data_1m0v_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 1m0v _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 ' 2' ' ' ASN . . . . . 0.411 ' HB3' ' CG2' ' A' ' 58' ' ' THR . 7.1 p-10 . . . . . 0 CA--C 1.528 0.133 0 CA-C-O 120.678 0.275 . . . . 0.0 110.918 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.44 ' HB2' ' CD2' ' A' ' 8' ' ' LEU . 5.1 mp -73.1 172.89 10.21 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.909 0.385 . . . . 0.0 110.497 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.4 p -88.62 135.68 33.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.077 179.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.5 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 2.9 mt -37.4 -62.02 0.55 Allowed 'General case' 0 CA--C 1.504 -0.792 0 CA-C-O 121.434 0.635 . . . . 0.0 111.712 -179.621 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -40.44 -65.01 0.45 Allowed 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 114.553 -1.203 . . . . 0.0 111.378 -179.192 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . 0.534 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 0.7 OUTLIER -61.63 -44.57 96.74 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.982 0.42 . . . . 0.0 109.95 178.873 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.535 ' HB3' ' CD2' ' A' ' 117' ' ' LEU . 0.0 OUTLIER -45.41 -65.0 0.6 Allowed 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.791 178.87 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.549 ' O ' ' CB ' ' A' ' 13' ' ' SER . 61.1 t60 -52.77 -39.87 62.64 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.603 178.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.534 ' HB2' ' O ' ' A' ' 7' ' ' ASP . 8.3 mmt180 -56.94 -62.48 1.71 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.846 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.492 ' HG3' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -64.75 -53.26 49.93 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 120.299 -0.561 . . . . 0.0 111.168 179.894 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.606 ' HA ' ' CD1' ' A' ' 15' ' ' LEU . 8.1 p -53.96 -51.07 49.12 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 C-N-CA 120.63 -0.428 . . . . 0.0 111.343 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.575 ' HA ' ' CE ' ' A' ' 114' ' ' LYS . 21.6 t -63.68 -31.19 72.28 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -179.552 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 20.0 tpp180 -70.99 -35.3 72.05 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 120.236 -0.585 . . . . 0.0 110.966 -178.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.606 ' CD1' ' HA ' ' A' ' 12' ' ' VAL . 0.1 OUTLIER -75.35 -52.66 10.28 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 119.974 -0.691 . . . . 0.0 110.593 179.841 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.581 HG22 ' O ' ' A' ' 12' ' ' VAL . 1.8 t -60.81 -55.14 26.6 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.96 -179.367 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -61.02 -17.83 54.37 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -178.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 15.9 pt20 -170.39 71.44 0.06 Allowed 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.527 -0.469 . . . . 0.0 111.977 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.46 ' HB2' ' HA ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER 170.3 -38.18 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.117 179.382 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.414 ' N ' ' O ' ' A' ' 15' ' ' LEU . 70.1 m -115.33 -24.03 8.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.54 -179.362 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 56.66 55.34 30.45 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.457 -0.877 . . . . 0.0 111.945 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.418 ' HA ' ' CG1' ' A' ' 16' ' ' VAL . 0.3 OUTLIER 59.97 82.9 0.14 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.136 0.493 . . . . 0.0 110.768 -179.544 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.428 ' O ' ' HB ' ' A' ' 109' ' ' THR . 0.1 OUTLIER -133.97 -151.9 0.46 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.703 179.851 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.635 ' HB ' ' HB3' ' A' ' 34' ' ' ASN . 0.2 OUTLIER -103.9 134.37 47.31 Favored 'General case' 0 CA--C 1.52 -0.184 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.179 179.609 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -104.5 141.01 15.19 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.399 -0.905 . . . . 0.0 112.619 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.53 ' HB2' ' CB ' ' A' ' 51' ' ' SER . 0.0 OUTLIER -104.5 130.27 52.44 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 179.877 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.479 ' CD1' ' CD1' ' A' ' 55' ' ' PHE . 0.7 OUTLIER -111.12 153.17 26.09 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.296 0.57 . . . . 0.0 112.293 -178.468 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.405 ' HD2' ' NZ ' ' A' ' 26' ' ' LYS . 2.7 mtm180 161.2 61.35 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.188 179.559 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 79.74 -0.34 82.31 Favored Glycine 0 N--CA 1.45 -0.379 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 -177.