.204 -0.935 . . . . 0.0 109.625 -179.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -81.66 -4.12 55.32 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.225 -0.922 . . . . 0.0 109.589 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 98.06 -41.8 2.2 Favored Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.802 -1.319 . . . . 0.0 109.802 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.73 HG21 HG21 ' A' ' 48' ' ' ILE . 59.7 mt -47.04 117.55 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.163 -1.198 . . . . 0.0 109.666 -179.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.73 17.91 5.2 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.306 -0.872 . . . . 0.0 109.508 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.427 ' HB3' ' CD2' ' A' ' 28' ' ' TYR . 3.0 t -54.97 127.67 29.94 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.108 -0.995 . . . . 0.0 109.038 179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.558 ' O ' ' CB ' ' A' ' 30' ' ' ASN . 17.4 p-10 -72.15 -13.39 61.54 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.187 -0.946 . . . . 0.0 109.878 -179.394 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.531 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 18.9 t80 -81.44 -3.2 52.24 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 120.479 -1.388 . . . . 0.0 108.901 179.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.906 ' CD2' HG23 ' A' ' 48' ' ' ILE . 21.4 m-30 -111.48 -29.88 7.6 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 108.493 -0.929 . . . . 0.0 108.493 179.515 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.991 ' CE1' HG23 ' A' ' 15' ' ' ILE . 3.9 m-30 -103.23 -43.75 5.37 Favored 'General case' 0 C--N 1.295 -1.763 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.558 ' CB ' ' O ' ' A' ' 26' ' ' ASP . 3.1 t-20 -68.33 -26.94 65.86 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 108.45 -0.945 . . . . 0.0 108.45 179.127 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -88.55 4.43 46.85 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.53 -0.731 . . . . 0.0 109.68 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.919 HD12 HG13 ' A' ' 41' ' ' VAL . 0.7 OUTLIER -84.73 -20.79 8.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.169 -0.957 . . . . 0.0 109.104 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.513 ' HB2' ' CE ' ' A' ' 11' ' ' LYS . 0.7 OUTLIER -76.5 -23.48 53.74 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.127 -0.983 . . . . 0.0 109.004 179.387 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.453 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.4 OUTLIER -80.21 -18.44 49.53 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.396 -0.815 . . . . 0.0 109.313 179.716 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.453 ' O ' ' O ' ' A' ' 34' ' ' LYS . . . -44.54 168.99 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.342 -0.849 . . . . 0.0 109.807 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.525 ' O ' HD13 ' A' ' 7' ' ' LEU . 45.0 mttp -106.27 -69.85 0.81 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.425 -0.797 . . . . 0.0 109.248 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 8.8 t -108.38 179.0 4.33 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.277 -0.889 . . . . 0.0 108.877 179.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.746 HG22 HD21 ' A' ' 9' ' ' ASN . 25.5 t -59.35 -44.92 93.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.462 0 O-C-N 120.956 -1.09 . . . . 0.0 108.942 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.705 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 0.5 OUTLIER -56.32 -27.01 54.32 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 179.449 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -78.89 -33.74 45.38 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 179.069 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 1.009 ' CG2' HD21 ' A' ' 7' ' ' LEU . 90.7 t -71.09 -73.4 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.389 0 N-CA-C 107.937 -1.135 . . . . 0.0 107.937 178.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.677 ' ND2' HG12 ' A' ' 38' ' ' VAL . 76.2 m-20 -44.26 -28.19 0.5 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.553 -0.717 . . . . 0.0 109.328 179.15 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.705 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -68.55 -52.78 28.18 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.155 -0.966 . . . . 0.0 109.291 -179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.1 mt -60.12 -34.79 74.0 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.369 -0.832 . . . . 0.0 110.295 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.625 ' HE3' ' CA ' ' A' ' 15' ' ' ILE . 0.0 OUTLIER -77.17 -27.25 53.68 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.063 -1.023 . . . . 0.0 109.271 -179.777 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -80.47 -22.42 41.06 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.266 -0.897 . . . . 0.0 108.84 179.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.734 ' O ' ' HB3' ' A' ' 51' ' ' ALA . 0.6 OUTLIER -78.18 1.31 21.8 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.466 -0.771 . . . . 0.0 109.037 179.456 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.906 HG23 ' CD2' ' A' ' 28' ' ' TYR . 42.2 mt -80.6 -46.66 21.24 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 O-C-N 121.176 -0.953 . . . . 0.0 108.783 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.54 -30.18 68.43 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.652 -0.655 . . . . 0.0 109.944 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 40.7 mmtt -100.06 -62.61 1.22 Allowed 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.108 -0.995 . . . . 0.0 109.751 -179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.734 ' HB3' ' O ' ' A' ' 47' ' ' GLU . . . -51.05 -21.68 1.97 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.214 -0.929 . . . . 0.0 109.031 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.684 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 1.4 t-80 -148.72 170.94 17.05 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 -179.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.684 ' HB3' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 118.044 -0.979 . . . . 0.0 109.445 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . 0.622 ' O ' HG22 ' A' ' 2' ' ' ILE . 6.3 t . . . . . 0 N--CA 1.49 1.546 0 N-CA-C 109.484 -0.561 . . . . 0.0 109.484 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.622 HG22 ' O ' ' A' ' 1' ' ' THR . 15.0 tt 41.83 41.63 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.486 -0.759 . . . . 0.0 109.654 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.438 ' H ' HG23 ' A' ' 1' ' ' THR . 0.2 OUTLIER -67.38 -9.18 38.92 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.303 -0.873 . . . . 0.0 109.176 179.461 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.482 ' O ' ' O ' ' A' ' 5' ' ' TRP . 0.0 OUTLIER -73.29 -2.24 21.19 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.335 -0.853 . . . . 0.0 109.622 179.943 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.493 ' O ' ' N ' ' A' ' 7' ' ' LEU . 18.4 t90 -40.35 -96.64 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.382 0 O-C-N 121.411 -0.806 . . . . 0.0 110.899 -179.399 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.558 HD22 ' H ' ' A' ' 6' ' ' LEU . 3.8 mm? 38.87 28.11 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.996 -1.065 . . . . 0.0 110.355 -179.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.946 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.7 OUTLIER 40.57 74.06 0.11 Allowed 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.341 -0.85 . . . . 0.0 109.39 -179.567 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 21.5 mtpt -129.65 17.36 5.82 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 121.284 -0.885 . . . . 0.0 108.621 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.824 HD21 HG22 ' A' ' 38' ' ' VAL . 5.8 p30 -85.5 -47.12 10.22 Favored 'General case' 0 C--N 1.305 -1.346 0 N-CA-C 108.375 -0.972 . . . . 0.0 108.375 179.294 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.852 ' O ' ' HB3' ' A' ' 14' ' ' ALA . . . -81.02 -14.19 58.14 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.422 -0.799 . . . . 0.0 108.949 179.099 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.898 ' HA ' HG21 ' A' ' 32' ' ' ILE . 0.7 OUTLIER -48.36 -68.22 0.2 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.045 -1.034 . . . . 0.0 109.863 -179.823 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -98.9 -23.12 15.46 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 120.993 -1.067 . . . . 0.0 109.804 -179.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.501 ' CB ' ' O ' ' A' ' 9' ' ' ASN . 4.1 t0 -75.7 -19.21 59.28 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.162 -0.961 . . . . 0.0 109.02 179.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.852 ' HB3' ' O ' ' A' ' 10' ' ' ALA . . . -102.27 -44.31 5.45 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 179.401 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.64 HD12 ' O ' ' A' ' 11' ' ' LYS . 59.6 mt -54.99 -29.08 21.43 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 O-C-N 121.381 -0.824 . . . . 0.0 109.066 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.64 -37.09 84.98 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.502 -0.749 . . . . 0.0 109.364 -179.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -88.22 -16.18 33.95 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.459 -0.776 . . . . 0.0 110.291 -179.41 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.731 HD22 ' CD ' ' A' ' 45' ' ' LYS . 47.6 mt -83.66 -32.32 25.69 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.041 -1.037 . . . . 0.0 109.745 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.4 mtmt -65.06 -35.58 81.6 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.056 -1.027 . . . . 0.0 109.319 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.08 -10.51 56.79 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.419 -0.8 . . . . 0.0 109.248 179.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.14 -42.49 98.64 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.254 -0.904 . . . . 0.0 109.261 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 141.74 -13.58 2.67 Favored Glycine 0 N--CA 1.491 2.353 0 N-CA-C 109.67 -1.372 . . . . 0.0 109.67 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.824 HD13 HG21 ' A' ' 48' ' ' ILE . 3.5 mt -105.53 146.39 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.108 -1.23 . . . . 0.0 109.85 -179.713 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 1.1 p -135.38 15.49 3.45 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 179.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 26.5 m -59.43 -168.51 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.424 -0.797 . . . . 0.0 109.475 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.518 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 0.3 OUTLIER -126.37 -16.05 5.5 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.222 -0.924 . . . . 0.0 109.862 -179.932 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.638 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 4.2 t80 -80.26 -9.07 59.72 Favored 'General case' 0 C--N 1.301 -1.532 0 O-C-N 120.635 -1.291 . . . . 0.0 109.038 179.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.696 ' CG ' HG12 ' A' ' 48' ' ' ILE . 17.8 m-85 -102.67 -23.97 13.79 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.342 -0.849 . . . . 0.0 108.837 179.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.486 ' CE2' ' HB2' ' A' ' 18' ' ' LEU . 80.3 m-85 -96.47 -51.95 4.15 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-O 121.149 0.5 . . . . 0.0 109.759 -179.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.518 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 0.4 OUTLIER -63.66 -19.3 64.78 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.196 -0.94 . . . . 0.0 109.618 179.857 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -87.82 16.3 5.99 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.239 -0.913 . . . . 0.0 109.086 -179.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.898 HG21 ' HA ' ' A' ' 11' ' ' LYS . 8.6 mm -76.21 -65.77 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 121.547 -0.721 . . . . 0.0 109.373 -179.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -51.28 -26.17 6.91 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.223 -0.923 . . . . 0.0 109.083 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.435 ' O ' ' C ' ' A' ' 35' ' ' ALA . 0.4 OUTLIER -62.3 -44.71 95.89 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.4 -0.812 . . . . 0.0 109.467 179.924 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.697 ' HB3' HG22 ' A' ' 41' ' ' VAL . . . -42.65 146.73 0.34 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.344 -0.847 . . . . 0.0 109.587 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.422 ' HG3' ' OE2' ' A' ' 40' ' ' GLU . 26.8 mttm -69.44 -64.65 0.84 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.272 -0.893 . . . . 0.0 109.825 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.812 ' O ' HG23 ' A' ' 41' ' ' VAL . 1.2 p -118.82 -163.56 0.97 Allowed 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.121 -0.987 . . . . 0.0 109.48 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.824 HG22 HD21 ' A' ' 9' ' ' ASN . 18.0 t -68.61 -55.36 16.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.251 -0.905 . . . . 0.0 109.741 -179.751 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.779 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 14.2 pt-20 -50.48 -23.16 2.28 Favored 'General case' 0 C--N 1.295 -1.778 0 O-C-N 121.058 -1.027 . . . . 0.0 108.542 179.592 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.422 ' OE2' ' HG3' ' A' ' 36' ' ' LYS . 1.4 mm-40 -83.1 -38.34 22.6 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.434 -0.791 . . . . 0.0 109.02 179.159 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.907 HG21 HD21 ' A' ' 7' ' ' LEU . 11.7 t -63.54 -58.87 5.57 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 N-CA-C 108.234 -1.024 . . . . 0.0 108.234 179.263 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 27.6 m-80 -62.52 -29.78 70.81 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.362 -0.836 . . . . 0.0 108.893 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.779 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -65.72 -33.41 75.81 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.413 -0.804 . . . . 0.0 109.642 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.72 ' C ' HD12 ' A' ' 44' ' ' LEU . 0.3 OUTLIER -61.07 -39.44 89.87 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.174 -0.954 . . . . 0.0 109.519 -179.752 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.786 ' HE3' HD12 ' A' ' 23' ' ' ILE . 30.5 tptt -66.61 -18.59 65.45 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.127 -0.983 . . . . 0.0 109.475 -179.874 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.464 ' HB2' ' O ' ' A' ' 43' ' ' ALA . 26.0 m-80 -73.41 -40.02 64.6 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.203 -0.936 . . . . 0.0 109.232 179.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.536 ' O ' ' CB ' ' A' ' 51' ' ' ALA . 39.1 mt-10 -62.65 -27.07 68.97 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.273 -0.892 . . . . 0.0 109.308 179.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.824 HG21 HD13 ' A' ' 23' ' ' ILE . 2.5 mp -70.73 -29.81 39.44 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 179.35 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.427 ' HB2' ' O ' ' A' ' 46' ' ' ASN . 4.5 mp -59.31 -30.39 68.3 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 108.795 -0.817 . . . . 0.0 108.795 179.238 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 8.0 mtmt -122.41 5.5 9.63 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.209 -0.932 . . . . 0.0 109.722 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.536 ' CB ' ' O ' ' A' ' 47' ' ' GLU . . . -101.54 -49.54 3.99 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.248 -0.907 . . . . 0.0 109.907 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.507 ' CD2' ' C ' ' A' ' 52' ' ' HIS . 0.0 OUTLIER -106.91 -6.82 17.35 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.314 -0.866 . . . . 0.0 110.161 -178.987 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 118.112 -0.947 . . . . 0.0 109.539 -179.935 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.619 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.991 HD13 ' O ' ' A' ' 2' ' ' ILE . 0.0 OUTLIER -127.0 -7.59 4.61 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.159 -0.963 . . . . 0.0 109.699 -179.767 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.454 ' O ' ' N ' ' A' ' 5' ' ' TRP . 3.2 m-20 -51.83 -20.55 2.28 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.962 -1.086 . . . . 0.0 108.801 178.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.51 ' HG3' ' N ' ' A' ' 5' ' ' TRP . 0.4 OUTLIER -41.0 -25.74 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.467 -0.771 . . . . 0.0 110.402 179.724 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.512 ' O ' ' C ' ' A' ' 6' ' ' LEU . 1.1 t90 -37.92 -69.28 0.12 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.221 -0.924 . . . . 0.0 111.323 -179.566 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.512 ' C ' ' O ' ' A' ' 5' ' ' TRP . 30.4 tp -27.7 -43.76 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.005 0 CA-C-O 121.14 0.495 . . . . 0.0 110.939 -178.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.915 HD21 ' CG2' ' A' ' 41' ' ' VAL . 0.3 OUTLIER 75.9 -157.98 0.04 OUTLIER 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.257 -0.902 . . . . 0.0 109.358 179.761 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.521 ' CB ' ' O ' ' A' ' 7' ' ' LEU . 0.1 OUTLIER 76.57 -2.94 2.62 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.201 -0.937 . . . . 0.0 109.428 -179.711 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.708 HD21 HG22 ' A' ' 38' ' ' VAL . 6.1 p30 -73.6 -47.15 42.52 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.211 -0.931 . . . . 0.0 108.662 179.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.613 ' HB3' HG11 ' A' ' 41' ' ' VAL . . . -80.99 -4.51 55.34 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.322 -0.861 . . . . 0.0 109.014 179.199 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.401 ' O ' HG13 ' A' ' 15' ' ' ILE . 0.1 OUTLIER -50.43 -75.99 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.363 -0.836 . . . . 0.0 110.201 -179.572 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 26.0 tt0 -76.92 -18.42 58.3 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.144 -0.972 . . . . 0.0 110.369 -179.2 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -71.6 -18.28 62.23 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.947 -1.096 . . . . 0.0 109.441 -179.767 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.598 ' HB1' ' HG3' ' A' ' 45' ' ' LYS . . . -106.75 -38.79 6.0 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 179.58 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.755 HG23 ' CE1' ' A' ' 29' ' ' PHE . 35.8 mt -61.9 -28.36 44.14 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 CA-C-O 121.752 0.787 . . . . 0.0 109.263 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.06 -3.06 4.75 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.651 -0.655 . . . . 0.0 110.941 -178.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.526 ' O ' ' CG ' ' A' ' 17' ' ' GLU . 17.0 tt0 -117.56 1.94 12.32 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 120.847 -1.158 . . . . 0.0 109.933 -179.531 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.685 HD12 HD12 ' A' ' 23' ' ' ILE . 3.7 mm? -100.44 -39.68 7.84 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.001 -1.062 . . . . 0.0 110.511 -179.47 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.63 -19.71 64.06 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.018 -1.051 . . . . 0.0 109.942 -179.384 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.468 ' O ' ' HG3' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -96.94 -14.8 21.49 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.144 -0.972 . . . . 0.0 109.381 179.892 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -79.81 -39.33 31.02 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.156 -0.965 . . . . 0.0 109.587 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 125.25 14.07 3.39 Favored Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.954 -1.259 . . . . 0.0 109.954 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.736 HG23 ' CE1' ' A' ' 52' ' ' HIS . 34.1 mt -105.03 117.99 51.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.078 -1.248 . . . . 0.0 109.257 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 3.2 p -113.44 -4.74 13.55 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.233 -0.917 . . . . 0.0 109.938 -179.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -45.97 133.58 8.66 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.101 -0.999 . . . . 0.0 109.149 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.458 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 7.4 p-10 -88.47 -2.84 58.82 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.282 -0.886 . . . . 0.0 109.732 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.472 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 26.1 t80 -76.21 -13.94 60.16 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.166 -0.959 . . . . 0.0 109.243 -179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.823 ' HB3' HD11 ' A' ' 48' ' ' ILE . 22.3 m-85 -100.6 -45.21 5.59 Favored 'General case' 0 C--N 1.302 -1.477 0 O-C-N 121.428 -0.795 . . . . 0.0 108.973 179.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.755 ' CE1' HG23 ' A' ' 15' ' ' ILE . 5.5 m-85 -66.84 -44.62 80.58 Favored 'General case' 0 C--N 1.3 -1.557 0 O-C-N 121.473 -0.767 . . . . 0.0 109.559 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.458 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 14.4 m120 -68.74 -24.66 64.48 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.322 -0.861 . . . . 0.0 110.055 -179.799 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -92.49 -17.27 24.74 Favored 'General case' 0 C--N 1.304 -1.392 0 O-C-N 121.123 -0.986 . . . . 0.0 110.565 -178.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.511 HD11 ' HG2' ' A' ' 45' ' ' LYS . 0.6 OUTLIER -53.69 -39.05 36.81 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 120.981 -1.074 . . . . 0.0 109.242 -179.853 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -71.17 -38.82 72.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.184 -0.947 . . . . 0.0 109.442 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.418 ' O ' ' C ' ' A' ' 35' ' ' ALA . 16.7 mmtt -52.7 -25.65 11.62 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.287 -0.883 . . . . 0.0 109.408 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.626 ' HB3' HG22 ' A' ' 41' ' ' VAL . . . -41.69 137.12 1.73 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.457 -0.777 . . . . 0.0 109.764 179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.874 ' O ' HD13 ' A' ' 7' ' ' LEU . 6.5 mtpt -75.85 -64.85 0.99 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.213 -0.93 . . . . 0.0 109.275 179.792 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.69 ' C ' HD11 ' A' ' 7' ' ' LEU . 9.0 t -109.71 -178.4 3.53 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.213 -0.929 . . . . 0.0 108.901 179.541 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.708 HG22 HD21 ' A' ' 9' ' ' ASN . 12.1 t -61.25 -46.33 96.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 O-C-N 120.896 -1.127 . . . . 0.0 108.942 179.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.718 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 5.8 mt-10 -53.34 -25.72 16.26 Favored 'General case' 0 C--N 1.298 -1.65 0 N-CA-C 108.154 -1.054 . . . . 0.0 108.154 179.07 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.556 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -79.68 -37.14 36.48 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 179.071 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.915 ' CG2' HD21 ' A' ' 7' ' ' LEU . 38.4 t -65.53 -66.12 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.434 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 179.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.509 ' ND2' HG12 ' A' ' 38' ' ' VAL . 28.2 m-80 -55.68 -29.41 59.32 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.48 -0.762 . . . . 0.0 109.579 179.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.718 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -67.52 -39.87 85.1 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.216 -0.927 . . . . 0.0 109.622 -179.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.447 HD12 ' HB2' ' A' ' 35' ' ' ALA . 3.6 mt -61.39 -45.51 94.06 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.207 -0.933 . . . . 0.0 109.791 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.598 ' HG3' ' HB1' ' A' ' 14' ' ' ALA . 14.1 mmtm -63.14 -25.86 68.55 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.125 -0.984 . . . . 0.0 109.319 -179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -80.43 -19.83 45.27 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.283 -0.886 . . . . 0.0 109.743 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -79.51 -16.57 55.79 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.158 -0.964 . . . . 0.0 109.744 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.823 HD11 ' HB3' ' A' ' 28' ' ' TYR . 64.0 mt -71.46 -42.05 73.01 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 O-C-N 120.877 -1.139 . . . . 0.0 108.548 179.525 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 87.4 mt -51.89 -26.41 10.13 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.417 -0.802 . . . . 0.0 109.338 179.442 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.42 ' O ' ' N ' ' A' ' 52' ' ' HIS . 0.1 OUTLIER -112.31 -71.15 0.77 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.186 -0.946 . . . . 0.0 109.965 -179.89 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -43.58 -25.44 0.16 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.311 -0.868 . . . . 0.0 109.844 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.771 ' CD2' HG22 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -130.32 152.04 50.17 Favored 'General case' 0 C--N 1.305 -1.333 0 O-C-N 121.22 -0.925 . . . . 0.0 108.707 -179.644 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.646 ' HB3' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 118.009 -0.996 . . . . 0.0 109.247 -179.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 121.234 0.54 . . . . 0.0 109.555 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.85 ' O ' HG22 ' A' ' 2' ' ' ILE . 14.7 mm 47.01 60.35 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.28 -0.887 . . . . 0.0 109.574 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.746 ' HA ' HD23 ' A' ' 6' ' ' LEU . 4.3 t0 -96.78 24.98 5.57 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 178.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -76.05 -50.21 15.39 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.718 -0.614 . . . . 0.0 110.573 -178.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.83 ' CZ2' HG21 ' A' ' 2' ' ' ILE . 4.2 p-90 -105.77 -49.55 3.38 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.16 -0.963 . . . . 0.0 111.08 -178.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.746 HD23 ' HA ' ' A' ' 3' ' ' ASP . 0.5 OUTLIER 38.99 29.7 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.559 -0.713 . . . . 0.0 109.504 -178.773 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.955 HD11 ' CG2' ' A' ' 41' ' ' VAL . 11.6 tp 96.41 38.21 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.953 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 -179.271 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.422 ' N ' ' O ' ' A' ' 5' ' ' TRP . 9.7 mtmt -136.71 63.59 1.57 Allowed 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 179.629 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -142.4 -48.71 0.35 Allowed 'General case' 0 C--N 1.303 -1.451 0 O-C-N 121.464 -0.773 . . . . 0.0 109.137 -179.384 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.534 ' HB2' HG13 ' A' ' 38' ' ' VAL . . . -80.95 -18.97 45.25 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 121.291 -0.88 . . . . 0.0 108.863 179.545 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.602 ' O ' HD12 ' A' ' 15' ' ' ILE . 4.7 ptmt -74.88 -14.8 60.71 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.354 -0.842 . . . . 0.0 109.615 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -100.97 -37.84 8.46 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.055 -1.028 . . . . 0.0 109.513 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -74.85 -26.53 59.76 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.247 -0.908 . . . . 0.0 109.684 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.521 ' O ' HD23 ' A' ' 18' ' ' LEU . . . -92.97 -42.58 9.38 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.089 -1.007 . . . . 0.0 109.626 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.602 HD12 ' O ' ' A' ' 11' ' ' LYS . 20.4 mt -63.28 -31.0 51.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 CA-C-O 121.776 0.798 . . . . 0.0 108.999 179.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.507 ' HA ' ' HD2' ' A' ' 19' ' ' LYS . . . -67.24 -7.0 20.64 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.641 -0.662 . . . . 0.0 110.132 -179.3 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.444 ' O ' ' CG ' ' A' ' 17' ' ' GLU . 9.4 tp10 -109.27 -5.97 15.69 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.231 -0.918 . . . . 0.0 109.522 -179.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.834 HD12 HD12 ' A' ' 23' ' ' ILE . 4.0 mm? -93.49 -41.01 10.02 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.113 -0.992 . . . . 0.0 109.031 179.895 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.507 ' HD2' ' HA ' ' A' ' 16' ' ' ALA . 0.1 OUTLIER -56.42 -23.31 37.59 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 121.504 -0.747 . . . . 0.0 109.524 -179.942 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.497 ' N ' ' HG2' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -97.64 -20.09 17.87 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.293 -0.879 . . . . 0.0 109.142 179.551 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -75.41 -28.67 59.51 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.259 -0.901 . . . . 0.0 109.575 179.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 128.36 -45.86 1.12 Allowed Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.26 -1.536 . . . . 0.0 109.26 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.867 HD13 HG21 ' A' ' 48' ' ' ILE . 5.5 mt -45.24 122.83 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.205 -1.173 . . . . 0.0 109.008 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -128.93 10.51 5.95 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.162 -0.961 . . . . 0.0 109.842 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 1.7 t -66.09 156.41 33.96 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.197 -0.939 . . . . 0.0 109.198 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.49 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 2.7 t70 -103.38 -4.11 24.58 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.103 -0.998 . . . . 0.0 109.825 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.472 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 5.9 t80 -77.57 -18.07 57.27 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.11 -0.993 . . . . 0.0 109.232 -179.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.647 ' CG ' ' CG1' ' A' ' 48' ' ' ILE . 22.5 m-85 -95.46 -41.12 9.13 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.263 -0.898 . . . . 0.0 108.926 179.558 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.594 ' CE1' HG23 ' A' ' 15' ' ' ILE . 9.6 m-30 -71.03 -49.88 40.08 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.434 -0.791 . . . . 0.0 109.465 179.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.49 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 3.5 t-20 -59.12 -52.37 66.03 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.24 -0.912 . . . . 0.0 109.671 -179.746 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.16 -22.07 65.58 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.27 -0.894 . . . . 0.0 109.645 -179.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.61 HG23 HG13 ' A' ' 41' ' ' VAL . 1.4 mm -67.64 -53.94 27.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.205 -0.935 . . . . 0.0 109.399 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.524 ' CB ' ' HD2' ' A' ' 11' ' ' LYS . 1.6 p-10 -73.53 -1.96 20.74 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.149 -0.969 . . . . 0.0 109.461 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.483 ' O ' ' O ' ' A' ' 35' ' ' ALA . 7.2 mttt -105.3 -8.86 17.99 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.27 -0.894 . . . . 0.0 109.817 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.735 ' HB1' ' HB3' ' A' ' 40' ' ' GLU . . . -55.2 -158.89 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.531 -0.731 . . . . 0.0 110.088 -179.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.91 ' O ' HD22 ' A' ' 7' ' ' LEU . 6.7 mttt -110.02 -67.47 0.99 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.128 -0.983 . . . . 0.0 110.087 -179.702 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.952 ' O ' HG23 ' A' ' 41' ' ' VAL . 0.7 OUTLIER -118.79 -168.5 1.56 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.979 -1.075 . . . . 0.0 109.645 -179.565 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.534 HG13 ' HB2' ' A' ' 10' ' ' ALA . 65.3 t -70.41 -31.6 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.201 -0.937 . . . . 0.0 109.931 -179.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.748 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 1.7 mm-40 -71.01 -26.75 63.26 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 120.945 -1.097 . . . . 0.0 108.139 179.319 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.735 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 0.1 OUTLIER -84.51 -26.7 27.92 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 178.736 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.955 ' CG2' HD11 ' A' ' 7' ' ' LEU . 53.9 t -73.8 -70.04 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 178.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 -50.14 -29.08 8.4 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 178.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.748 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -64.48 -50.66 66.57 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.389 -0.819 . . . . 0.0 108.923 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.786 ' O ' HD12 ' A' ' 48' ' ' ILE . 5.9 mt -61.09 -46.58 90.05 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.314 -0.867 . . . . 0.0 109.922 -179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.577 ' HA ' HD13 ' A' ' 48' ' ' ILE . 0.2 OUTLIER -56.09 -40.9 74.37 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.118 -0.989 . . . . 0.0 109.805 -179.596 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 45.1 m-20 -76.43 -18.74 58.67 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.149 -0.97 . . . . 0.0 109.388 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.404 ' O ' ' CB ' ' A' ' 51' ' ' ALA . 8.6 tp10 -73.17 -19.89 61.02 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.259 -0.901 . . . . 0.0 109.407 179.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.867 HG21 HD13 ' A' ' 23' ' ' ILE . 2.9 mp -68.62 -27.76 37.47 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 179.075 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.503 ' HB2' ' HE2' ' A' ' 50' ' ' LYS . 2.3 mm? -58.24 -38.3 76.59 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.612 -0.68 . . . . 0.0 109.951 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.503 ' HE2' ' HB2' ' A' ' 49' ' ' LEU . 0.0 OUTLIER -114.69 0.16 13.79 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.929 -1.107 . . . . 0.0 110.201 -179.432 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.404 ' CB ' ' O ' ' A' ' 47' ' ' GLU . . . -100.62 -12.17 19.43 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 121.182 -0.949 . . . . 0.0 109.172 179.718 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.724 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 0.0 OUTLIER -154.47 -171.61 3.92 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.429 -0.794 . . . . 0.0 108.886 -179.723 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.724 ' HB3' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.491 1.619 0 CA-C-O 117.945 -1.026 . . . . 0.0 109.585 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.648 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.759 HG23 ' O ' ' A' ' 2' ' ' ILE . 0.2 OUTLIER -147.4 33.68 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.265 -0.897 . . . . 0.0 109.495 -179.763 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.4 p-10 -90.09 37.64 0.9 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.141 -0.974 . . . . 0.0 108.466 179.019 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 42.7 tp60 -62.91 -23.34 67.31 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.7 -0.625 . . . . 0.0 110.319 -179.343 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.691 ' HB2' HD23 ' A' ' 6' ' ' LEU . 0.0 OUTLIER -104.32 -102.72 0.31 Allowed 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.974 -1.079 . . . . 0.0 110.055 -179.553 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.691 HD23 ' HB2' ' A' ' 5' ' ' TRP . 2.1 pt? -152.54 -19.06 0.17 Allowed 'General case' 0 N--CA 1.495 1.809 0 O-C-N 120.715 -1.241 . . . . 0.0 111.446 -179.466 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.969 HD13 ' O ' ' A' ' 36' ' ' LYS . 1.2 tp 83.17 -135.87 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.889 -1.132 . . . . 0.0 109.112 -179.396 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.507 ' HA ' ' HG3' ' A' ' 11' ' ' LYS . 29.2 mttt 64.49 6.42 3.12 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.026 -1.046 . . . . 0.0 109.878 -179.365 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.431 HD21 HG22 ' A' ' 38' ' ' VAL . 7.4 p30 -80.99 -45.57 16.4 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.024 -1.048 . . . . 0.0 108.501 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.693 ' HB3' HG11 ' A' ' 41' ' ' VAL . . . -80.44 0.11 34.85 Favored 'General case' 0 C--N 1.304 -1.41 0 O-C-N 121.487 -0.758 . . . . 0.0 109.255 179.397 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.507 ' HG3' ' HA ' ' A' ' 8' ' ' LYS . 0.0 OUTLIER -51.31 -88.38 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.961 -1.087 . . . . 0.0 109.49 -179.686 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.435 ' O ' ' HB2' ' A' ' 16' ' ' ALA . 19.9 tt0 -67.08 -10.73 53.08 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.064 -1.022 . . . . 0.0 109.907 -179.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -69.56 -72.31 0.19 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.083 -1.011 . . . . 0.0 109.259 179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.563 ' O ' HD23 ' A' ' 18' ' ' LEU . . . -64.16 -35.72 81.72 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.409 -0.807 . . . . 0.0 109.858 179.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 1.054 HG23 ' CE1' ' A' ' 29' ' ' PHE . 33.8 mt -61.2 -28.55 44.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 CA-C-O 121.774 0.797 . . . . 0.0 109.389 -179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.435 ' HB2' ' O ' ' A' ' 12' ' ' GLU . . . -66.77 -4.15 8.41 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.823 -0.548 . . . . 0.0 110.893 -178.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.561 ' C ' HD22 ' A' ' 18' ' ' LEU . 12.1 tt0 -116.12 -2.8 12.14 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 120.938 -1.101 . . . . 0.0 109.874 -179.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.613 ' N ' HD22 ' A' ' 18' ' ' LEU . 3.6 mm? -99.59 -40.14 7.95 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.945 -1.097 . . . . 0.0 109.707 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.8 ttpp -53.76 -23.81 13.07 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.225 -0.922 . . . . 0.0 109.601 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.77 -22.39 16.43 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.224 -0.922 . . . . 0.0 109.712 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.02 -7.41 28.88 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.179 -0.951 . . . . 0.0 109.534 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 100.72 -9.3 58.52 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.256 -1.537 . . . . 0.0 109.256 -179.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.513 ' O ' HG23 ' A' ' 24' ' ' THR . 4.9 mm -69.15 149.05 11.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.302 -1.117 . . . . 0.0 109.583 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.513 HG23 ' O ' ' A' ' 23' ' ' ILE . 1.4 p -155.88 20.13 0.38 Allowed 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.315 -0.866 . . . . 0.0 109.346 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 6.0 m -80.17 142.17 34.99 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.361 -0.837 . . . . 0.0 109.428 179.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.489 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 1.8 p30 -88.96 -11.77 43.46 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.309 -0.869 . . . . 0.0 109.561 -179.748 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.511 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 5.8 t80 -75.7 -12.56 60.22 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.208 -0.933 . . . . 0.0 109.121 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.64 ' CG ' ' CG1' ' A' ' 48' ' ' ILE . 24.0 m-85 -100.77 -43.2 6.19 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.33 -0.857 . . . . 0.0 109.204 179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 1.054 ' CE1' HG23 ' A' ' 15' ' ' ILE . 5.2 m-85 -71.87 -45.17 62.27 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.503 -0.748 . . . . 0.0 109.765 -179.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.489 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 0.1 OUTLIER -65.27 -33.57 76.3 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.117 -0.989 . . . . 0.0 109.141 179.96 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -75.32 -11.72 60.12 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.38 -0.825 . . . . 0.0 109.184 179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.825 HD11 ' HD2' ' A' ' 45' ' ' LYS . 4.3 mm -74.4 -25.2 19.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 O-C-N 121.343 -0.848 . . . . 0.0 109.367 179.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.503 ' ND2' ' HE2' ' A' ' 8' ' ' LYS . 4.8 t-20 -80.32 -31.19 38.16 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.185 -0.947 . . . . 0.0 109.252 179.59 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.466 ' O ' ' C ' ' A' ' 35' ' ' ALA . 15.6 mtpp -77.12 -17.2 58.82 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.22 -0.925 . . . . 0.0 109.57 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.855 ' CB ' HG22 ' A' ' 41' ' ' VAL . . . -36.97 155.17 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.701 0 CA-C-O 121.513 0.673 . . . . 0.0 110.497 -179.332 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.969 ' O ' HD13 ' A' ' 7' ' ' LEU . 2.8 mmtm -95.6 -66.63 0.9 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.433 -0.792 . . . . 0.0 109.682 -179.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.802 ' O ' HG23 ' A' ' 41' ' ' VAL . 38.2 p -116.44 178.22 4.41 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.149 -0.969 . . . . 0.0 109.198 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.431 HG22 HD21 ' A' ' 9' ' ' ASN . 26.3 t -63.29 -42.96 98.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.192 -0.942 . . . . 0.0 109.46 179.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.569 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 4.4 mm-40 -62.51 -23.07 66.75 Favored 'General case' 0 C--N 1.298 -1.661 0 O-C-N 121.219 -0.926 . . . . 0.0 109.035 179.799 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.498 ' HB2' ' H ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -85.71 -30.24 23.3 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.32 -0.862 . . . . 0.0 108.992 179.651 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.873 ' CG2' HD21 ' A' ' 7' ' ' LEU . 