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.509 ' C ' ' ND2' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -165.93 165.84 17.87 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 -179.682 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.492 HG12 ' HG3' ' A' ' 11' ' ' GLN . 9.1 p -111.9 137.91 42.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.24 0.543 . . . . 0.0 111.074 178.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.428 ' CB ' ' CG ' ' A' ' 26' ' ' LYS . . . -125.39 165.72 17.89 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.783 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -103.93 127.89 51.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.295 0.569 . . . . 0.0 111.717 -179.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.635 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 50.3 t30 -116.3 115.93 26.81 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.628 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.68 -28.6 3.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.279 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -48.6 -72.6 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.207 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.418 ' O ' ' CB ' ' A' ' 38' ' ' THR . 57.9 p -86.95 -103.43 0.07 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.423 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.51 ' O ' ' HB3' ' A' ' 39' ' ' PHE . 0.2 OUTLIER 164.66 -111.69 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.581 ' CG ' ' N ' ' A' ' 40' ' ' GLN . 0.1 OUTLIER 172.54 -164.61 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 179.98 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.581 ' N ' ' CG ' ' A' ' 39' ' ' PHE . 0.2 OUTLIER 160.34 37.6 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.078 0.551 . . . . 0.0 110.494 179.501 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.53 ' C ' ' HB2' ' A' ' 107' ' ' GLN . . . 77.72 -26.24 2.03 Favored Glycine 0 CA--C 1.526 0.727 0 CA-C-N 115.755 -0.657 . . . . 0.0 113.091 -179.159 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.453 ' O ' ' HB2' ' A' ' 107' ' ' GLN . 1.8 mp -32.62 135.03 0.09 Allowed 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.4 m -95.39 36.08 1.27 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.422 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.458 ' O ' ' CG2' ' A' ' 44' ' ' ILE . 5.1 mp 66.02 0.0 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.079 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -74.92 -25.56 59.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.927 0.394 . . . . 0.0 110.761 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.5 t -101.33 -66.01 0.94 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.144 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -170.59 52.25 0.19 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.602 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.405 ' CB ' ' OE1' ' A' ' 107' ' ' GLN . . . -113.34 -178.73 3.45 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.015 0.436 . . . . 0.0 111.11 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.72 126.28 51.97 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.786 179.268 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -46.97 -28.36 1.6 Allowed 'General case' 0 C--O 1.233 0.206 0 CA-C-O 120.98 0.419 . . . . 0.0 110.468 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' SER . . . . . 0.53 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 82.7 p -59.22 -62.49 1.84 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.935 179.502 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.485 ' CB ' ' HG2' ' A' ' 107' ' ' GLN . 0.4 OUTLIER -42.65 -57.6 2.65 Favored 'General case' 0 C--O 1.231 0.082 0 CA-C-O 121.188 0.518 . . . . 0.0 110.435 179.639 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.436 ' HB3' HD11 ' A' ' 44' ' ' ILE . 0.1 OUTLIER -46.85 -61.9 1.64 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.88 179.151 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 30.9 t -50.07 -46.86 24.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.812 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.479 ' CD1' ' CD1' ' A' ' 27' ' ' LEU . 0.4 OUTLIER -58.95 -33.42 70.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.329 179.263 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -67.76 -43.91 78.71 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.847 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.1 mm-40 -67.42 -33.87 76.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.057 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.411 ' CG2' ' HB3' ' A' ' 2' ' ' ASN . 11.8 p -77.46 -41.29 40.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.061 -179.507 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.472 ' CG1' ' CD1' ' A' ' 55' ' ' PHE . 21.0 m -73.49 -31.28 32.42 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.844 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.538 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.429 ' N ' HG21 ' A' ' 59' ' ' VAL . 10.1 tp -77.84 -37.89 47.42 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-O 120.906 0.384 . . . . 0.0 110.101 178.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 6.3 t -67.73 -53.06 30.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.793 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . 0.423 ' CE1' ' HG ' ' A' ' 5' ' ' LEU . 2.0 m-70 -47.82 -50.17 26.88 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 120.791 0.329 . . . . 0.0 110.199 179.471 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.467 HG12 HG12 ' A' ' 66' ' ' VAL . 