12.8 t -71.78 -61.58 1.64 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.434 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 179.005 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -57.72 -33.14 68.11 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.727 -0.608 . . . . 0.0 109.448 179.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.569 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -69.9 -31.74 69.69 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.323 -0.861 . . . . 0.0 109.753 -179.692 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.885 ' O ' HD12 ' A' ' 44' ' ' LEU . 0.2 OUTLIER -78.46 -24.75 45.87 Favored 'General case' 0 N--CA 1.486 1.351 0 O-C-N 121.105 -0.997 . . . . 0.0 109.346 -179.828 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.825 ' HD2' HD11 ' A' ' 32' ' ' ILE . 0.2 OUTLIER -80.5 -30.8 37.29 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.115 -0.991 . . . . 0.0 110.242 -179.314 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -79.87 -15.9 56.45 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 120.992 -1.067 . . . . 0.0 109.982 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.519 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 5.8 pt-20 -82.83 -6.98 59.68 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.058 -1.026 . . . . 0.0 109.521 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.64 ' CG1' ' CG ' ' A' ' 28' ' ' TYR . 1.6 mp -71.74 -48.42 51.68 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.473 0 N-CA-C 107.81 -1.182 . . . . 0.0 107.81 178.531 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.437 ' O ' ' C ' ' A' ' 53' ' ' ALA . 1.2 tp -50.2 -20.74 1.1 Allowed 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.297 -0.877 . . . . 0.0 109.793 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.421 ' O ' ' N ' ' A' ' 52' ' ' HIS . 0.0 OUTLIER -105.84 -74.49 0.65 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.991 -1.068 . . . . 0.0 109.877 -179.704 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -43.75 -22.62 0.05 Allowed 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.526 -0.734 . . . . 0.0 111.081 -179.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.521 ' CB ' ' OH ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -126.91 -8.48 6.05 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 120.935 -1.103 . . . . 0.0 110.578 -178.397 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.437 ' C ' ' O ' ' A' ' 49' ' ' LEU . . . . . . . . 0 N--CA 1.491 1.587 0 O-C-N 120.943 -1.098 . . . . 0.0 109.643 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 1.5 p . . . . . 0 N--CA 1.489 1.512 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.543 ' CG1' ' O ' ' A' ' 2' ' ' ILE . 1.9 tt -169.88 41.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.525 0 O-C-N 121.136 -0.977 . . . . 0.0 109.479 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -49.3 -22.99 1.21 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.075 -1.015 . . . . 0.0 108.711 179.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.439 ' O ' ' O ' ' A' ' 5' ' ' TRP . 0.0 OUTLIER -64.44 -67.92 0.4 Allowed 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.509 -0.744 . . . . 0.0 109.13 179.497 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.439 ' O ' ' O ' ' A' ' 4' ' ' GLN . 0.6 OUTLIER 59.75 128.75 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.343 0 CA-C-O 122.415 1.102 . . . . 0.0 110.862 179.557 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.565 HD13 ' HD2' ' A' ' 8' ' ' LYS . 0.5 OUTLIER -164.75 14.31 0.05 OUTLIER 'General case' 0 C--N 1.289 -2.024 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.636 -179.735 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.603 HD21 ' HB3' ' A' ' 35' ' ' ALA . 10.1 tp 83.89 -145.46 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.384 -0.823 . . . . 0.0 109.645 179.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.565 ' HD2' HD13 ' A' ' 6' ' ' LEU . 45.3 mttp 56.74 34.18 24.19 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 120.961 -1.087 . . . . 0.0 108.915 -178.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -131.18 -50.1 1.01 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.346 -0.846 . . . . 0.0 109.481 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -81.03 -13.55 58.72 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.096 -1.003 . . . . 0.0 109.194 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.498 ' HE3' ' CG ' ' A' ' 12' ' ' GLU . 0.0 OUTLIER -53.73 -92.26 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.365 -0.834 . . . . 0.0 110.163 -179.289 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.539 ' HA ' ' HB ' ' A' ' 15' ' ' ILE . 26.0 mt-10 -47.04 -23.57 0.5 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.294 -0.879 . . . . 0.0 110.342 -179.109 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -56.35 -52.1 65.83 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.17 -0.956 . . . . 0.0 108.958 179.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 1.03 ' O ' HD13 ' A' ' 18' ' ' LEU . . . -78.14 -47.92 17.1 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.281 -0.887 . . . . 0.0 109.238 179.53 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.939 ' HA ' HD22 ' A' ' 18' ' ' LEU . 55.0 mt -46.34 -30.15 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 O-C-N 121.324 -0.86 . . . . 0.0 109.481 -179.801 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -67.4 -47.25 70.84 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 107.41 -1.33 . . . . 0.0 107.41 179.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.411 ' O ' ' HB2' ' A' ' 21' ' ' ALA . 11.4 mt-10 -79.32 4.75 14.29 Favored 'General case' 0 C--N 1.296 -1.755 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.271 178.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 1.03 HD13 ' O ' ' A' ' 14' ' ' ALA . 5.2 mp -91.57 -46.78 7.77 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.181 -0.95 . . . . 0.0 110.197 -178.191 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 5.8 ttpt -58.77 -27.62 65.16 Favored 'General case' 0 C--N 1.303 -1.42 0 O-C-N 121.054 -1.029 . . . . 0.0 109.179 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.0 tttt -95.01 -14.49 24.29 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.398 -0.813 . . . . 0.0 109.116 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.411 ' HB2' ' O ' ' A' ' 17' ' ' GLU . . . -63.58 -54.73 31.47 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.312 -0.868 . . . . 0.0 109.627 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 151.01 -14.16 0.86 Allowed Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.924 -1.271 . . . . 0.0 109.924 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.74 HD13 HG21 ' A' ' 48' ' ' ILE . 1.2 mt -103.65 161.24 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 120.988 -1.301 . . . . 0.0 109.482 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 2.4 p -147.81 15.97 1.09 Allowed 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 179.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.72 174.03 0.07 Allowed 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.366 -0.834 . . . . 0.0 109.429 -179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.51 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 1.1 m-20 -112.13 -16.02 13.12 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.346 -0.846 . . . . 0.0 109.353 179.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.582 ' O ' ' HB3' ' A' ' 31' ' ' ALA . 2.8 t80 -81.27 -20.78 40.17 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 120.869 -1.144 . . . . 0.0 108.864 179.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 1.048 ' CE2' HG23 ' A' ' 48' ' ' ILE . 18.8 m-30 -93.16 -4.75 51.58 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.372 -0.83 . . . . 0.0 109.351 179.482 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.687 ' CE2' ' HB3' ' A' ' 18' ' ' LEU . 23.5 m-85 -115.71 -55.64 2.41 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.475 -0.765 . . . . 0.0 109.57 -179.553 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.51 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 1.0 OUTLIER -64.12 -36.34 83.7 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.548 -0.72 . . . . 0.0 109.749 179.74 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.582 ' HB3' ' O ' ' A' ' 27' ' ' PHE . . . -80.88 -0.11 37.63 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.256 -0.903 . . . . 0.0 109.354 -179.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.495 ' CG2' ' HA ' ' A' ' 11' ' ' LYS . 15.6 mm -62.41 -55.55 23.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.445 -0.784 . . . . 0.0 109.606 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 11.5 p30 -64.26 -23.41 67.29 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.257 -0.902 . . . . 0.0 109.269 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.453 ' HB2' ' O ' ' A' ' 31' ' ' ALA . 0.4 OUTLIER -61.63 -28.28 69.26 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.165 -0.959 . . . . 0.0 109.191 179.615 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.625 ' HB3' HG22 ' A' ' 41' ' ' VAL . . . -41.54 159.04 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.424 -0.798 . . . . 0.0 109.917 -179.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.436 ' O ' HD22 ' A' ' 7' ' ' LEU . 9.8 mtpt -92.04 -61.84 1.54 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.433 -0.792 . . . . 0.0 109.413 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.479 ' CA ' HD13 ' A' ' 7' ' ' LEU . 0.4 OUTLIER -117.06 178.47 4.34 Favored 'General case' 0 N--CA 1.491 1.625 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.575 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.469 ' N ' ' OG1' ' A' ' 37' ' ' THR . 96.4 t -56.78 -52.98 47.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.094 -1.004 . . . . 0.0 109.143 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.744 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 10.6 pt-20 -48.42 -27.98 2.97 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.352 -0.843 . . . . 0.0 108.934 179.521 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.422 ' HB2' ' O ' ' A' ' 37' ' ' THR . 19.7 mm-40 -79.1 -39.17 34.41 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.329 -0.857 . . . . 0.0 108.852 179.582 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.625 HG22 ' HB3' ' A' ' 35' ' ' ALA . 21.6 t -64.27 -64.62 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 178.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -55.16 -36.19 65.57 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.432 -0.793 . . . . 0.0 109.204 179.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.744 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -59.03 -39.73 82.83 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.381 -0.824 . . . . 0.0 109.08 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.448 HD23 ' HA ' ' A' ' 44' ' ' LEU . 8.5 mt -53.07 -44.55 67.57 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.337 -0.852 . . . . 0.0 109.831 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.846 ' HD3' HD11 ' A' ' 18' ' ' LEU . 4.7 tptp -62.74 -45.34 93.17 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.043 -1.036 . . . . 0.0 109.752 -179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.452 ' OD1' ' HA ' ' A' ' 43' ' ' ALA . 1.9 m120 -66.49 -19.96 65.92 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.421 -0.799 . . . . 0.0 109.755 -179.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.901 ' O ' ' HB3' ' A' ' 51' ' ' ALA . 0.0 OUTLIER -86.67 11.93 11.81 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.163 -0.961 . . . . 0.0 109.326 179.797 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 1.048 HG23 ' CE2' ' A' ' 28' ' ' TYR . 11.8 mm -96.55 -51.99 9.88 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.566 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 178.532 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.429 HD23 ' N ' ' A' ' 49' ' ' LEU . 7.8 mt -52.96 -22.97 6.29 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 121.357 -0.839 . . . . 0.0 108.883 178.601 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.4 mmpt? -107.68 -45.83 3.94 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.132 -0.98 . . . . 0.0 109.532 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.901 ' HB3' ' O ' ' A' ' 47' ' ' GLU . . . -92.02 44.22 1.16 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.223 -0.923 . . . . 0.0 109.429 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.72 ' CG ' HG22 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -178.2 -27.86 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.191 -0.943 . . . . 0.0 109.979 179.865 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.601 ' HB2' ' CD2' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.49 1.569 0 O-C-N 120.999 -1.063 . . . . 0.0 109.505 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.556 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.418 HD13 HG21 ' A' ' 2' ' ' ILE . 1.3 pt -114.17 60.34 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.177 -0.952 . . . . 0.0 109.817 -179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -64.63 -10.93 30.09 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.222 -0.924 . . . . 0.0 109.134 179.433 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.12 -52.95 48.34 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.382 -0.823 . . . . 0.0 110.275 -179.551 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.569 ' O ' ' CB ' ' A' ' 6' ' ' LEU . 20.5 p-90 -129.09 -138.26 0.23 Allowed 'General case' 0 C--N 1.305 -1.339 0 O-C-N 121.098 -1.001 . . . . 0.0 109.348 -179.164 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.595 ' O ' ' N ' ' A' ' 8' ' ' LYS . 1.3 tp 93.46 -4.54 0.13 Allowed 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.548 ' O ' ' N ' ' A' ' 9' ' ' ASN . 0.1 OUTLIER 40.05 -80.1 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.094 0 O-C-N 122.047 -0.408 . . . . 0.0 112.099 178.884 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.595 ' N ' ' O ' ' A' ' 6' ' ' LEU . 2.9 mtpt -35.91 -28.43 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.108 -0.995 . . . . 0.0 110.963 -179.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.743 HD21 HG22 ' A' ' 38' ' ' VAL . 2.4 p30 -47.12 -50.55 19.98 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.02 -1.05 . . . . 0.0 110.257 -179.761 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.485 ' O ' ' C ' ' A' ' 11' ' ' LYS . . . -80.83 -31.64 35.46 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.878 -1.139 . . . . 0.0 110.115 -179.571 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.693 ' O ' HD12 ' A' ' 15' ' ' ILE . 0.0 OUTLIER -33.29 -55.88 0.41 Allowed 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.533 -0.73 . . . . 0.0 111.609 -179.138 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -74.67 -50.97 15.67 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 120.868 -1.145 . . . . 0.0 111.893 -177.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -47.76 -56.97 6.18 Favored 'General case' 0 C--N 1.299 -1.626 0 O-C-N 120.555 -1.341 . . . . 0.0 110.142 -178.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.432 ' O ' ' C ' ' A' ' 15' ' ' ILE . . . -69.62 -58.28 4.13 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.147 -0.971 . . . . 0.0 110.621 -179.358 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.693 HD12 ' O ' ' A' ' 11' ' ' LYS . 65.5 mt -42.02 -30.64 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.041 -1.037 . . . . 0.0 109.607 -179.448 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.7 -51.56 40.34 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.419 -0.801 . . . . 0.0 109.438 -179.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.44 ' O ' ' CG ' ' A' ' 17' ' ' GLU . 19.9 tt0 -70.24 -5.52 28.2 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.393 -0.817 . . . . 0.0 109.405 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.768 HD13 ' O ' ' A' ' 18' ' ' LEU . 1.3 tm? -93.68 -39.8 10.59 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.39 -0.819 . . . . 0.0 109.751 -179.56 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.5 ' HD3' HG22 ' A' ' 24' ' ' THR . 0.4 OUTLIER -67.59 -23.07 65.34 Favored 'General case' 0 N--CA 1.488 1.428 0 O-C-N 121.298 -0.877 . . . . 0.0 109.733 -179.463 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.19 -26.07 16.13 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.142 -0.974 . . . . 0.0 109.381 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -52.26 -37.2 54.71 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.271 -0.893 . . . . 0.0 109.297 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 130.2 11.11 2.59 Favored Glycine 0 N--CA 1.491 2.305 0 C-N-CA 119.939 -1.124 . . . . 0.0 110.393 179.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.967 HG21 ' CE1' ' A' ' 52' ' ' HIS . 0.0 OUTLIER -127.18 154.71 37.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 120.928 -1.337 . . . . 0.0 109.708 179.813 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.5 HG22 ' HD3' ' A' ' 19' ' ' LYS . 18.0 p -140.42 19.63 2.39 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.381 -0.824 . . . . 0.0 109.021 179.663 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 3.1 t -58.01 124.28 18.78 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.377 -0.827 . . . . 0.0 109.717 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 14.5 p-10 -80.06 -1.87 41.85 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.239 -0.913 . . . . 0.0 109.405 179.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -73.69 -33.61 64.49 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.37 -0.831 . . . . 0.0 109.275 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.959 ' CE2' HG23 ' A' ' 48' ' ' ILE . 21.9 m-85 -80.59 -44.98 18.09 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.328 -0.857 . . . . 0.0 109.414 179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.627 ' CD1' HG12 ' A' ' 15' ' ' ILE . 18.3 m-30 -62.8 -53.34 55.8 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.315 -0.866 . . . . 0.0 109.859 -179.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.428 ' O ' ' OD1' ' A' ' 33' ' ' ASN . 12.0 t-20 -54.54 -41.83 70.2 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.153 -0.967 . . . . 0.0 109.044 179.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -69.73 -25.22 63.74 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.498 -0.751 . . . . 0.0 109.451 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.853 HG23 HG13 ' A' ' 41' ' ' VAL . 5.3 mt -64.43 -46.2 93.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.268 -0.895 . . . . 0.0 109.344 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.428 ' OD1' ' O ' ' A' ' 30' ' ' ASN . 1.2 p-10 -71.87 -10.47 59.81 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.03 -1.044 . . . . 0.0 109.066 179.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.405 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -96.97 -20.7 17.9 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.294 -0.879 . . . . 0.0 109.363 179.938 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.958 ' HB1' ' HB3' ' A' ' 40' ' ' GLU . . . -46.75 169.66 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.28 -0.887 . . . . 0.0 109.458 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 19.7 mtmt -84.82 -58.91 2.52 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.218 -0.926 . . . . 0.0 109.281 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.652 HG22 ' OE2' ' A' ' 40' ' ' GLU . 15.1 t -131.2 -174.16 3.31 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.254 -0.904 . . . . 0.0 109.297 179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.743 HG22 HD21 ' A' ' 9' ' ' ASN . 54.9 t -60.71 -39.99 83.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.064 -1.022 . . . . 0.0 109.256 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.564 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 3.5 mt-10 -56.2 -28.76 59.46 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 179.159 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.958 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 0.4 OUTLIER -79.62 -31.41 41.64 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 179.037 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.853 HG13 HG23 ' A' ' 32' ' ' ILE . 16.3 t -66.73 -68.05 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 N-CA-C 108.05 -1.093 . . . . 0.0 108.05 178.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 45.7 m-20 -53.16 -33.92 54.63 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.616 -0.678 . . . . 0.0 109.635 179.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.564 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -67.39 -34.95 78.33 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.339 -0.851 . . . . 0.0 110.31 -179.267 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 12.4 mt -76.95 -38.81 52.59 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.029 -1.044 . . . . 0.0 110.065 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.81 ' HG3' HD12 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -61.28 -29.57 69.94 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.169 -0.957 . . . . 0.0 109.943 -179.521 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 24.1 m-20 -71.24 -25.56 62.53 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.188 -0.945 . . . . 0.0 109.287 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.588 ' O ' ' HB3' ' A' ' 51' ' ' ALA . 2.8 tt0 -83.43 9.04 12.03 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.233 -0.917 . . . . 0.0 109.04 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.959 HG23 ' CE2' ' A' ' 28' ' ' TYR . 43.9 mt -88.34 -43.18 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 179.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.404 ' HA ' HD23 ' A' ' 49' ' ' LEU . 0.8 OUTLIER -69.94 -10.93 60.29 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.594 -0.692 . . . . 0.0 110.401 -179.89 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -120.38 -31.55 4.32 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 120.695 -1.253 . . . . 0.0 110.835 -179.253 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.588 ' HB3' ' O ' ' A' ' 47' ' ' GLU . . . -79.56 -20.07 47.91 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.881 -1.137 . . . . 