0.9 OUTLIER -68.38 -74.48 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.35 179.48 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.457 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 60.91 13.95 4.88 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.506 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.457 ' CB ' ' O ' ' A' ' 64' ' ' ALA . 0.3 OUTLIER 159.72 -66.47 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 120.849 0.357 . . . . 0.0 111.644 -179.663 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.518 ' CG1' ' HA ' ' A' ' 120' ' ' ALA . 14.8 m 48.11 -127.66 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 115.79 -0.641 . . . . 0.0 112.248 -179.199 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.522 ' O ' ' O ' ' A' ' 98' ' ' SER . 5.9 p -174.54 -18.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 N-CA-C 113.107 0.781 . . . . 0.0 113.107 -179.303 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.485 HD11 ' HB3' ' A' ' 100' ' ' LEU . 3.5 mp 32.81 105.05 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 178.688 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 18.9 p -66.12 -153.42 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 177.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -68.64 -34.54 75.9 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.122 0.487 . . . . 0.0 110.114 179.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.43 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 0.8 OUTLIER -64.04 -65.77 0.63 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.362 -179.631 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.563 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 1.0 OUTLIER -50.92 -32.26 20.14 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.755 0.312 . . . . 0.0 110.936 -179.929 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 85.1 m -62.61 -63.51 1.2 Allowed 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.4 -24.43 59.99 Favored 'General case' 0 C--N 1.333 -0.116 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 177.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.577 ' CG ' ' CG2' ' A' ' 115' ' ' VAL . 0.2 OUTLIER -57.13 -65.42 0.62 Allowed 'General case' 0 C--O 1.236 0.36 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.514 179.074 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.454 ' CD1' ' CD2' ' A' ' 68' ' ' LEU . 0.5 OUTLIER -60.48 -42.22 95.82 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 178.913 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -54.15 -36.45 63.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.801 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -75.66 -60.45 2.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.321 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.58 -32.05 70.02 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.206 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.402 ' OG1' ' CD1' ' A' ' 88' ' ' TYR . 54.5 m . . . . . 0 C--N 1.328 -0.326 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.346 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . 0.404 ' OD1' ' O ' ' A' ' 103' ' ' LEU . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.181 0 CA-C-O 120.446 0.165 . . . . 0.0 110.774 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.522 ' CZ ' ' CG ' ' A' ' 112' ' ' ASP . 2.5 m-85 -96.59 141.8 29.42 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 121.038 0.447 . . . . 0.0 110.757 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.732 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.5 OUTLIER -117.06 140.29 49.67 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 179.732 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.427 ' CD2' ' HA ' ' A' ' 100' ' ' LEU . 34.0 mt -143.31 154.55 43.89 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -177.018 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.464 ' O ' ' OG ' ' A' ' 98' ' ' SER . 0.0 OUTLIER -143.77 131.9 21.82 Favored 'General case' 0 C--O 1.223 -0.334 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 177.176 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.424 ' O ' ' CG1' ' A' ' 93' ' ' VAL . 54.2 p -103.96 146.01 29.31 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 -176.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.424 ' CG1' ' O ' ' A' ' 92' ' ' SER . 10.4 m . . . . . 0 CA--C 1.541 0.614 0 CA-C-N 113.616 -1.629 . . . . 0.0 108.683 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.419 ' O ' ' O ' ' A' ' 93' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.225 -0.197 0 CA-C-O 120.697 0.284 . . . . 0.0 110.385 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.522 ' O ' ' O ' ' A' ' 67' ' ' VAL . 4.1 t -140.49 162.88 34.3 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.371 0.605 . . . . 0.0 110.834 -179.581 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . 0.4 ' O ' HD22 ' A' ' 90' ' ' LEU . 1.2 t -103.18 136.8 34.13 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.957 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 178.658 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.501 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 0.1 OUTLIER -104.3 110.37 22.58 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-O 121.911 0.863 . . . . 0.0 113.032 -177.695 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.732 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -118.69 103.61 14.81 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.997 0 N-CA-C 103.878 -2.638 . . . . 0.0 103.878 175.023 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 0.512 ' O ' HD22 ' A' ' 103' ' ' LEU . 0.3 OUTLIER -139.75 154.59 47.46 Favored 'General case' 0 C--N 1.309 -1.192 0 C-N-CA 119.015 -1.074 . . . . 0.0 113.732 -174.756 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.512 HD22 ' O ' ' A' ' 102' ' ' SER . 0.0 OUTLIER 166.81 -91.38 0.0 OUTLIER 'General case' 0 N--CA 1.438 -1.063 0 CA-C-N 113.662 -1.608 . . . . 0.0 111.515 176.796 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.574 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 48.6 59.18 4.53 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 -179.532 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.574 ' CB ' ' O ' ' A' ' 104' ' ' ARG . 4.9 t 102.53 157.82 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 -176.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.95 100.87 10.47 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 119.211 -0.996 . . . . 0.0 112.799 -178.685 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.53 ' HB2' ' C ' ' A' ' 41' ' ' GLY . 1.5 tt0 -168.03 122.92 0.97 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.838 -1.074 . . . . 0.0 109.874 177.325 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -122.8 164.46 18.33 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.172 0.51 . . . . 0.0 111.531 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.449 ' CG2' ' CE1' ' A' ' 39' ' ' PHE . 1.5 p -121.79 165.4 15.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.771 -179.63 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.497 ' HB3' ' CG2' ' A' ' 16' ' ' VAL . 5.5 mt -51.86 -49.87 62.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.778 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -59.82 -64.05 1.09 Allowed 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.119 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . 0.575 ' HA ' HG22 ' A' ' 115' ' ' VAL . 24.8 m-20 -48.02 -44.87 31.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.901 179.434 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . 0.405 ' HB2' ' CZ ' ' A' ' 55' ' ' PHE . . . -56.4 -54.2 48.42 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.08 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.575 ' CE ' ' HA ' ' A' ' 13' ' ' SER . 0.3 OUTLIER -62.5 -34.68 77.34 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.505 179.413 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.577 ' CG2' ' CG ' ' A' ' 75' ' ' LYS . 84.4 t -55.84 -65.48 0.37 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.827 0 CA-C-O 121.931 0.872 . . . . 0.0 111.299 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.577 ' O ' ' HB2' ' A' ' 120' ' ' ALA . 0.0 OUTLIER -59.93 -37.75 80.4 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.311 -179.106 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.535 ' CD2' ' HB3' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -73.66 -21.36 60.3 Favored 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 120.505 -0.478 . . . . 0.0 111.621 -179.994 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.479 ' HB2' ' O ' ' A' ' 114' ' ' LYS . 0.1 OUTLIER -69.17 -47.4 65.04 Favored 'General case' 0 CA--C 1.503 -0.83 0 N-CA-C 106.442 -1.688 . . . . 0.0 106.442 177.479 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . 0.422 ' CB ' ' HG ' ' A' ' 68' ' ' LEU . . . -76.12 -25.31 55.26 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 114.747 -1.115 . . . . 0.0 109.909 177.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.577 ' HB2' ' O ' ' A' ' 116' ' ' LEU . . . -69.8 -60.64 2.18 Favored 'General case' 0 CA--C 1.508 -0.666 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.979 179.395 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.56 ' HG ' ' N ' ' A' ' 122' ' ' ARG . 0.2 OUTLIER -62.4 -39.39 93.09 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.193 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.56 ' N ' ' HG ' ' A' ' 121' ' ' LEU . 0.1 OUTLIER -52.37 -58.18 7.49 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.186 179.481 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 92.3 mm-40 -81.74 -26.37 34.59 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 -178.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . 0.42 ' CG ' ' O ' ' A' ' 120' ' ' ALA . 3.6 mm-40 -96.06 -66.65 0.89 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.847 1.054 . . . . 0.0 113.847 -178.164 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.268 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -177.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . 0.525 ' CG ' ' H ' ' A' ' 3' ' ' LEU . 2.5 p30 . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.915 0.388 . . . . 0.0 111.078 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.536 HD22 ' HA ' ' A' ' 30' ' ' ASN . 2.6 mp -164.05 -75.23 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.278 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.411 ' O ' ' CB ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER 171.07 -170.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.726 -179.842 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.46 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 6.5 mt -95.52 -63.26 1.18 Allowed 'General case' 0 CA--C 1.505 -0.765 0 CA-C-O 121.293 0.568 . . . . 0.0 111.558 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.419 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -59.54 -47.19 86.48 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 115.195 -0.911 . . . . 