0.0 110.617 -179.058 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.967 ' CE1' HG21 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -125.83 -16.79 5.58 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 120.955 -1.091 . . . . 0.0 109.9 -179.474 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.533 0 O-C-N 121.037 -1.039 . . . . 0.0 109.371 179.595 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . 0.441 ' O ' ' C ' ' A' ' 2' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.578 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.511 ' O ' ' CD1' ' A' ' 5' ' ' TRP . 1.0 OUTLIER 42.5 35.69 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.271 -0.893 . . . . 0.0 109.778 179.622 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -49.17 -18.52 0.34 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.232 -0.917 . . . . 0.0 109.833 179.735 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -74.99 13.9 0.6 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.269 -0.894 . . . . 0.0 111.338 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.531 ' CE3' ' N ' ' A' ' 6' ' ' LEU . 1.2 p-90 -57.06 -46.92 82.09 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.389 -1.444 . . . . 0.0 109.147 -179.788 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.531 ' N ' ' CE3' ' A' ' 5' ' ' TRP . 68.9 mt 48.07 16.78 0.09 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.485 -0.76 . . . . 0.0 111.394 179.373 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.568 HD11 ' CG2' ' A' ' 41' ' ' VAL . 14.2 tp 60.86 6.51 1.21 Allowed 'General case' 0 N--CA 1.497 1.903 0 O-C-N 120.652 -1.28 . . . . 0.0 110.662 179.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.51 ' HG3' ' NZ ' ' A' ' 11' ' ' LYS . 5.9 mttm -102.98 84.45 2.37 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 120.765 -1.209 . . . . 0.0 108.912 179.591 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.552 ' ND2' ' N ' ' A' ' 9' ' ' ASN . 0.0 OUTLIER -151.57 -82.26 0.1 Allowed 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 -179.806 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.57 ' O ' ' HB3' ' A' ' 14' ' ' ALA . . . -70.68 -3.65 19.57 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.252 -0.905 . . . . 0.0 109.405 179.426 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.75 ' HD2' HG22 ' A' ' 32' ' ' ILE . 0.7 OUTLIER -54.47 -53.28 56.43 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.064 -1.022 . . . . 0.0 109.94 -179.823 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -88.83 -42.1 12.08 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.049 -1.032 . . . . 0.0 109.626 -179.648 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -59.91 -16.26 28.21 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.018 -1.051 . . . . 0.0 108.747 179.44 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.57 ' HB3' ' O ' ' A' ' 10' ' ' ALA . . . -102.99 -41.46 6.11 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.355 -0.84 . . . . 0.0 108.866 179.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.575 ' CG1' ' CD1' ' A' ' 32' ' ' ILE . 22.7 mt -52.88 -33.61 19.31 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 N-CA-C 107.577 -1.268 . . . . 0.0 107.577 179.147 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -68.87 -38.88 79.99 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 179.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.534 ' O ' ' CG ' ' A' ' 17' ' ' GLU . 15.6 tt0 -90.22 4.22 51.22 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 179.228 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.602 HD23 ' HE3' ' A' ' 45' ' ' LYS . 20.1 mt -96.11 -55.33 3.0 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.262 -0.899 . . . . 0.0 108.725 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 25.5 ttpt -59.05 -40.9 86.54 Favored 'General case' 0 N--CA 1.487 1.405 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 179.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.81 -26.53 68.67 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.355 -0.841 . . . . 0.0 108.948 179.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.464 ' HB3' ' O ' ' A' ' 18' ' ' LEU . . . -53.92 -39.34 65.75 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.328 -0.857 . . . . 0.0 109.141 179.654 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 134.8 -1.72 3.94 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.742 -1.343 . . . . 0.0 109.742 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.47 HG22 ' H ' ' A' ' 25' ' ' SER . 9.4 mt -106.74 158.99 6.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.096 -1.237 . . . . 0.0 109.63 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 5.8 p -151.17 18.4 0.76 Allowed 'General case' 0 N--CA 1.489 1.497 0 O-C-N 121.414 -0.804 . . . . 0.0 108.926 179.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.47 ' H ' HG22 ' A' ' 23' ' ' ILE . 0.6 OUTLIER -62.69 -177.44 0.15 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.395 -0.816 . . . . 0.0 109.447 -179.895 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.481 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 3.4 t0 -116.18 -21.0 9.59 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.42 -0.8 . . . . 0.0 109.009 179.629 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.54 ' O ' ' CD1' ' A' ' 27' ' ' PHE . 5.7 t80 -81.04 -3.92 53.44 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 120.991 -1.068 . . . . 0.0 108.443 179.001 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.89 ' CE2' HG23 ' A' ' 48' ' ' ILE . 16.9 m-30 -109.42 -6.9 15.29 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.527 -0.733 . . . . 0.0 109.614 -179.85 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.547 ' CE1' ' HB3' ' A' ' 18' ' ' LEU . 61.6 m-85 -119.38 -43.93 2.59 Favored 'General case' 0 C--N 1.298 -1.672 0 CA-C-O 121.728 0.775 . . . . 0.0 109.381 -178.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.481 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 0.8 OUTLIER -65.5 -21.06 66.58 Favored 'General case' 0 C--N 1.295 -1.765 0 O-C-N 121.738 -0.601 . . . . 0.0 109.38 179.301 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.28 -3.1 58.71 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.224 -0.922 . . . . 0.0 109.823 -179.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.75 HG22 ' HD2' ' A' ' 11' ' ' LYS . 18.1 mt -65.27 -61.6 1.62 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.394 -0.816 . . . . 0.0 109.759 179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.539 ' HA ' ' CD ' ' A' ' 11' ' ' LYS . 0.4 OUTLIER -65.29 -9.46 24.42 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.196 -0.94 . . . . 0.0 109.807 -179.617 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.455 ' O ' ' O ' ' A' ' 35' ' ' ALA . 18.7 mmtm -93.62 -19.1 21.47 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.189 -0.945 . . . . 0.0 109.395 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.564 ' HB1' ' HB3' ' A' ' 40' ' ' GLU . . . -55.17 -164.52 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.413 -0.805 . . . . 0.0 109.72 -179.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -117.7 -63.89 1.37 Allowed 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.191 -0.943 . . . . 0.0 109.715 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.596 ' O ' HG23 ' A' ' 41' ' ' VAL . 21.4 p -120.02 178.22 4.7 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.166 -0.958 . . . . 0.0 109.444 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.452 HG22 ' ND2' ' A' ' 9' ' ' ASN . 86.6 t -62.33 -43.45 98.11 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.334 -0.854 . . . . 0.0 109.157 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.706 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 0.0 OUTLIER -57.08 -26.33 60.24 Favored 'General case' 0 C--N 1.297 -1.678 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 179.135 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.564 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -80.69 -33.98 34.99 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 178.896 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.615 HG13 HG23 ' A' ' 32' ' ' ILE . 14.6 t -65.27 -64.53 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.372 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 178.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 55.9 m-80 -56.34 -31.96 64.24 Favored 'General case' 0 N--CA 1.487 1.424 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.03 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.706 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -59.5 -42.34 91.96 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.25 -0.906 . . . . 0.0 108.722 179.569 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.411 ' HB2' ' O ' ' A' ' 41' ' ' VAL . 2.3 mt -49.8 -54.57 18.37 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.407 -0.808 . . . . 0.0 109.89 179.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.84 ' HA ' HD12 ' A' ' 48' ' ' ILE . 17.1 tptp -49.61 -34.62 18.46 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.094 -1.004 . . . . 0.0 109.607 -179.599 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.407 ' HA ' HD21 ' A' ' 49' ' ' LEU . 2.8 m-20 -67.53 -48.77 66.03 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.26 -0.9 . . . . 0.0 109.428 -179.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.45 ' O ' ' HB3' ' A' ' 51' ' ' ALA . 0.1 OUTLIER -74.27 -0.95 18.62 Favored 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.057 -1.027 . . . . 0.0 109.176 179.333 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.89 HG23 ' CE2' ' A' ' 28' ' ' TYR . 20.4 mt -87.63 -53.3 10.18 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.363 0 O-C-N 121.237 -0.914 . . . . 0.0 108.649 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.565 HD23 ' O ' ' A' ' 45' ' ' LYS . 0.6 OUTLIER -67.03 -18.7 65.49 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.046 -1.033 . . . . 0.0 108.424 179.12 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -89.9 -41.23 11.91 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 179.246 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.45 ' HB3' ' O ' ' A' ' 47' ' ' GLU . . . -89.56 13.7 13.32 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 178.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.706 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 0.0 OUTLIER -166.76 164.68 16.58 Favored 'General case' 0 C--N 1.304 -1.389 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 -179.731 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.706 ' HB3' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.493 1.687 0 CA-C-O 118.005 -0.998 . . . . 0.0 109.287 -179.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 1.6 m . . . . . 0 N--CA 1.49 1.555 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 1.8 mt -131.87 61.66 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.183 -0.948 . . . . 0.0 110.036 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -86.11 15.81 4.8 Favored 'General case' 0 N--CA 1.487 1.395 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.101 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.506 ' O ' ' O ' ' A' ' 5' ' ' TRP . 0.6 OUTLIER -99.75 14.42 30.29 Favored 'General case' 0 N--CA 1.483 1.215 0 O-C-N 121.623 -0.673 . . . . 0.0 109.892 -179.407 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.616 ' CE3' ' HG ' ' A' ' 6' ' ' LEU . 2.4 t90 -53.45 -107.3 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.32 -0.862 . . . . 0.0 109.626 -179.699 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.616 ' HG ' ' CE3' ' A' ' 5' ' ' TRP . 0.5 OUTLIER 158.94 19.11 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.194 0 O-C-N 120.813 -1.179 . . . . 0.0 112.336 178.982 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.882 HD21 HG21 ' A' ' 41' ' ' VAL . 0.6 OUTLIER 25.97 -134.77 0.01 OUTLIER 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.339 -0.851 . . . . 0.0 110.92 178.893 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.503 ' H ' HD22 ' A' ' 7' ' ' LEU . 7.8 mttp 64.69 33.91 10.12 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.776 -1.203 . . . . 0.0 109.866 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.731 ' ND2' HD23 ' A' ' 7' ' ' LEU . 4.5 p30 -129.23 -48.98 1.19 Allowed 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 179.194 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.77 ' HB2' HG13 ' A' ' 38' ' ' VAL . . . -81.77 -7.16 59.57 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.308 -0.87 . . . . 0.0 109.115 178.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.749 ' O ' HD12 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -37.89 -46.48 0.96 Allowed 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.555 -0.716 . . . . 0.0 110.512 -179.503 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -97.93 -22.18 16.46 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.005 -1.059 . . . . 0.0 110.455 -179.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 93.2 m-20 -61.27 -41.93 97.77 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.069 -1.02 . . . . 0.0 110.483 -179.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.548 ' CB ' ' HA ' ' A' ' 42' ' ' ASN . . . -85.41 -40.31 16.59 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.03 -1.044 . . . . 0.0 109.893 -179.631 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 1.001 HG23 ' CE1' ' A' ' 29' ' ' PHE . 67.2 mt -61.08 -27.04 40.86 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.542 0 CA-C-O 121.566 0.698 . . . . 0.0 109.81 -179.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -65.12 -7.1 10.87 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.643 -0.661 . . . . 0.0 110.743 -178.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.465 ' OE2' ' OD1' ' A' ' 46' ' ' ASN . 2.9 pt-20 -109.35 -8.55 15.05 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 121.022 -1.049 . . . . 0.0 109.51 -179.515 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.637 HD11 HG21 ' A' ' 48' ' ' ILE . 0.6 OUTLIER -100.65 -46.81 5.06 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.19 -0.943 . . . . 0.0 110.125 179.946 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 27.8 ttmt -52.75 -39.38 62.13 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.126 -0.984 . . . . 0.0 109.934 -179.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -31.27 71.86 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.195 -0.94 . . . . 0.0 109.613 -179.759 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.52 -49.07 78.19 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.19 -0.944 . . . . 0.0 109.239 179.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 135.46 -8.88 4.34 Favored Glycine 0 N--CA 1.489 2.193 0 N-CA-C 109.661 -1.376 . . . . 0.0 109.661 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.617 HD13 ' NE2' ' A' ' 52' ' ' HIS . 48.8 mt -75.08 122.98 29.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.213 -1.169 . . . . 0.0 109.499 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -117.86 19.08 13.88 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.388 -0.82 . . . . 0.0 109.43 179.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.48 121.58 15.22 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.292 -0.88 . . . . 0.0 109.52 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.42 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 0.3 OUTLIER -74.41 -1.68 22.08 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.238 -0.914 . . . . 0.0 109.598 179.87 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.69 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 4.5 t80 -76.64 -14.99 59.93 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.235 -0.915 . . . . 0.0 109.175 -179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.714 ' HB3' HD11 ' A' ' 48' ' ' ILE . 62.3 m-85 -104.27 -33.37 8.7 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.421 -0.799 . . . . 0.0 109.073 179.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 1.001 ' CE1' HG23 ' A' ' 15' ' ' ILE . 8.7 m-85 -71.44 -47.37 56.2 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.362 -0.836 . . . . 0.0 108.805 179.082 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.461 ' O ' ' HD2' ' A' ' 34' ' ' LYS . 0.1 OUTLIER -61.33 -29.77 70.1 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.374 -0.829 . . . . 0.0 109.561 179.821 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.6 -22.4 50.91 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.268 -0.895 . . . . 0.0 109.462 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.71 HD13 ' O ' ' A' ' 28' ' ' TYR . 1.2 mp -65.18 -42.54 94.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.301 -0.874 . . . . 0.0 108.932 179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 31.2 t30 -80.81 8.29 8.52 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.168 -0.957 . . . . 0.0 110.222 -179.773 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.479 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.2 OUTLIER -122.14 -14.47 7.95 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.027 -1.046 . . . . 0.0 110.034 -179.746 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.803 ' HB2' HD12 ' A' ' 44' ' ' LEU . . . -47.65 -102.54 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.36 -0.838 . . . . 0.0 110.599 -179.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.55 ' C ' HD12 ' A' ' 7' ' ' LEU . 0.9 OUTLIER -171.05 -68.71 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.803 -1.185 . . . . 0.0 109.565 -179.311 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.938 ' O ' HG23 ' A' ' 41' ' ' VAL . 33.3 p -123.41 -167.72 1.66 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.313 -0.867 . . . . 0.0 109.399 -179.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.77 HG13 ' HB2' ' A' ' 10' ' ' ALA . 26.1 t -64.85 -53.9 36.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.152 -0.968 . . . . 0.0 109.372 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.56 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 9.2 pt-20 -52.97 -27.32 18.51 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.273 -0.892 . . . . 0.0 109.469 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.615 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 2.8 mm-40 -81.08 -33.09 33.63 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.167 -0.958 . . . . 0.0 109.001 179.507 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.938 HG23 ' O ' ' A' ' 37' ' ' THR . 15.6 t -70.61 -62.35 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.391 -0.818 . . . . 0.0 108.959 179.582 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.548 ' HA ' ' CB ' ' A' ' 14' ' ' ALA . 69.1 m-80 -57.12 -31.7 65.58 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.467 -0.771 . . . . 0.0 109.61 179.54 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.56 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -67.36 -40.47 85.8 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.181 -0.949 . . . . 0.0 109.058 179.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.803 HD12 ' HB2' ' A' ' 35' ' ' ALA . 6.0 mt -61.91 -48.52 80.08 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.313 -0.867 . . . . 0.0 110.704 -179.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.645 ' HD2' HD11 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -65.73 -24.94 67.08 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.868 -1.145 . . . . 0.0 110.356 -178.898 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.465 ' OD1' ' OE2' ' A' ' 17' ' ' GLU . 41.1 m-20 -80.94 -25.1 37.66 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.964 -1.085 . . . . 0.0 110.398 -179.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.434 ' O ' ' N ' ' A' ' 51' ' ' ALA . 0.3 OUTLIER -77.69 -18.97 56.08 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.986 -1.072 . . . . 0.0 110.412 -179.365 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.714 HD11 ' HB3' ' A' ' 28' ' ' TYR . 1.1 mt -66.14 -29.06 45.55 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.084 -1.01 . . . . 0.0 108.989 179.528 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.466 ' O ' ' OXT' ' A' ' 53' ' ' ALA . 1.4 mm? -60.34 -25.66 65.99 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.037 -1.039 . . . . 0.0 109.19 179.373 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -128.59 6.37 5.67 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.062 -1.024 . . . . 0.0 109.87 -179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.445 ' HB3' ' HA ' ' A' ' 48' ' ' ILE . . . -101.0 -19.52 15.8 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.283 -0.886 . . . . 0.0 109.496 179.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.617 ' NE2' HD13 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -143.36 8.55 1.59 Allowed 'General case' 0 C--N 1.303 -1.454 0 C-N-CA 119.573 -0.851 . . . . 0.0 110.156 -178.398 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.466 ' OXT' ' O ' ' A' ' 49' ' ' LEU . . . . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 117.999 -1.0 . . . . 0.0 109.596 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 14.6 t . . . . . 0 N--CA 1.491 1.575 0 CA-C-O 121.315 0.579 . . . . 0.0 109.633 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.537 ' CG1' ' O ' ' A' ' 2' ' ' ILE . 2.1 tt -170.1 33.3 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 O-C-N 121.246 -0.908 . . . . 0.0 109.353 179.735 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.71 -10.83 50.85 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 121.056 -1.028 . . . . 0.0 108.634 179.266 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -71.88 -23.32 61.48 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.388 -0.82 . . . . 0.0 109.291 179.77 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.491 ' O ' ' N ' ' A' ' 7' ' ' LEU . 1.3 t90 -52.32 -48.5 65.41 Favored 'General case' 0 C--N 1.306 -1.304 0 O-C-N 121.242 -0.911 . . . . 0.0 110.86 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.48 ' O ' ' HB3' ' A' ' 7' ' ' LEU . 44.7 mt -38.68 -28.83 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.325 -0.859 . . . . 0.0 110.247 -178.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 1.094 HD11 HG21 ' A' ' 41' ' ' VAL . 20.5 tp 62.38 113.74 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.261 -0.899 . . . . 0.0 109.773 179.365 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.554 ' CG ' ' O ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER 179.26 40.37 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 179.647 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.827 ' OD1' HG22 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -110.73 -61.98 1.6 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.366 -0.834 . . . . 