0.0 112.075 -178.162 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -65.59 -55.1 19.49 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.33 0.586 . . . . 0.0 110.021 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.455 ' HB3' HD22 ' A' ' 117' ' ' LEU . 8.6 tp -55.2 -45.7 75.86 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.102 179.019 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.422 ' CD2' HD22 ' A' ' 121' ' ' LEU . 76.4 t60 -54.4 -45.66 72.96 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.227 179.154 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.419 ' HG3' ' O ' ' A' ' 6' ' ' SER . 36.9 mtt180 -59.31 -52.88 63.74 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.594 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.464 ' HG3' HG13 ' A' ' 31' ' ' VAL . 3.3 tp-100 -57.31 -57.41 12.74 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 121.149 0.5 . . . . 0.0 110.706 179.461 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.47 HG21 ' CD1' ' A' ' 110' ' ' LEU . 7.4 p -58.83 -46.11 91.16 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.717 -179.804 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.707 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 35.9 t -55.34 -64.07 0.96 Allowed 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.954 -0.566 . . . . 0.0 112.002 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.464 ' O ' ' CG ' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -60.16 -32.78 71.37 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.056 -179.115 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 9.7 mt -59.57 -65.37 0.68 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.925 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.658 ' CG2' ' HB3' ' A' ' 110' ' ' LEU . 0.5 OUTLIER -65.53 -24.99 35.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.144 -179.523 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.38 -4.88 47.65 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -178.787 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.464 ' CG ' ' O ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -140.38 23.9 2.31 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 120.392 -0.523 . . . . 0.0 112.382 179.558 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -177.69 -69.85 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.493 ' CB ' ' HA ' ' A' ' 16' ' ' VAL . 0.1 OUTLIER -46.51 -53.06 12.02 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.703 -178.787 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 80.93 37.57 18.66 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.558 -0.83 . . . . 0.0 112.031 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.635 ' H ' HG21 ' A' ' 16' ' ' VAL . 7.7 t70 78.13 21.87 0.84 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.823 0.344 . . . . 0.0 110.715 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.42 ' O ' ' OG1' ' A' ' 109' ' ' THR . 0.0 OUTLIER -76.28 -151.97 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.708 179.978 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.522 ' HB ' ' HB3' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -103.51 165.35 11.09 Favored 'General case' 0 CA--C 1.519 -0.243 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 -179.987 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.467 ' HA2' ' O ' ' A' ' 32' ' ' ALA . . . -127.58 156.18 20.4 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.041 -1.076 . . . . 0.0 113.909 -178.721 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.557 ' HB2' ' CB ' ' A' ' 51' ' ' SER . 0.0 OUTLIER -125.75 123.88 39.8 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.998 -0.601 . . . . 0.0 109.96 179.488 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.463 ' HB2' ' CG ' ' A' ' 55' ' ' PHE . 2.6 tt -113.15 144.34 42.82 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.419 0.628 . . . . 0.0 111.922 -179.376 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 169.77 54.23 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.729 179.672 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . 0.433 ' O ' HD22 ' A' ' 3' ' ' LEU . . . 109.17 -19.31 29.88 Favored Glycine 0 N--CA 1.45 -0.433 0 N-CA-C 110.468 -1.053 . . . . 0.0 110.468 -177.673 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.536 ' HA ' HD22 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -166.14 165.45 17.67 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 179.481 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.464 HG13 ' HG3' ' A' ' 11' ' ' GLN . 2.1 p -106.74 133.38 51.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 121.348 0.594 . . . . 0.0 110.836 178.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.522 ' O ' HD21 ' A' ' 110' ' ' LEU . . . -123.52 166.27 15.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.404 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.405 ' CB ' ' OG ' ' A' ' 20' ' ' SER . . . -102.61 138.42 39.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.543 0.687 . . . . 0.0 112.381 -178.216 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.522 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 31.4 t30 -114.94 123.5 49.28 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 114.698 -1.137 . . . . 0.0 110.531 -179.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.1 mtmp? -135.86 21.96 3.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.068 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -119.02 -24.59 6.