0.0 109.799 -178.984 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -81.15 10.98 4.56 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.251 -0.906 . . . . 0.0 109.709 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.488 ' O ' HG13 ' A' ' 15' ' ' ILE . 0.1 OUTLIER -50.98 -78.15 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.028 -1.045 . . . . 0.0 110.505 -179.244 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 24.6 tt0 -88.16 -18.34 28.98 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.011 -1.056 . . . . 0.0 110.94 -178.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -61.08 -39.48 90.06 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 120.826 -1.171 . . . . 0.0 109.308 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.522 ' O ' HD23 ' A' ' 18' ' ' LEU . . . -85.86 -45.93 11.09 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.27 -0.894 . . . . 0.0 109.254 179.724 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.808 HG23 ' CE1' ' A' ' 29' ' ' PHE . 95.2 mt -50.49 -29.23 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.535 -0.728 . . . . 0.0 110.288 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -61.3 -39.05 89.04 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.407 -0.808 . . . . 0.0 110.145 -178.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.416 ' C ' HD22 ' A' ' 18' ' ' LEU . 12.8 tt0 -83.37 -2.02 54.77 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.411 -0.806 . . . . 0.0 110.969 -178.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.522 HD23 ' O ' ' A' ' 14' ' ' ALA . 4.1 mm? -98.1 -38.01 9.51 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.814 -1.179 . . . . 0.0 110.066 -179.685 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -50.66 -38.92 49.12 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.237 -0.914 . . . . 0.0 109.736 -179.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.9 ttpt -71.51 -32.78 68.59 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.015 -1.053 . . . . 0.0 109.263 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -56.62 -22.21 32.44 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.259 -0.901 . . . . 0.0 109.582 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.444 ' O ' ' N ' ' A' ' 24' ' ' THR . . . 106.26 -41.14 2.25 Favored Glycine 0 N--CA 1.492 2.39 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.536 HD13 ' CG2' ' A' ' 48' ' ' ILE . 46.8 mt -52.01 94.2 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.3 -1.118 . . . . 0.0 109.397 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.444 ' N ' ' O ' ' A' ' 22' ' ' GLY . 0.8 OUTLIER -97.27 19.8 12.53 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.22 -0.925 . . . . 0.0 109.848 -179.843 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -60.98 150.85 32.14 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.119 -0.988 . . . . 0.0 109.752 -179.981 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -96.77 -8.18 31.86 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.244 -0.91 . . . . 0.0 109.276 179.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.514 ' O ' ' CD1' ' A' ' 27' ' ' PHE . 8.4 t80 -80.65 -8.8 59.75 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.038 -1.039 . . . . 0.0 109.476 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.656 ' CE2' HG23 ' A' ' 48' ' ' ILE . 18.6 m-30 -106.18 -15.33 14.89 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.384 -0.823 . . . . 0.0 109.207 179.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.808 ' CE1' HG23 ' A' ' 15' ' ' ILE . 10.7 m-30 -104.66 -49.75 3.46 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.577 -0.702 . . . . 0.0 109.376 -179.783 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -64.61 -41.23 96.34 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.244 -0.91 . . . . 0.0 109.35 179.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.7 1.27 20.45 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.228 -0.92 . . . . 0.0 109.775 -179.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.613 ' HA ' HD21 ' A' ' 44' ' ' LEU . 0.1 OUTLIER -72.96 -41.45 60.13 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 O-C-N 121.154 -0.966 . . . . 0.0 109.017 179.914 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 23.0 p30 -80.19 -0.78 37.66 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.339 -0.851 . . . . 0.0 109.576 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.497 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -107.03 -16.54 14.41 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.264 -0.898 . . . . 0.0 109.752 -179.563 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.634 ' HB1' ' OE1' ' A' ' 40' ' ' GLU . . . -39.61 -98.91 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.641 -0.662 . . . . 0.0 110.624 -179.273 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.518 ' CG ' ' O ' ' A' ' 35' ' ' ALA . 5.3 mttt -171.15 -69.28 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 120.993 -1.067 . . . . 0.0 109.027 -179.235 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.855 ' O ' HG23 ' A' ' 41' ' ' VAL . 5.1 t -127.94 -177.65 4.21 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.827 HG22 ' OD1' ' A' ' 9' ' ' ASN . 4.6 t -61.53 -48.87 86.79 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 O-C-N 120.909 -1.119 . . . . 0.0 109.661 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.554 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 1.1 tt0 -61.35 -18.47 58.81 Favored 'General case' 0 C--N 1.296 -1.749 0 O-C-N 121.087 -1.008 . . . . 0.0 109.103 -179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.634 ' OE1' ' HB1' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -90.78 -26.15 19.61 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.208 -0.932 . . . . 0.0 109.019 179.657 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 1.094 HG21 HD11 ' A' ' 7' ' ' LEU . 20.2 t -76.09 -54.75 12.92 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.398 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 179.007 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 69.6 m-80 -66.68 -28.49 68.49 Favored 'General case' 0 C--N 1.302 -1.474 0 O-C-N 121.514 -0.741 . . . . 0.0 109.493 179.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.554 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -76.99 -23.97 52.26 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.201 -0.937 . . . . 0.0 109.678 -179.68 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.681 ' C ' HD12 ' A' ' 44' ' ' LEU . 0.3 OUTLIER -78.75 -41.23 31.24 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.162 -0.961 . . . . 0.0 109.86 -179.581 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.83 ' HA ' HD13 ' A' ' 48' ' ' ILE . 6.4 mmtt -61.58 -35.17 77.05 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.959 -1.088 . . . . 0.0 109.592 -179.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.2 m-20 -70.39 -23.5 62.78 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.083 -1.01 . . . . 0.0 108.457 179.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.552 ' O ' ' HB3' ' A' ' 51' ' ' ALA . 2.2 tt0 -78.85 1.56 23.0 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.5 -0.75 . . . . 0.0 109.038 179.183 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.83 HD13 ' HA ' ' A' ' 45' ' ' LYS . 1.7 mp -79.33 -33.16 15.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 179.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.545 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 23.1 tp -69.98 -30.86 68.3 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 121.426 -0.796 . . . . 0.0 109.938 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 28.6 mttt -102.79 -14.89 16.43 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.025 -1.047 . . . . 0.0 110.01 -179.546 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.552 ' HB3' ' O ' ' A' ' 47' ' ' GLU . . . -100.77 19.69 16.67 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.154 -0.966 . . . . 0.0 109.72 -179.768 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -165.52 -44.26 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.272 -0.892 . . . . 0.0 109.153 -179.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.545 ' HB3' ' O ' ' A' ' 49' ' ' LEU . . . . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 117.953 -1.023 . . . . 0.0 109.558 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 13.9 t . . . . . 0 N--CA 1.491 1.597 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.405 ' C ' ' N ' ' A' ' 4' ' ' GLN . 0.2 OUTLIER -147.37 26.32 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.184 -0.948 . . . . 0.0 110.183 -179.622 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -55.34 -18.71 7.03 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 177.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.405 ' N ' ' C ' ' A' ' 2' ' ' ILE . 24.5 mt-30 -94.04 55.39 2.07 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.517 ' O ' ' N ' ' A' ' 7' ' ' LEU . 5.0 p-90 -79.43 -56.69 4.14 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.884 -1.135 . . . . 0.0 109.829 -179.605 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.865 ' N ' HD12 ' A' ' 6' ' ' LEU . 4.6 mp 38.34 25.42 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.595 -0.691 . . . . 0.0 111.02 179.766 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.81 HD11 ' CG2' ' A' ' 41' ' ' VAL . 42.1 tp 67.09 -10.09 0.34 Allowed 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.12 -0.988 . . . . 0.0 112.012 179.547 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -99.48 90.82 4.65 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 120.35 -1.469 . . . . 0.0 109.233 -179.743 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.6 ' ND2' HG22 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -161.93 -87.82 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.413 -0.804 . . . . 0.0 109.189 -179.572 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.43 ' HB3' HG13 ' A' ' 38' ' ' VAL . . . -54.45 -18.3 4.09 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.333 -0.854 . . . . 0.0 109.687 179.782 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.462 ' O ' HG13 ' A' ' 15' ' ' ILE . 0.4 OUTLIER -57.82 -71.46 0.11 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.237 -0.915 . . . . 0.0 110.181 -179.471 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -64.29 -28.54 69.79 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.002 -1.061 . . . . 0.0 110.013 -179.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -61.77 -31.87 72.1 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 120.975 -1.078 . . . . 0.0 109.125 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.28 -58.25 2.83 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.312 -0.868 . . . . 0.0 108.775 179.323 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.597 HG23 ' CE1' ' A' ' 29' ' ' PHE . 8.3 mt -43.33 -35.22 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 O-C-N 121.531 -0.731 . . . . 0.0 110.413 179.717 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -77.15 29.26 0.14 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.294 -0.879 . . . . 0.0 110.652 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -151.66 -36.62 0.13 Allowed 'General case' 0 C--N 1.304 -1.374 0 N-CA-C 107.852 -1.166 . . . . 0.0 107.852 179.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.619 HD12 ' HE3' ' A' ' 45' ' ' LYS . 14.9 mt -78.72 -31.31 46.34 Favored 'General case' 0 C--N 1.306 -1.287 0 O-C-N 121.64 -0.662 . . . . 0.0 109.558 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.9 tttt -58.95 -21.53 58.5 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.131 -0.981 . . . . 0.0 109.674 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 41.1 mtmt -84.03 -25.91 29.51 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.289 -0.882 . . . . 0.0 109.527 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.32 -4.06 13.11 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.27 -0.894 . . . . 0.0 109.773 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 102.36 -34.73 5.49 Favored Glycine 0 N--CA 1.488 2.149 0 N-CA-C 108.966 -1.654 . . . . 0.0 108.966 -179.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.472 ' O ' ' CG2' ' A' ' 23' ' ' ILE . 0.0 OUTLIER -46.9 117.67 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.468 0 O-C-N 121.44 -1.035 . . . . 0.0 108.864 179.735 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -127.39 6.77 6.36 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.08 -1.013 . . . . 0.0 110.042 -179.661 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -54.01 121.1 7.35 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.237 -0.914 . . . . 0.0 109.222 179.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.471 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 33.3 m-20 -73.51 -1.4 18.4 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.083 -1.01 . . . . 0.0 109.641 -179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.466 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 3.2 t80 -80.82 -39.79 26.02 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.034 -1.041 . . . . 0.0 109.247 179.884 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 1.079 ' CE2' HG23 ' A' ' 48' ' ' ILE . 21.7 m-30 -74.83 -25.03 58.72 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.472 -0.768 . . . . 0.0 110.129 -179.467 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.597 ' CE1' HG23 ' A' ' 15' ' ' ILE . 11.7 m-85 -94.97 -49.93 5.33 Favored 'General case' 0 C--N 1.297 -1.677 0 O-C-N 121.271 -0.893 . . . . 0.0 110.205 -178.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.471 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 66.3 m-20 -61.0 -35.77 77.72 Favored 'General case' 0 C--N 1.297 -1.704 0 O-C-N 121.152 -0.968 . . . . 0.0 109.476 179.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.432 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . . . -85.26 -4.39 59.14 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.256 -0.903 . . . . 0.0 110.328 -179.033 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.551 ' CD1' ' HE2' ' A' ' 45' ' ' LYS . 0.4 OUTLIER -62.59 -44.82 99.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.074 -1.016 . . . . 0.0 109.554 -179.67 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -77.82 -5.63 51.46 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.14 -0.975 . . . . 0.0 109.489 179.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.452 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.8 OUTLIER -77.99 -22.86 48.72 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.244 -0.91 . . . . 0.0 109.607 -179.92 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.901 ' HB1' ' HB3' ' A' ' 40' ' ' GLU . . . -51.53 -175.47 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.216 -0.928 . . . . 0.0 109.973 -179.683 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.446 ' H ' ' CB ' ' A' ' 40' ' ' GLU . 0.5 OUTLIER -106.58 -54.04 2.53 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.498 -0.751 . . . . 0.0 109.096 179.824 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.686 ' O ' HG23 ' A' ' 41' ' ' VAL . 51.9 p -123.61 -172.95 2.63 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.312 -0.868 . . . . 0.0 109.24 179.752 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.6 HG22 ' ND2' ' A' ' 9' ' ' ASN . 67.4 t -66.91 -26.17 36.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.111 -0.993 . . . . 0.0 109.474 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.722 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 63.7 mt-10 -73.12 -29.18 62.71 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 179.381 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.901 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 2.9 mm-40 -79.23 -32.54 43.94 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 108.25 -1.018 . . . . 0.0 108.25 178.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.81 ' CG2' HD11 ' A' ' 7' ' ' LEU . 21.1 t -68.61 -68.37 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -51.3 -28.27 11.63 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 179.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.722 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -64.21 -50.34 68.45 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.43 -0.794 . . . . 0.0 109.031 179.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.9 mt -54.98 -44.0 74.05 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.29 -0.882 . . . . 0.0 109.881 -179.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.655 ' NZ ' HD11 ' A' ' 48' ' ' ILE . 0.3 OUTLIER -57.64 -40.53 79.45 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.16 -0.963 . . . . 0.0 109.162 179.862 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 67.5 m-20 -69.65 -21.87 63.5 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.263 -0.898 . . . . 0.0 109.622 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.67 ' O ' ' HB3' ' A' ' 51' ' ' ALA . 1.4 mt-10 -82.96 10.27 8.27 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.212 -0.93 . . . . 0.0 109.314 179.488 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 1.079 HG23 ' CE2' ' A' ' 28' ' ' TYR . 62.0 mt -90.03 -45.02 15.1 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 179.154 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 7.4 mp -61.72 -21.48 64.53 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.436 -0.79 . . . . 0.0 109.681 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -106.42 -43.22 4.82 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.902 -1.124 . . . . 0.0 109.906 -179.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.67 ' HB3' ' O ' ' A' ' 47' ' ' GLU . . . -84.71 43.15 0.96 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.163 -0.961 . . . . 0.0 109.134 179.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.725 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 0.4 OUTLIER 163.14 157.03 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 -179.54 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.725 ' HB3' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 118.037 -0.982 . . . . 0.0 109.425 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 7.7 p . . . . . 0 N--CA 1.491 1.582 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.488 ' O ' HG12 ' A' ' 2' ' ' ILE . 17.4 tt -136.62 36.66 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.203 -0.936 . . . . 0.0 109.69 -179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -69.57 -6.67 32.56 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.176 -0.953 . . . . 0.0 108.576 178.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -91.56 57.45 3.29 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.466 -0.771 . . . . 0.0 109.917 -179.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.444 ' O ' ' HB2' ' A' ' 6' ' ' LEU . 1.3 t90 -56.32 -87.61 0.0 OUTLIER 'General case' 0 C--N 1.304 -1.395 0 O-C-N 120.977 -1.077 . . . . 0.0 111.123 -179.24 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.444 ' HB2' ' O ' ' A' ' 5' ' ' TRP . 0.7 OUTLIER 179.23 -44.94 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.601 -1.312 . . . . 0.0 109.389 -179.792 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.915 HD21 ' CG2' ' A' ' 41' ' ' VAL . 0.7 OUTLIER -139.09 -106.12 0.17 Allowed 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.362 -0.837 . . . . 0.0 109.108 179.805 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.632 ' H ' HD23 ' A' ' 7' ' ' LEU . 0.4 OUTLIER 41.97 35.95 0.61 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.073 -1.017 . . . . 0.0 109.867 179.731 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.488 ' ND2' ' HG ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER -87.36 -75.08 0.42 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.249 -0.907 . . . . 0.0 108.714 179.705 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -81.87 29.73 0.39 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.184 -0.947 . . . . 0.0 110.396 179.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.768 ' O ' HD12 ' A' ' 15' ' ' ILE . 0.4 OUTLIER -63.81 -42.86 97.59 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 120.788 -1.195 . . . . 0.0 109.915 -179.715 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.519 ' O ' ' HB2' ' A' ' 16' ' ' ALA . 1.5 tt0 -96.01 -26.04 15.7 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.048 -1.033 . . . . 0.0 110.437 -179.241 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.0 t0 -65.83 -56.43 11.93 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 120.822 -1.174 . . . . 0.0 110.146 -179.341 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.64 ' HB1' ' HD2' ' A' ' 45' ' ' LYS . . . -69.77 -46.78 65.03 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.203 -0.936 . . . . 0.0 110.009 -179.531 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 1.052 HG23 ' CZ ' ' A' ' 29' ' ' PHE . 46.0 mt -57.85 -29.59 35.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 CA-C-O 121.718 0.77 . . . . 0.0 109.652 -179.699 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.519 ' HB2' ' O ' ' A' ' 12' ' ' GLU . . . -61.79 -6.8 2.92 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.51 -0.744 . . . . 0.0 111.284 -178.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.589 ' HB3' ' HZ2' ' A' ' 45' ' ' LYS . 28.6 tt0 -105.39 -22.61 12.99 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 120.906 -1.121 . . . . 0.0 109.996 -179.365 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.987 HD21 HD12 ' A' ' 48' ' ' ILE . 0.7 OUTLIER -76.78 -35.98 57.31 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.924 -1.11 . . . . 0.0 109.449 -179.87 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.7 ttmt -50.34 -35.12 26.35 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.323 -0.861 . . . . 0.0 109.843 -179.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.85 -21.77 21.29 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.141 -0.974 . . . . 0.0 109.746 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.27 -28.13 69.52 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.154 -0.966 . . . . 0.0 109.17 179.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 115.61 -16.93 16.37 Favored Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.643 -1.383 . . . . 