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.338 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 4.9 p -118.09 177.55 4.75 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.988 0.423 . . . . 0.0 111.105 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.409 ' O ' ' NE2' ' A' ' 40' ' ' GLN . 12.3 p -128.63 115.04 17.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.312 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.615 ' C ' ' NE2' ' A' ' 107' ' ' GLN . 4.2 p90 -68.45 -84.87 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.591 -179.138 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.553 ' N ' ' CG ' ' A' ' 39' ' ' PHE . 0.0 OUTLIER 63.96 54.45 1.72 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.382 0.673 . . . . 0.0 112.711 179.924 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.566 ' O ' ' O ' ' A' ' 42' ' ' LEU . . . 69.2 -50.55 0.56 Allowed Glycine 0 CA--C 1.526 0.72 0 CA-C-N 116.088 -0.505 . . . . 0.0 113.095 179.618 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.566 ' O ' ' O ' ' A' ' 41' ' ' GLY . 0.8 OUTLIER 3.94 125.75 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.454 1.101 . . . . 0.0 113.92 179.102 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.428 ' C ' ' H ' ' A' ' 45' ' ' ALA . 0.8 OUTLIER -91.2 56.98 3.28 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.976 -179.617 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.444 ' HA ' ' HB3' ' A' ' 48' ' ' ALA . 1.8 mp 49.55 9.26 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 179.052 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.428 ' H ' ' C ' ' A' ' 43' ' ' THR . . . -100.75 -56.78 2.25 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -178.448 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' SER . . . . . 0.458 ' CB ' ' CD1' ' A' ' 42' ' ' LEU . 0.3 OUTLIER -54.5 -26.79 33.65 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.741 -178.883 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 140.51 38.99 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.378 -0.915 . . . . 0.0 112.929 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.444 ' HB3' ' HA ' ' A' ' 44' ' ' ILE . . . -93.96 -167.04 1.61 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.799 0.333 . . . . 0.0 110.447 179.504 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.445 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 0.7 OUTLIER -128.94 146.86 50.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.574 179.664 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.515 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 8.5 tt0 -53.14 -24.05 9.62 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.099 0.476 . . . . 0.0 110.706 179.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' SER . . . . . 0.672 ' O ' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -61.7 -65.25 0.72 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.454 -179.441 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.544 ' HB2' ' HG2' ' A' ' 107' ' ' GLN . 0.6 OUTLIER -53.23 -50.52 64.58 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.713 0.292 . . . . 0.0 111.783 -179.221 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.515 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -55.22 -57.13 13.03 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 111.716 0.265 . . . . 0.0 111.716 -179.35 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.672 HG23 ' O ' ' A' ' 51' ' ' SER . 15.7 m -54.36 -47.55 69.42 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 120.662 -0.415 . . . . 0.0 110.383 179.503 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.494 ' CZ ' ' CB ' ' A' ' 113' ' ' ALA . 0.6 OUTLIER -48.37 -42.72 32.51 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.812 178.785 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.411 ' CA ' ' HB2' ' A' ' 108' ' ' MET . . . -64.24 -44.95 90.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.316 178.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 50.6 mm-40 -56.73 -47.46 79.96 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.13 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.458 HG21 ' O ' ' A' ' 55' ' ' PHE . 0.1 OUTLIER -64.02 -64.08 0.98 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.309 -179.702 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.477 ' O ' HG23 ' A' ' 63' ' ' VAL . 12.0 p -46.28 -51.73 3.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.971 -179.6 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.411 ' CD1' ' O ' ' A' ' 102' ' ' SER . 0.4 OUTLIER -55.6 -49.17 73.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.815 0.341 . . . . 0.0 110.835 179.235 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.8 m -55.57 -60.6 3.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.239 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . 0.415 ' HB3' ' CD2' ' A' ' 5' ' ' LEU . 1.7 m170 -49.51 -37.36 26.31 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 121.094 0.473 . . . . 0.0 110.123 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.605 ' CG2' ' HB3' ' A' ' 116' ' ' LEU . 40.8 t -75.64 -82.19 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.247 179.194 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.475 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 72.62 -6.72 1.56 Allowed 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 178.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.506 ' H ' HG12 ' A' ' 63' ' ' VAL . 