0.0 109.643 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.668 HD13 HG21 ' A' ' 48' ' ' ILE . 67.4 mt -84.19 115.13 25.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.198 -1.178 . . . . 0.0 109.798 -179.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.414 ' O ' ' C ' ' A' ' 25' ' ' SER . 0.0 OUTLIER -117.47 0.45 12.15 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.187 -0.946 . . . . 0.0 109.302 179.36 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.414 ' C ' ' O ' ' A' ' 24' ' ' THR . 49.6 m -44.75 157.44 0.07 Allowed 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.177 -0.952 . . . . 0.0 109.45 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.463 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 4.8 p-10 -104.11 -7.17 20.42 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.22 -0.925 . . . . 0.0 109.866 -179.621 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.563 ' O ' ' CG ' ' A' ' 27' ' ' PHE . 27.0 t80 -80.54 1.3 30.13 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.982 -1.073 . . . . 0.0 109.55 -179.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.961 ' CE2' HG23 ' A' ' 48' ' ' ILE . 15.6 m-85 -117.34 -50.66 2.54 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 108.342 -0.984 . . . . 0.0 108.342 179.205 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 1.052 ' CZ ' HG23 ' A' ' 15' ' ' ILE . 1.2 m-30 -66.41 -38.83 88.34 Favored 'General case' 0 C--N 1.302 -1.48 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 179.121 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.463 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 12.0 m-20 -69.76 -34.33 73.64 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.209 -0.932 . . . . 0.0 108.833 179.435 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -78.91 -15.42 58.35 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.476 -0.765 . . . . 0.0 109.471 -179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 1.111 HG23 HG13 ' A' ' 41' ' ' VAL . 1.3 mm -53.12 -27.72 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.251 -0.905 . . . . 0.0 108.968 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.457 ' OD1' ' O ' ' A' ' 30' ' ' ASN . 2.2 p-10 -80.38 -33.32 37.24 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.031 -1.043 . . . . 0.0 109.486 179.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.46 ' O ' ' O ' ' A' ' 35' ' ' ALA . 0.0 OUTLIER -54.71 -27.98 44.61 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.245 -0.909 . . . . 0.0 109.428 179.986 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.716 ' HB2' HD12 ' A' ' 44' ' ' LEU . . . -44.99 169.27 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.288 -0.883 . . . . 0.0 109.476 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.3 mttp -99.0 -47.0 5.4 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.319 -0.863 . . . . 0.0 109.455 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.627 ' O ' HG23 ' A' ' 41' ' ' VAL . 70.6 p -126.73 -163.08 1.2 Allowed 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.208 -0.932 . . . . 0.0 109.388 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.484 HG22 HD22 ' A' ' 9' ' ' ASN . 87.3 t -70.56 -54.98 15.96 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 O-C-N 121.301 -0.874 . . . . 0.0 109.317 179.818 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.685 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 3.2 tt0 -53.33 -27.94 26.02 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.275 -0.891 . . . . 0.0 109.228 179.755 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.596 ' HB2' ' HB1' ' A' ' 35' ' ' ALA . 4.8 mm-40 -79.07 -35.38 42.54 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.223 -1.028 . . . . 0.0 108.223 179.295 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 1.111 HG13 HG23 ' A' ' 32' ' ' ILE . 55.4 t -65.76 -67.18 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.435 0 N-CA-C 108.072 -1.085 . . . . 0.0 108.072 178.685 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.484 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 7.4 m-20 -53.9 -30.71 47.29 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.674 -0.641 . . . . 0.0 109.537 179.228 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.685 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -66.14 -39.89 90.2 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.215 -0.928 . . . . 0.0 109.457 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.716 HD12 ' HB2' ' A' ' 35' ' ' ALA . 4.0 mt -61.67 -43.11 99.48 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.262 -0.899 . . . . 0.0 110.699 -179.451 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.942 ' HE2' HD13 ' A' ' 18' ' ' LEU . 0.0 OUTLIER -67.32 -43.51 81.42 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.846 -1.159 . . . . 0.0 109.883 -179.163 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.475 ' N ' ' CG ' ' A' ' 45' ' ' LYS . 28.0 m-20 -69.35 -21.47 63.81 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.108 -0.995 . . . . 0.0 108.69 179.626 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.426 ' HB2' ' O ' ' A' ' 43' ' ' ALA . 1.3 tm-20 -73.32 -12.71 60.93 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.89 -0.781 . . . . 0.0 108.89 179.638 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.987 HD12 HD21 ' A' ' 18' ' ' LEU . 53.9 mt -65.81 -41.08 89.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 179.082 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.2 mp -50.76 -29.47 11.56 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.78 -0.575 . . . . 0.0 110.353 -179.728 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.45 ' O ' ' CD ' ' A' ' 50' ' ' LYS . 0.1 OUTLIER -111.99 -13.89 13.54 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 120.778 -1.201 . . . . 0.0 110.675 -179.228 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -100.9 20.49 15.32 Favored 'General case' 0 C--N 1.299 -1.624 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 179.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.879 ' CD2' HG22 ' A' ' 48' ' ' ILE . 0.0 OUTLIER 173.47 155.21 0.11 Allowed 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.84 -1.171 . . . . 0.0 107.84 -179.248 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.715 ' HB3' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.492 1.654 0 CA-C-O 117.943 -1.027 . . . . 0.0 109.252 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 17.8 m . . . . . 0 N--CA 1.49 1.525 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.669 HD13 ' O ' ' A' ' 2' ' ' ILE . 0.0 OUTLIER -109.82 24.02 3.79 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 O-C-N 121.294 -0.879 . . . . 0.0 109.525 -179.833 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.5 p30 -90.36 29.37 1.28 Allowed 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.095 -1.003 . . . . 0.0 108.661 179.105 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -99.88 53.4 0.92 Allowed 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.508 -0.745 . . . . 0.0 109.946 -179.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.631 ' O ' ' CB ' ' A' ' 6' ' ' LEU . 27.3 p-90 -114.49 -133.25 0.34 Allowed 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.109 -1.071 . . . . 0.0 108.109 179.286 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.631 ' CB ' ' O ' ' A' ' 5' ' ' TRP . 17.8 tp 101.11 -14.21 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.536 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 1.006 HD22 ' O ' ' A' ' 36' ' ' LYS . 5.1 tp 74.88 -68.75 0.2 Allowed 'General case' 0 N--CA 1.499 1.981 0 CA-C-O 120.944 0.402 . . . . 0.0 110.459 179.319 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.493 ' HB3' ' HD3' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -56.25 -12.84 1.75 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.889 -1.132 . . . . 0.0 110.13 179.806 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.785 HD21 HG22 ' A' ' 38' ' ' VAL . 0.8 OUTLIER -56.97 -41.2 77.93 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 120.991 -1.068 . . . . 0.0 110.032 -179.963 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.76 ' HB3' HG11 ' A' ' 41' ' ' VAL . . . -80.22 -9.54 59.73 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.218 -0.926 . . . . 0.0 110.401 -179.213 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.493 ' HD3' ' HB3' ' A' ' 8' ' ' LYS . 36.4 mtpt -45.26 -69.89 0.12 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.118 -0.989 . . . . 0.0 110.152 -179.44 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -90.79 -20.67 22.09 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.05 -1.031 . . . . 0.0 110.322 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.82 -30.86 71.8 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 120.911 -1.118 . . . . 0.0 109.426 -179.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.549 ' O ' ' CD2' ' A' ' 18' ' ' LEU . . . -93.77 -49.04 6.03 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.685 -0.858 . . . . 0.0 108.685 179.458 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.863 HG23 ' CE1' ' A' ' 29' ' ' PHE . 70.0 mt -53.65 -27.32 14.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 CA-C-O 121.547 0.689 . . . . 0.0 110.65 179.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.4 -3.05 1.21 Allowed 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.444 -0.785 . . . . 0.0 111.351 -178.39 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -122.31 -3.6 8.94 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 120.683 -1.261 . . . . 0.0 110.201 -179.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.808 ' N ' HD22 ' A' ' 18' ' ' LEU . 2.5 mm? -99.71 -38.53 8.66 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.036 -1.04 . . . . 0.0 109.562 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 7.7 tptp -50.91 -45.07 60.24 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.245 -0.909 . . . . 0.0 109.148 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.93 -31.27 72.1 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.232 -0.917 . . . . 0.0 109.548 179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.97 -48.86 79.98 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.254 -0.904 . . . . 0.0 109.52 -179.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.532 ' O ' HG23 ' A' ' 24' ' ' THR . . . 136.29 -22.25 3.4 Favored Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.294 -1.522 . . . . 0.0 109.294 -179.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.582 HD13 HG21 ' A' ' 48' ' ' ILE . 53.9 mt -66.57 122.5 17.69 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.336 -1.097 . . . . 0.0 109.301 179.789 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.532 HG23 ' O ' ' A' ' 22' ' ' GLY . 13.7 p -128.99 1.38 5.29 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.192 -0.942 . . . . 0.0 109.845 -179.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.421 ' C ' ' O ' ' A' ' 24' ' ' THR . 18.3 t -44.22 161.2 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.178 -0.951 . . . . 0.0 108.958 179.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.528 ' O ' ' CB ' ' A' ' 30' ' ' ASN . 3.6 p30 -99.6 -10.89 21.48 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.129 -0.982 . . . . 0.0 109.573 -179.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.608 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 18.4 t80 -81.01 -6.38 58.72 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.029 -1.045 . . . . 0.0 109.611 -179.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.832 ' CD1' HD11 ' A' ' 48' ' ' ILE . 23.1 m-85 -110.97 -37.11 5.47 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.205 -0.934 . . . . 0.0 108.494 179.446 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.863 ' CE1' HG23 ' A' ' 15' ' ' ILE . 3.5 m-85 -85.39 -43.53 13.57 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 179.175 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.528 ' CB ' ' O ' ' A' ' 26' ' ' ASP . 48.3 t30 -69.87 -57.87 4.55 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.4 -0.813 . . . . 0.0 108.955 179.636 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -59.5 -16.29 23.35 Favored 'General case' 0 C--N 1.303 -1.433 0 O-C-N 121.437 -0.79 . . . . 0.0 109.203 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.539 HG21 HD11 ' A' ' 15' ' ' ILE . 0.4 OUTLIER -54.15 -39.38 42.11 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.34 -0.85 . . . . 0.0 108.814 179.924 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.526 ' ND2' ' N ' ' A' ' 34' ' ' LYS . 0.7 OUTLIER -75.77 -35.03 60.26 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.274 -0.891 . . . . 0.0 109.094 179.618 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.526 ' N ' ' ND2' ' A' ' 33' ' ' ASN . 0.7 OUTLIER -55.41 -25.2 34.51 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.377 -0.827 . . . . 0.0 109.501 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.706 ' HB2' HD12 ' A' ' 44' ' ' LEU . . . -40.12 155.96 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.667 -0.646 . . . . 0.0 109.914 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 1.006 ' O ' HD22 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -86.39 -70.85 0.58 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.318 -0.864 . . . . 0.0 109.535 -179.976 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.654 ' O ' HG23 ' A' ' 41' ' ' VAL . 0.6 OUTLIER -108.55 -179.94 4.02 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.159 -0.963 . . . . 0.0 109.138 179.758 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.785 HG22 HD21 ' A' ' 9' ' ' ASN . 27.8 t -59.3 -37.77 70.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.489 0 O-C-N 121.23 -0.918 . . . . 0.0 109.234 179.864 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.655 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 43.4 mt-10 -63.51 -28.48 69.98 Favored 'General case' 0 C--N 1.299 -1.607 0 O-C-N 121.281 -0.887 . . . . 0.0 108.747 179.378 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.502 ' OE1' ' N ' ' A' ' 40' ' ' GLU . 1.1 mp0 -79.49 -31.27 42.26 Favored 'General case' 0 N--CA 1.489 1.491 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 179.131 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.76 HG11 ' HB3' ' A' ' 10' ' ' ALA . 12.7 t -67.21 -66.67 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.343 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 178.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -55.46 -35.29 65.32 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 179.182 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.655 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -62.05 -35.82 79.78 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.283 -0.885 . . . . 0.0 109.164 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.706 HD12 ' HB2' ' A' ' 35' ' ' ALA . 3.7 mt -59.44 -52.15 66.85 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.433 -0.792 . . . . 0.0 110.314 -179.758 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.524 ' HA ' HD13 ' A' ' 48' ' ' ILE . 43.0 mmtt -64.39 -25.67 68.13 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.106 -0.997 . . . . 0.0 109.998 -179.119 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 13.4 m-20 -76.46 -18.07 58.98 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.054 -1.029 . . . . 0.0 109.621 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.534 ' O ' ' CB ' ' A' ' 51' ' ' ALA . 0.0 OUTLIER -90.18 -12.79 37.1 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.186 -0.946 . . . . 0.0 109.294 179.76 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.832 HD11 ' CD1' ' A' ' 28' ' ' TYR . 1.2 mp -73.3 -35.38 46.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 179.529 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 5.7 tp -61.82 -24.03 66.62 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.074 -1.016 . . . . 0.0 110.081 -179.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 26.1 mttt -121.76 -1.72 9.42 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.818 -1.176 . . . . 0.0 110.076 -179.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.534 ' CB ' ' O ' ' A' ' 47' ' ' GLU . . . -101.11 -28.11 12.88 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.111 -0.993 . . . . 0.0 109.886 -179.925 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.533 ' CD2' HG23 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -131.96 -0.03 3.82 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.094 -1.004 . . . . 0.0 109.87 -179.334 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.656 0 CA-C-O 118.027 -0.987 . . . . 0.0 109.572 179.769 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . 0.506 ' O ' ' CG2' ' A' ' 2' ' ' ILE . 1.8 t . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 121.247 0.546 . . . . 0.0 109.73 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.53 ' CG1' ' O ' ' A' ' 2' ' ' ILE . 0.3 OUTLIER 39.9 34.4 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 CA-C-O 121.601 0.715 . . . . 0.0 109.787 179.786 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 63.1 m-20 -91.49 21.1 4.79 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 178.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -100.46 76.61 1.86 Allowed 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.744 -0.598 . . . . 0.0 109.517 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.528 ' CE3' ' N ' ' A' ' 6' ' ' LEU . 0.7 OUTLIER -97.27 -38.51 9.65 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.225 -0.922 . . . . 0.0 109.294 179.8 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.528 ' N ' ' CE3' ' A' ' 5' ' ' TRP . 4.6 mp 61.92 86.46 0.11 Allowed 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.35 -0.844 . . . . 0.0 109.805 179.812 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 1.014 HD21 ' CG2' ' A' ' 41' ' ' VAL . 14.0 tp -85.16 47.11 1.36 Allowed 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.368 -0.832 . . . . 0.0 108.945 179.612 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.664 ' HA ' ' HB2' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -94.66 -15.09 24.25 Favored 'General case' 0 C--N 1.304 -1.388 0 O-C-N 121.217 -0.927 . . . . 0.0 109.66 -179.748 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.58 ' ND2' ' N ' ' A' ' 9' ' ' ASN . 0.1 OUTLIER -38.02 -91.36 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.732 -0.605 . . . . 0.0 110.632 -179.758 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.54 ' HA ' ' HB2' ' A' ' 13' ' ' ASP . . . -69.8 0.2 6.1 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.177 -0.952 . . . . 0.0 110.818 -179.085 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.664 ' HB2' ' HA ' ' A' ' 8' ' ' LYS . 0.1 OUTLIER -44.63 -74.05 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.464 0 O-C-N 120.819 -1.176 . . . . 0.0 110.571 -179.712 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.49 ' HA ' ' HB ' ' A' ' 15' ' ' ILE . 76.0 mt-10 -75.76 -5.77 47.38 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.962 -1.086 . . . . 0.0 110.307 -179.103 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.54 ' HB2' ' HA ' ' A' ' 10' ' ' ALA . 1.0 OUTLIER -70.37 -44.82 67.3 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.208 -0.933 . . . . 0.0 109.333 179.8 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.408 ' CB ' ' HD3' ' A' ' 45' ' ' LYS . . . -87.25 -31.7 20.12 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.329 -0.857 . . . . 0.0 109.284 179.686 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.922 HG23 ' CE1' ' A' ' 29' ' ' PHE . 31.4 mt -62.39 -28.84 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.508 0 CA-C-O 121.917 0.865 . . . . 0.0 109.051 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -62.29 -10.96 12.53 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.808 -0.557 . . . . 0.0 110.145 -179.087 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -101.27 -18.66 16.01 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.299 -0.876 . . . . 0.0 109.526 -179.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.59 ' HG ' ' CE ' ' A' ' 45' ' ' LYS . 4.2 mm? -90.02 -56.07 3.37 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.278 -0.889 . . . . 0.0 109.824 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.6 tttp -49.5 -29.59 6.96 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.4 -0.813 . . . . 0.0 109.908 -179.288 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.0 tttp -86.7 -29.53 22.36 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.1 -1.0 . . . . 0.0 109.715 -179.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -68.23 -33.99 75.41 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.27 -0.894 . . . . 0.0 109.713 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.721 ' O ' HG23 ' A' ' 24' ' ' THR . . . 131.04 -45.15 1.15 Allowed Glycine 0 N--CA 1.49 2.267 0 N-CA-C 109.414 -1.475 . . . . 0.0 109.414 -179.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.476 HD13 ' CG2' ' A' ' 48' ' ' ILE . 66.0 mt -45.62 136.6 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.272 -1.134 . . . . 0.0 109.517 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.721 HG23 ' O ' ' A' ' 22' ' ' GLY . 64.1 p -137.74 25.22 2.84 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.249 -0.907 . . . . 0.0 109.457 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 9.8 t -65.11 156.63 30.96 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.281 -0.887 . . . . 0.0 109.329 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.48 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 68.7 m-20 -96.45 -6.98 36.03 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.223 -0.923 . . . . 0.0 109.597 -179.871 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.528 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 8.6 t80 -81.83 -19.27 41.43 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 120.971 -1.081 . . . . 0.0 109.013 179.625 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.629 ' CD2' HG12 ' A' ' 48' ' ' ILE . 22.2 m-30 -97.16 -11.82 23.84 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.39 -0.819 . . . . 0.0 109.615 -179.892 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.922 ' CE1' HG23 ' A' ' 15' ' ' ILE . 9.8 m-85 -112.55 -49.96 2.92 Favored 'General case' 0 C--N 1.297 -1.697 0 O-C-N 121.296 -0.877 . . . . 0.0 109.45 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.48 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 8.5 t30 -62.19 -40.55 96.43 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.581 -0.699 . . . . 0.0 109.285 179.501 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.16 -1.2 43.64 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.39 -0.819 . . . . 0.0 109.886 -179.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.646 ' HA ' HD21 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -76.45 -55.93 9.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.108 -0.995 . . . . 0.0 109.611 -179.659 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.597 ' N ' HG22 ' A' ' 32' ' ' ILE . 6.8 t-20 -69.24 -6.42 29.07 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.136 -0.977 . . . . 0.0 109.193 179.77 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.48 ' O ' ' O ' ' A' ' 35' ' ' ALA . 4.2 mttt -103.38 -20.63 14.01 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.255 -0.903 . . . . 0.0 109.636 -179.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.515 ' HB3' HG22 ' A' ' 41' ' ' VAL . . . -40.29 164.09 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.747 0 CA-C-O 121.625 0.726 . . . . 0.0 110.175 -179.568 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 7.6 mttp -51.4 -78.93 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.336 -0.852 . . . . 0.0 110.165 -179.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.873 HG21 ' OE2' ' A' ' 39' ' ' GLU . 4.8 t -128.76 -154.09 0.61 Allowed 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.186 -0.946 . . . . 0.0 109.724 -179.555 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.665 ' N ' HG23 ' A' ' 37' ' ' THR . 12.3 t -75.79 -53.9 14.83 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 O-C-N 121.119 -0.988 . . . . 0.0 109.845 -179.798 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.873 ' OE2' HG21 ' A' ' 37' ' ' THR . 1.3 pt-20 -55.36 -22.6 20.21 Favored 'General case' 0 C--N 1.296 -1.732 0 O-C-N 121.007 -1.058 . . . . 0.0 108.575 179.542 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.459 ' O ' ' HB3' ' A' ' 44' ' ' LEU . 20.0 tp10 -84.9 -32.82 22.94 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 178.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 1.014 ' CG2' HD21 ' A' ' 7' ' ' LEU . 53.9 t -66.62 -59.96 3.22 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 178.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.432 ' O ' ' OD1' ' A' ' 46' ' ' ASN . 35.9 m-80 -58.75 -34.93 71.95 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.474 -0.766 . . . . 0.0 109.735 179.574 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -72.85 -26.64 61.54 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.156 -0.965 . . . . 0.0 109.631 -179.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.712 ' O ' HD12 ' A' ' 44' ' ' LEU . 0.3 OUTLIER -75.83 -30.15 58.86 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.139 -0.976 . . . . 0.0 108.464 179.502 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.59 ' CE ' ' HG ' ' A' ' 18' ' ' LEU . 0.0 OUTLIER -64.62 -26.21 68.3 Favored 'General case' 0 N--CA 1.487 1.408 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 179.369 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.432 ' OD1' ' O ' ' A' ' 42' ' ' ASN . 23.1 m120 -80.18 -15.86 56.11 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.554 -0.716 . . . . 0.0 109.813 -179.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -83.01 -7.61 59.65 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.201 -0.937 . . . . 0.0 109.82 -179.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.629 HG12 ' CD2' ' A' ' 28' ' ' TYR . 2.4 mp -74.82 -46.67 40.46 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 O-C-N 120.966 -1.084 . . . . 0.0 108.586 179.348 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.2 mp -54.09 -40.12 66.97 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.311 -0.868 . . . . 0.0 109.105 179.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 1.6 tmtt? -80.4 -73.14 0.38 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.162 -0.962 . . . . 0.0 108.548 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.463 ' O ' ' HB3' ' A' ' 52' ' ' HIS . . . -55.88 161.46 2.23 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 179.075 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.625 ' CG ' ' O ' ' A' ' 52' ' ' HIS . 0.4 OUTLIER 64.73 10.46 6.04 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 120.911 -1.118 . . . . 0.0 108.964 179.674 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.453 0 O-C-N 120.963 -1.086 . . . . 0.0 109.455 179.722 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.552 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.669 HD13 ' O ' ' A' ' 2' ' ' ILE . 0.3 OUTLIER -106.7 12.95 8.43 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.26 -0.9 . . . . 0.0 109.343 -179.91 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 19.3 p-10 -60.34 -16.99 40.04 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.16 -0.962 . . . . 0.0 109.054 179.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.493 ' O ' ' C ' ' A' ' 5' ' ' TRP . 0.2 OUTLIER -57.18 -33.63 67.67 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.363 -0.835 . . . . 0.0 109.421 179.997 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.523 ' O ' ' N ' ' A' ' 7' ' ' LEU . 22.2 t90 -32.96 -88.17 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.741 -0.599 . . . . 0.0 110.578 179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.471 ' O ' ' HB3' ' A' ' 7' ' ' LEU . 0.5 OUTLIER 36.59 28.53 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.383 -0.823 . . . . 0.0 111.039 179.841 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.833 HD21 ' CG2' ' A' ' 41' ' ' VAL . 0.4 OUTLIER 61.71 99.01 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.009 -1.057 . . . . 0.0 110.079 179.45 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.497 ' HD3' ' CD ' ' A' ' 11' ' ' LYS . 0.0 OUTLIER -151.58 58.57 0.88 Allowed 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 179.5 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.816 ' ND2' HG22 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -126.85 -49.01 1.49 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.399 -0.813 . . . . 0.0 109.619 -178.974 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.654 ' HB3' HG11 ' A' ' 41' ' ' VAL . . . -80.78 0.82 33.09 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.262 -0.899 . . . . 0.0 109.617 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.497 ' CD ' ' HD3' ' A' ' 8' ' ' LYS . 5.4 mtpm? -62.52 -88.01 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.171 -0.956 . . . . 0.0 109.969 -179.463 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.431 ' O ' ' HB2' ' A' ' 16' ' ' ALA . 4.7 tt0 -57.83 -17.15 14.32 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.159 -0.963 . . . . 0.0 110.077 -179.3 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.457 ' HB2' ' HA ' ' A' ' 10' ' ' ALA . 61.8 m-20 -59.94 -73.61 0.09 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.097 -1.002 . . . . 0.0 109.475 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.545 ' O ' HD12 ' A' ' 18' ' ' LEU . . . -68.47 -42.36 78.84 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.228 -0.92 . . . . 0.0 109.461 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.748 HG23 ' CE1' ' A' ' 29' ' ' PHE . 10.6 mt -49.86 -30.82 6.33 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.524 0 O-C-N 121.206 -0.934 . . . . 0.0 109.033 179.796 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.431 ' HB2' ' O ' ' A' ' 12' ' ' GLU . . . -66.4 -38.74 88.17 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.633 -0.667 . . . . 0.0 110.582 -178.43 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.3 tp10 -76.21 -25.0 54.67 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.179 -0.951 . . . . 0.0 110.763 -178.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.581 HD13 ' HB3' ' A' ' 45' ' ' LYS . 0.9 OUTLIER -88.69 -30.21 19.29 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 120.929 -1.107 . . . . 0.0 110.37 -178.945 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.6 -29.67 68.14 Favored 'General case' 0 C--N 1.3 -1.562 0 O-C-N 121.305 -0.872 . . . . 0.0 109.504 -179.516 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -86.29 -26.37 24.98 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.335 -0.853 . . . . 0.0 109.211 179.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.31 -30.57 69.59 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.236 -0.915 . . . . 0.0 109.316 179.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 121.19 -28.99 5.88 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.779 -1.328 . . . . 0.0 109.779 179.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.557 HD13 HG21 ' A' ' 48' ' ' ILE . 26.8 mt -48.87 110.51 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.153 -1.204 . . . . 0.0 109.485 -179.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -105.99 -7.12 18.28 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.213 -0.929 . . . . 0.0 109.4 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -48.12 118.62 2.47 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.25 -0.906 . . . . 0.0 109.182 179.958 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.505 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 0.3 OUTLIER -80.05 6.45 11.46 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.336 -0.853 . . . . 0.0 109.644 -179.868 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.442 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 20.4 t80 -78.85 -22.58 45.89 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.107 -0.996 . . . . 0.0 109.462 -179.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.863 ' CE2' HG23 ' A' ' 48' ' ' ILE . 22.6 m-85 -94.75 -45.2 7.44 Favored 'General case' 0 C--N 1.302 -1.471 0 O-C-N 121.179 -0.95 . . . . 0.0 108.821 179.464 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.748 ' CE1' HG23 ' A' ' 15' ' ' ILE . 14.4 m-85 -61.03 -50.95 71.26 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 108.686 -0.857 . . . . 0.0 108.686 179.08 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.505 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 1.9 t30 -60.34 -31.32 70.2 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.419 -0.801 . . . . 0.0 108.901 179.615 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.04 -22.08 53.52 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.453 -0.779 . . . . 0.0 109.682 -179.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.714 HD11 ' HG2' ' A' ' 45' ' ' LYS . 0.8 OUTLIER -68.28 -34.09 64.18 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.212 -0.93 . . . . 0.0 108.837 179.914 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -75.91 -4.54 41.49 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.213 -0.929 . . . . 0.0 109.021 179.366 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.448 ' O ' ' C ' ' A' ' 35' ' ' ALA . 6.5 mmmt -108.83 -17.78 13.85 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.212 -0.93 . . . . 0.0 109.531 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.538 ' HB2' HD12 ' A' ' 44' ' ' LEU . . . -38.45 154.82 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.71 -0.619 . . . . 0.0 110.127 -179.711 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.465 ' O ' HD13 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -87.74 -73.09 0.49 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.295 -0.878 . . . . 0.0 109.954 -179.791 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.668 ' O ' HG23 ' A' ' 41' ' ' VAL . 0.8 OUTLIER -105.89 -177.38 3.35 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.152 -0.968 . . . . 0.0 109.365 -179.741 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.816 HG22 ' ND2' ' A' ' 9' ' ' ASN . 92.4 t -67.44 -30.05 47.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.134 -0.979 . . . . 0.0 109.028 179.649 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.56 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 3.0 pt-20 -71.33 -25.29 62.34 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 178.254 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.532 ' N ' ' HG3' ' A' ' 39' ' ' GLU . 4.5 mm-40 -80.97 -30.74 35.05 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 178.592 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.833 ' CG2' HD21 ' A' ' 7' ' ' LEU . 48.7 t -67.41 -61.16 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 179.038 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 58.1 m-80 -62.05 -29.4 70.27 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.589 -0.695 . . . . 0.0 109.306 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.56 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -71.17 -29.4 65.15 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.259 -0.901 . . . . 0.0 109.497 179.881 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.538 HD12 ' HB2' ' A' ' 35' ' ' ALA . 7.4 mt -75.1 -47.94 26.23 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.117 -0.989 . . . . 0.0 110.947 -179.228 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.714 ' HG2' HD11 ' A' ' 32' ' ' ILE . 0.3 OUTLIER -75.29 -43.45 51.09 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.861 -1.15 . . . . 0.0 110.081 -178.888 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -68.32 -21.08 64.77 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.029 -1.045 . . . . 0.0 109.436 179.782 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.481 ' HG2' ' HB2' ' A' ' 51' ' ' ALA . 14.6 tt0 -79.79 -7.11 58.47 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.176 -0.952 . . . . 0.0 109.674 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.91 HG22 ' CD2' ' A' ' 52' ' ' HIS . 83.3 mt -68.95 -41.67 81.96 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 178.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 49' ' ' LEU . 12.7 mt -47.32 -32.33 4.66 Favored 'General case' 0 C--N 1.302 -1.472 0 C-N-CA 119.688 -0.805 . . . . 0.0 109.435 179.613 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 6.7 mttm -115.66 -3.61 12.28 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.977 -1.077 . . . . 0.0 110.177 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.481 ' HB2' ' HG2' ' A' ' 47' ' ' GLU . . . -100.58 -2.55 32.58 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 121.126 -0.984 . . . . 0.0 109.218 179.741 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.91 ' CD2' HG22 ' A' ' 48' ' ' ILE . 0.0 OUTLIER -160.89 -164.97 1.28 Allowed 'General case' 0 C--N 1.303 -1.436 0 O-C-N 121.343 -0.848 . . . . 0.0 108.957 -179.614 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.604 ' N ' ' CG ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.49 1.542 0 O-C-N 121.11 -0.994 . . . . 0.0 109.277 -179.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . 0.66 HG23 ' O ' ' A' ' 1' ' ' THR . 10.6 t . . . . . 0 N--CA 1.492 1.626 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.483 ' O ' HG13 ' A' ' 2' ' ' ILE . 1.1 tp -88.26 50.32 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.317 -0.864 . . . . 0.0 109.499 179.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -76.61 0.24 20.88 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.082 -1.011 . . . . 0.0 108.822 178.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -81.07 10.15 5.65 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.392 -0.817 . . . . 0.0 109.621 179.931 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.516 ' O ' ' N ' ' A' ' 7' ' ' LEU . 1.7 t90 -50.96 -46.38 61.13 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 121.223 -0.923 . . . . 0.0 111.28 -179.668 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.583 ' O ' ' CB ' ' A' ' 7' ' ' LEU . 46.6 mt -38.88 -25.8 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.318 -0.864 . . . . 0.0 110.998 -178.631 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 1.016 HD21 HG21 ' A' ' 41' ' ' VAL . 1.0 OUTLIER 85.66 -134.72 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.665 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 -179.835 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.45 ' H ' HD22 ' A' ' 7' ' ' LEU . 6.1 mtpt 53.23 17.59 1.04 Allowed 'General case' 0 N--CA 1.488 1.451 0 O-C-N 120.522 -1.361 . . . . 0.0 109.298 -179.103 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.848 HD21 HG22 ' A' ' 38' ' ' VAL . 4.5 p30 -95.85 -48.18 5.84 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 107.77 -1.196 . . . . 0.0 107.77 179.153 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.424 ' N ' ' CG ' ' A' ' 9' ' ' ASN . . . -81.56 -11.82 59.01 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 178.041 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.547 ' O ' HD12 ' A' ' 15' ' ' ILE . 1.3 ttpt -43.82 -64.22 0.7 Allowed 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.459 -0.776 . . . . 0.0 110.926 -179.424 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -95.95 -22.83 17.16 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.895 -1.128 . . . . 0.0 111.18 -178.428 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -61.28 -28.78 69.43 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 120.794 -1.191 . . . . 0.0 109.876 -179.469 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.615 ' O ' HD23 ' A' ' 18' ' ' LEU . . . -96.65 -43.62 7.48 Favored 'General case' 0 C--N 1.301 -1.5 0 O-C-N 121.096 -1.003 . . . . 0.0 108.853 179.549 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.641 HG23 ' CE1' ' A' ' 29' ' ' PHE . 88.0 mt -54.31 -28.72 18.69 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.513 0 O-C-N 121.66 -0.65 . . . . 0.0 109.705 179.815 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.483 ' HA ' ' CE ' ' A' ' 19' ' ' LYS . . . -64.06 -37.51 87.71 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.42 -0.8 . . . . 0.0 109.639 -179.03 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.574 ' O ' ' HB2' ' A' ' 21' ' ' ALA . 0.5 OUTLIER -86.86 9.6 18.7 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.386 -0.822 . . . . 0.0 109.913 -179.48 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.615 HD23 ' O ' ' A' ' 14' ' ' ALA . 0.5 OUTLIER -101.04 -47.93 4.59 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.249 -0.907 . . . . 0.0 109.627 -179.766 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.483 ' CE ' ' HA ' ' A' ' 16' ' ' ALA . 2.1 ptpt -59.43 -28.76 67.24 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.457 -0.777 . . . . 0.0 109.345 -179.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.06 -16.79 23.5 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.41 -0.807 . . . . 0.0 108.966 179.664 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . 0.574 ' HB2' ' O ' ' A' ' 17' ' ' GLU . . . -69.09 -29.92 68.11 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.334 -0.854 . . . . 0.0 109.532 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 126.87 -12.76 6.85 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.768 -1.333 . . . . 0.0 109.768 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.651 HD12 HG21 ' A' ' 48' ' ' ILE . 0.2 OUTLIER -101.97 123.05 54.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.101 -1.235 . . . . 0.0 109.696 -179.792 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -122.89 28.62 7.16 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.3 -0.875 . . . . 0.0 108.986 179.468 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.98 177.81 2.48 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.363 -0.836 . . . . 0.0 109.64 -179.748 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.476 ' O ' ' HB2' ' A' ' 30' ' ' ASN . 9.0 m-20 -122.22 0.78 9.62 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.26 -0.9 . . . . 0.0 109.659 -179.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.591 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 2.3 t80 -81.15 -40.41 24.02 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.159 -0.963 . . . . 0.0 109.569 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.605 ' CE2' HG23 ' A' ' 48' ' ' ILE . 21.5 m-85 -78.34 -31.05 48.42 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.351 -0.843 . . . . 0.0 110.198 -179.008 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.641 ' CE1' HG23 ' A' ' 15' ' ' ILE . 6.7 m-30 -75.53 -49.24 19.27 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.282 -0.886 . . . . 0.0 109.924 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.476 ' HB2' ' O ' ' A' ' 26' ' ' ASP . 0.4 OUTLIER -59.37 -25.65 64.42 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.156 -0.965 . . . . 0.0 110.175 -179.504 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -87.15 -16.18 36.19 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 120.97 -1.081 . . . . 0.0 110.44 -179.029 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 1.036 HD11 ' HD2' ' A' ' 45' ' ' LYS . 0.6 OUTLIER -64.8 -38.16 82.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.096 -1.002 . . . . 0.0 109.873 -179.596 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 45.9 p-10 -79.74 -8.65 59.37 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.023 -1.048 . . . . 0.0 110.348 -179.238 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.437 ' O ' ' C ' ' A' ' 35' ' ' ALA . 3.5 mtmt -99.64 -17.16 17.93 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.962 -1.086 . . . . 0.0 109.976 -179.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.737 ' HB3' HG22 ' A' ' 41' ' ' VAL . . . -43.14 154.54 0.07 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.23 -0.919 . . . . 0.0 109.554 -179.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.502 ' HB2' ' HG3' ' A' ' 40' ' ' GLU . 0.1 OUTLIER -73.09 -59.49 2.68 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.077 -1.014 . . . . 0.0 109.634 -179.775 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.859 ' O ' HG23 ' A' ' 41' ' ' VAL . 70.2 p -124.01 -167.0 1.57 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.09 -1.006 . . . . 0.0 109.754 -179.834 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.848 HG22 HD21 ' A' ' 9' ' ' ASN . 16.0 t -66.63 -52.09 49.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.562 0 O-C-N 121.406 -0.809 . . . . 0.0 109.587 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.765 ' O ' ' HB2' ' A' ' 43' ' ' ALA . 11.7 pt-20 -52.36 -26.51 12.55 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 179.597 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.502 ' HG3' ' HB2' ' A' ' 36' ' ' LYS . 27.6 mm-40 -80.45 -35.6 34.7 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.321 -0.862 . . . . 0.0 108.763 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 1.016 HG21 HD21 ' A' ' 7' ' ' LEU . 7.0 t -67.88 -66.88 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 179.051 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 76.1 m-20 -53.85 -28.6 36.9 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.565 -0.709 . . . . 0.0 109.375 179.391 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.765 ' HB2' ' O ' ' A' ' 39' ' ' GLU . . . -66.88 -46.18 75.77 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.287 -0.883 . . . . 0.0 109.605 -179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 2.1 mt -57.85 -37.14 73.34 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.244 -0.91 . . . . 0.0 109.985 -179.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 1.036 ' HD2' HD11 ' A' ' 32' ' ' ILE . 0.2 OUTLIER -63.4 -34.01 76.79 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.087 -1.008 . . . . 0.0 109.5 -179.847 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 8.4 m-20 -77.77 -30.23 51.31 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.196 -0.94 . . . . 0.0 109.504 179.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -57.09 -23.33 46.14 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.338 -0.851 . . . . 0.0 109.165 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.651 HG21 HD12 ' A' ' 23' ' ' ILE . 41.4 mt -66.64 -45.7 87.78 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 179.518 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.443 HD12 ' HA ' ' A' ' 49' ' ' LEU . 1.2 mp -48.17 -36.78 14.22 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.178 -0.951 . . . . 0.0 108.558 179.046 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 2.6 mttt -90.53 -80.78 0.32 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.42 -0.8 . . . . 0.0 108.917 179.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.499 ' O ' ' HB3' ' A' ' 52' ' ' HIS . . . -54.81 151.57 8.32 Favored 'General case' 0 N--CA 1.487 1.384 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 178.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.557 ' O ' ' HB3' ' A' ' 53' ' ' ALA . 0.5 OUTLIER 64.95 165.7 0.16 Allowed 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.658 -1.276 . . . . 0.0 107.784 -179.276 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.557 ' HB3' ' O ' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 118.045 -0.979 . . . . 0.0 109.414 -179.559 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 1.5 t . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.538 ' CG1' ' O ' ' A' ' 2' ' ' ILE . 0.9 OUTLIER -118.24 40.04 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.248 -0.908 . . . . 0.0 109.509 179.921 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -71.24 -5.1 29.49 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.141 -0.974 . . . . 0.0 108.782 179.078 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.49 ' O ' ' O ' ' A' ' 5' ' ' TRP . 2.1 mt-30 -81.08 -31.08 34.55 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.488 -0.758 . . . . 0.0 110.194 -179.661 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.49 ' O ' ' O ' ' A' ' 4' ' ' GLN . 6.3 t90 -46.58 -99.4 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.244 -0.91 . . . . 0.0 110.319 -179.073 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.437 ' C ' ' O ' ' A' ' 5' ' ' TRP . 5.0 mt 43.36 27.53 0.14 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 120.56 -1.338 . . . . 0.0 109.757 179.923 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 1.033 HD21 HG21 ' A' ' 41' ' ' VAL . 0.5 OUTLIER 42.56 59.85 2.6 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.322 -0.861 . . . . 0.0 109.693 -179.917 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -120.59 -3.8 9.82 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.065 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.53 ' ND2' ' N ' ' A' ' 9' ' ' ASN . 0.1 OUTLIER -59.6 -99.1 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.509 -0.744 . . . . 0.0 110.061 179.877 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.604 ' CB ' HG13 ' A' ' 38' ' ' VAL . . . -55.77 -16.82 4.87 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 120.979 -1.076 . . . . 0.0 109.619 -179.883 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.543 ' HG2' HG21 ' A' ' 32' ' ' ILE . 2.5 tttp -40.85 -35.47 0.51 Allowed 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.196 -0.94 . . . . 0.0 110.241 -179.734 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -88.07 -32.6 18.65 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.109 -0.994 . . . . 0.0 110.038 -179.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.82 -56.23 21.57 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.154 -0.966 . . . . 0.0 109.399 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.461 ' HB1' ' HG2' ' A' ' 45' ' ' LYS . . . -62.68 -55.7 24.47 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.294 -0.879 . . . . 0.0 110.149 -179.774 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.777 ' CG1' HD13 ' A' ' 32' ' ' ILE . 73.0 mt -53.41 -30.85 18.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.151 -0.968 . . . . 0.0 109.48 -179.819 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -66.29 -38.73 88.44 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 -179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.462 ' O ' ' HG3' ' A' ' 17' ' ' GLU . 2.4 pt-20 -83.57 1.88 39.94 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 109.111 -0.699 . . . . 0.0 109.111 179.634 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.702 HD13 ' O ' ' A' ' 18' ' ' LEU . 1.1 tm? -97.86 -53.64 3.34 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.286 -0.884 . . . . 0.0 109.377 -179.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.425 ' O ' ' HG2' ' A' ' 19' ' ' LYS . 5.7 ttmt -56.71 -18.2 11.6 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.32 -0.863 . . . . 0.0 109.294 -179.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.4 ttmt -96.16 -26.15 15.57 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.315 -0.865 . . . . 0.0 109.264 179.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.33 -49.74 75.18 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.257 -0.902 . . . . 0.0 109.557 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 138.86 -3.57 2.86 Favored Glycine 0 N--CA 1.49 2.236 0 C-N-CA 119.665 -1.255 . . . . 0.0 110.133 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.649 HG21 ' CE1' ' A' ' 52' ' ' HIS . 0.0 OUTLIER -100.18 149.26 6.05 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 120.867 -1.372 . . . . 0.0 109.574 179.846 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -133.23 11.58 4.19 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.432 -0.792 . . . . 0.0 109.234 179.755 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -62.34 139.88 58.53 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.234 -0.916 . . . . 0.0 109.447 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.401 ' N ' ' OD1' ' A' ' 26' ' ' ASP . 1.3 m-20 -87.64 6.07 36.45 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.313 -0.867 . . . . 0.0 109.784 -179.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.688 ' CD2' ' CE1' ' A' ' 28' ' ' TYR . 8.3 t80 -80.26 -17.23 52.78 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.119 -0.988 . . . . 0.0 109.321 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.826 ' HB3' HD11 ' A' ' 48' ' ' ILE . 18.1 m-85 -101.36 -28.46 12.59 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.226 -0.921 . . . . 0.0 109.12 179.687 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 0.844 ' HA ' HD12 ' A' ' 32' ' ' ILE . 9.5 m-85 -83.07 -47.05 12.08 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.474 -0.766 . . . . 0.0 109.193 179.536 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 40.7 m-20 -60.78 -36.63 79.48 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.479 -0.763 . . . . 0.0 109.406 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -77.6 -13.7 59.84 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.342 -0.849 . . . . 0.0 109.691 -179.55 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.844 HD12 ' HA ' ' A' ' 29' ' ' PHE . 4.3 mt -68.01 -48.61 73.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.268 -0.895 . . . . 0.0 109.351 -179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.52 ' HB2' ' CE ' ' A' ' 11' ' ' LYS . 8.4 t30 -64.92 -22.53 67.01 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.218 -0.926 . . . . 0.0 109.624 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.473 ' O ' ' O ' ' A' ' 35' ' ' ALA . 5.7 mptp? -96.54 -14.71 22.07 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.178 -0.951 . . . . 0.0 109.744 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.907 ' HB3' HG22 ' A' ' 41' ' ' VAL . . . -43.61 168.68 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.315 -0.865 . . . . 0.0 109.795 -179.67 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.4 ' HB2' ' HG2' ' A' ' 40' ' ' GLU . 1.7 tttm -77.3 -78.73 0.12 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.211 -0.931 . . . . 0.0 109.582 -179.965 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.961 ' O ' HG23 ' A' ' 41' ' ' VAL . 14.8 t -121.54 -174.34 2.84 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.233 -0.917 . . . . 0.0 108.868 179.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.604 HG13 ' CB ' ' A' ' 10' ' ' ALA . 24.9 t -59.79 -57.31 12.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.105 -0.997 . . . . 0.0 109.436 179.828 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.556 ' O ' ' CB ' ' A' ' 43' ' ' ALA . 73.2 mm-40 -51.37 -19.51 1.36 Allowed 'General case' 0 C--N 1.295 -1.797 0 O-C-N 120.974 -1.079 . . . . 0.0 109.414 -179.639 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.495 ' HA ' ' OE1' ' A' ' 40' ' ' GLU . 4.6 tp10 -90.5 -33.24 16.02 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.924 -1.11 . . . . 0.0 109.181 179.596 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 1.033 HG21 HD21 ' A' ' 7' ' ' LEU . 2.2 t -76.7 -66.27 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.456 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 178.372 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.407 ' OD1' ' C ' ' A' ' 42' ' ' ASN . 0.0 OUTLIER -46.94 -40.73 14.82 Favored 'General case' 0 C--N 1.296 -1.738 0 CA-C-N 115.356 -0.838 . . . . 0.0 109.19 178.317 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.556 ' CB ' ' O ' ' A' ' 39' ' ' GLU . . . -68.49 -37.37 80.05 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.263 -0.898 . . . . 0.0 109.748 179.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.726 ' O ' HD12 ' A' ' 44' ' ' LEU . 0.3 OUTLIER -65.28 -30.56 71.44 Favored 'General case' 0 C--N 1.303 -1.414 0 O-C-N 121.152 -0.967 . . . . 0.0 109.051 -179.916 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.794 ' CE ' HD11 ' A' ' 32' ' ' ILE . 0.0 OUTLIER -63.39 -43.94 96.13 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.179 -0.95 . . . . 0.0 109.181 179.641 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -75.76 -13.93 60.31 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.426 -0.796 . . . . 0.0 109.537 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -79.7 -28.33 40.64 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.29 -0.881 . . . . 0.0 109.716 -179.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.826 HD11 ' HB3' ' A' ' 28' ' ' TYR . 14.4 mt -56.15 -41.61 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.115 -0.991 . . . . 0.0 108.725 179.429 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.416 HD23 ' HA ' ' A' ' 49' ' ' LEU . 89.7 mt -45.24 -36.1 3.74 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.31 -0.869 . . . . 0.0 109.978 179.722 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 4.4 mttt -117.68 2.17 12.27 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 120.985 -1.072 . . . . 0.0 110.789 -179.361 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -100.83 -7.74 23.29 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.98 -1.075 . . . . 0.0 109.503 179.79 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.649 ' CE1' HG21 ' A' ' 23' ' ' ILE . 0.0 OUTLIER -145.13 8.74 1.23 Allowed 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.153 -0.967 . . . . 0.0 110.232 -178.822 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.301 -1.522 0 CA-C-O 117.95 -1.024 . . . . 0.0 109.449 -179.94 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 14.8 t . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 121.301 0.572 . . . . 0.0 109.548 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -103.64 48.91 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.366 0 O-C-N 121.232 -0.918 . . . . 0.0 109.698 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -67.58 -7.45 26.35 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 178.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.426 ' O ' ' O ' ' A' ' 5' ' ' TRP . 5.7 mp0 -54.6 -16.68 2.59 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.405 -0.809 . . . . 0.0 109.658 179.844 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' TRP . . . . . 0.453 ' O ' ' C ' ' A' ' 6' ' ' LEU . 0.0 OUTLIER -64.11 -123.02 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 107.743 -1.206 . . . . 0.0 107.743 179.407 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.463 ' O ' ' C ' ' A' ' 7' ' ' LEU . 93.6 mt 39.08 36.84 0.19 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.933 -1.104 . . . . 0.0 110.104 179.221 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.926 HD21 HG21 ' A' ' 41' ' ' VAL . 4.8 tt -38.42 115.94 0.5 Allowed 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.579 -0.701 . . . . 0.0 109.87 -179.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.542 ' CG ' ' O ' ' A' ' 7' ' ' LEU . 10.6 mttp -168.07 -34.01 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.488 -0.758 . . . . 0.0 109.481 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.577 ' ND2' HG22 ' A' ' 38' ' ' VAL . 0.1 OUTLIER -36.08 -93.48 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.555 -0.715 . . . . 0.0 110.995 -179.969 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.459 ' O ' ' C ' ' A' ' 11' ' ' LYS . . . -54.93 -13.2 1.01 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.181 -0.949 . . . . 0.0 111.037 -179.076 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.743 ' O ' HD12 ' A' ' 15' ' ' ILE . 0.0 OUTLIER -36.9 -43.01 0.42 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.231 -0.918 . . . . 0.0 110.982 -179.407 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -100.63 -21.07 15.37 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.888 -1.132 . . . . 0.0 110.28 -179.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -69.21 -15.95 63.5 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.044 -1.035 . . . . 0.0 109.454 -179.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -105.75 -40.61 5.68 Favored 'General case' 0 C--N 1.301 -1.514 0 O-C-N 121.346 -0.846 . . . . 0.0 108.927 179.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 1.125 HG23 ' CZ ' ' A' ' 29' ' ' PHE . 55.2 mt -62.81 -28.6 45.27 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 O-C-N 121.494 -0.754 . . . . 0.0 109.17 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -55.5 -22.67 22.1 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.404 -0.81 . . . . 0.0 109.675 -179.466 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -85.26 -28.06 25.6 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.377 -0.827 . . . . 0.0 110.343 -179.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.524 ' CD1' ' HE2' ' A' ' 45' ' ' LYS . 2.2 mt -84.25 -32.33 24.51 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.14 -0.975 . . . . 0.0 110.693 -178.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -56.5 -21.64 27.36 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 120.97 -1.081 . . . . 0.0 109.736 -179.631 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 6.5 tttm -100.9 -29.46 12.2 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.21 -0.931 . . . . 0.0 110.038 -179.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -69.14 -33.32 73.25 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.136 -0.978 . . . . 0.0 109.741 -179.764 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 124.81 -26.58 5.62 Favored Glycine 0 N--CA 1.49 2.248 0 N-CA-C 109.356 -1.497 . . . . 0.0 109.356 -179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.552 HG12 ' CE1' ' A' ' 52' ' ' HIS . 62.0 mt -66.2 106.44 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.368 -1.077 . . . . 0.0 109.393 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 9.6 p -128.99 17.67 6.15 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.085 -1.009 . . . . 0.0 109.56 -179.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 65.6 m -65.62 152.63 43.69 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.255 -0.903 . . . . 0.0 109.242 179.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.458 ' O ' ' CB ' ' A' ' 30' ' ' ASN . 7.9 m-20 -87.21 -3.08 59.03 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.189 -0.944 . . . . 0.0 109.787 -179.765 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.722 ' CE2' ' CE1' ' A' ' 28' ' ' TYR . 18.0 t80 -80.08 -7.5 58.91 Favored 'General case' 0 C--N 1.303 -1.444 0 O-C-N 121.155 -0.966 . . . . 0.0 109.269 -179.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.915 ' O ' HD13 ' A' ' 32' ' ' ILE . 37.8 m-85 -118.49 -34.78 3.92 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 179.308 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' PHE . . . . . 1.125 ' CZ ' HG23 ' A' ' 15' ' ' ILE . 6.1 m-30 -78.58 -40.9 33.37 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 178.838 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.458 ' CB ' ' O ' ' A' ' 26' ' ' ASP . 19.8 t30 -68.62 -49.61 57.87 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.465 -0.772 . . . . 0.0 108.966 179.527 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . 0.407 ' HA ' ' HB2' ' A' ' 34' ' ' LYS . . . -69.06 -12.85 62.06 Favored 'General case' 0 C--N 1.304 -1.412 0 O-C-N 121.495 -0.753 . . . . 0.0 109.603 -179.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.915 HD13 ' O ' ' A' ' 28' ' ' TYR . 0.7 OUTLIER -73.7 -50.52 29.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.262 -0.899 . . . . 0.0 108.961 179.839 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . 0.53 ' HB3' ' HG3' ' A' ' 11' ' ' LYS . 17.2 p30 -79.7 -10.93 59.86 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.242 -0.911 . . . . 0.0 109.366 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.479 ' O ' ' O ' ' A' ' 35' ' ' ALA . 7.8 mmtt -91.29 -14.83 30.13 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.344 -0.848 . . . . 0.0 109.654 -179.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.479 ' O ' ' O ' ' A' ' 34' ' ' LYS . . . -55.09 -160.74 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.527 -0.733 . . . . 0.0 110.198 -179.517 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.682 ' C ' HD12 ' A' ' 7' ' ' LEU . 27.8 mmtp -101.79 -62.87 1.2 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.103 -0.998 . . . . 0.0 110.401 -179.293 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.508 ' O ' HG23 ' A' ' 41' ' ' VAL . 66.6 p -125.86 178.02 5.97 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.945 -1.097 . . . . 0.0 110.082 -179.415 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.577 HG22 ' ND2' ' A' ' 9' ' ' ASN . 88.6 t -61.39 -34.46 61.25 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.331 -0.856 . . . . 0.0 109.331 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.13 -27.39 69.05 Favored 'General case' 0 C--N 1.3 -1.554 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 178.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.441 ' HG2' ' HB1' ' A' ' 35' ' ' ALA . 0.9 OUTLIER -79.58 -31.27 41.83 Favored 'General case' 0 N--CA 1.487 1.388 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.662 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.926 HG21 HD21 ' A' ' 7' ' ' LEU . 18.6 t -68.32 -67.53 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 178.796 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -49.56 -39.37 34.61 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.429 -0.794 . . . . 0.0 109.468 179.496 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -62.9 -38.96 93.01 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.294 -0.879 . . . . 0.0 109.619 -179.671 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.424 ' O ' HD12 ' A' ' 48' ' ' ILE . 7.6 mt -66.85 -46.61 74.54 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.282 -0.887 . . . . 0.0 110.258 -179.531 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.652 ' HA ' HD12 ' A' ' 48' ' ' ILE . 0.2 OUTLIER -65.61 -19.65 66.0 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.037 -1.04 . . . . 0.0 110.23 -179.243 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -79.84 -18.23 51.29 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.054 -1.029 . . . . 0.0 109.566 -179.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.539 ' O ' ' CB ' ' A' ' 51' ' ' ALA . 55.7 tt0 -90.76 -17.74 26.14 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.186 -0.946 . . . . 0.0 109.172 179.669 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.677 ' CG1' ' CD1' ' A' ' 28' ' ' TYR . 1.4 mt -68.6 -35.43 70.15 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.252 -0.905 . . . . 0.0 108.91 179.478 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 49' ' ' LEU . 14.5 tp -56.4 -30.05 62.29 Favored 'General case' 0 C--N 1.305 -1.336 0 O-C-N 121.162 -0.961 . . . . 0.0 109.324 179.646 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.419 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -122.28 5.87 9.68 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.197 -0.939 . . . . 0.0 109.889 -179.894 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.539 ' CB ' ' O ' ' A' ' 47' ' ' GLU . . . -101.39 -46.62 4.95 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.092 -1.005 . . . . 0.0 109.466 179.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.6 ' HB3' ' OH ' ' A' ' 28' ' ' TYR . 0.0 OUTLIER -112.66 -19.5 12.03 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.447 -0.783 . . . . 0.0 109.661 -178.975 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.486 ' N ' ' CD2' ' A' ' 52' ' ' HIS . . . . . . . . 0 N--CA 1.489 1.512 0 CA-C-O 118.012 -0.994 . . . . 0.0 109.42 179.66 . . . . . . . . 1 1 . 1 stop_ save_