6.5 m-20 153.46 -61.52 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.394 0.677 . . . . 0.0 109.365 -179.378 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.624 HG11 ' HA ' ' A' ' 120' ' ' ALA . 0.1 OUTLIER 44.23 -100.96 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 CA-C-N 115.243 -0.89 . . . . 0.0 112.842 178.903 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.599 ' HB ' ' O ' ' A' ' 66' ' ' VAL . 0.3 OUTLIER 167.38 107.87 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.343 0.289 0 CA-C-O 121.594 0.711 . . . . 0.0 109.833 -179.519 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.599 ' HB3' ' CB ' ' A' ' 72' ' ' ASP . 0.1 OUTLIER -110.29 112.63 24.71 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.752 -178.071 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.538 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 11.0 p -83.37 178.7 7.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.608 -0.723 . . . . 0.0 110.788 179.291 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -41.0 -31.14 0.16 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.558 -179.696 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -68.97 -57.8 4.98 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.943 0.401 . . . . 0.0 110.396 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.619 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 65.4 m-20 -69.3 -39.87 78.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.722 179.742 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 62.1 m -61.3 -41.23 96.63 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-O 121.296 0.569 . . . . 0.0 109.622 178.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.487 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . . . -71.24 -30.74 66.69 Favored 'General case' 0 CA--C 1.512 -0.506 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 177.744 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.619 ' HB2' ' HA ' ' A' ' 72' ' ' ASP . 0.3 OUTLIER -55.01 -50.36 69.22 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 114.322 -1.308 . . . . 0.0 109.426 177.92 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.48 ' HB3' ' CE2' ' A' ' 88' ' ' TYR . 1.4 mt -67.29 -56.75 8.49 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.466 179.205 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.487 ' CD2' ' HA ' ' A' ' 74' ' ' ALA . 0.6 OUTLIER -54.57 -26.85 34.85 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.476 179.808 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -72.53 -54.81 8.18 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.232 179.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' SER . . . . . 0.424 ' HB3' ' CG ' ' A' ' 111' ' ' GLN . 0.0 OUTLIER -52.65 -36.19 56.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.676 179.551 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 86.0 m . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.788 -179.549 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . 0.548 ' HA ' ' HB2' ' A' ' 104' ' ' ARG . 9.7 t-20 . . . . . 0 C--O 1.238 0.47 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.501 ' HB2' ' HB3' ' A' ' 102' ' ' SER . 6.9 p90 -96.73 160.57 14.3 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 121.232 0.539 . . . . 0.0 112.397 -178.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.708 ' HB3' ' O ' ' A' ' 101' ' ' VAL . 0.8 OUTLIER -131.9 140.7 49.14 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 178.593 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.405 ' CD1' ' CD1' ' A' ' 76' ' ' LEU . 8.0 mt -133.94 155.27 50.23 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 -176.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.664 ' O ' ' HB3' ' A' ' 98' ' ' SER . 0.0 OUTLIER -139.96 150.25 44.27 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.293 178.439 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.448 ' O ' ' CG1' ' A' ' 93' ' ' VAL . 33.7 p -104.47 159.33 15.82 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 121.77 0.795 . . . . 0.0 112.648 -179.02 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.57 ' O ' ' O ' ' A' ' 97' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.436 -1.146 0 CA-C-N 113.853 -1.521 . . . . 0.0 108.199 -179.389 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.57 ' O ' ' O ' ' A' ' 93' ' ' VAL . 0.5 OUTLIER . . . . . 0 N--CA 1.438 -1.049 0 N-CA-C 106.86 -1.533 . . . . 0.0 106.86 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.664 ' HB3' ' O ' ' A' ' 91' ' ' ARG . 3.5 m -147.48 159.85 43.26 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 119.343 -0.943 . . . . 0.0 111.39 -178.274 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 1.2 t -103.56 140.42 21.78 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.487 ' CD2' ' CD1' ' A' ' 116' ' ' LEU . 0.1 OUTLIER -103.57 111.07 23.37 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-O 121.764 0.792 . . . . 0.0 112.899 -178.197 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.708 ' O ' ' HB3' ' A' ' 89' ' ' ASP . 0.1 OUTLIER -123.88 103.52 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.194 0 N-CA-C 104.202 -2.518 . . . . 0.0 104.202 175.003 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 0.6 ' O ' ' HB2' ' A' ' 103' ' ' LEU . 12.2 p -140.37 142.24 35.54 Favored 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 119.669 -0.813 . . . . 0.0 112.068 -175.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.6 ' HB2' ' O ' ' A' ' 102' ' ' SER . 0.2 OUTLIER 147.74 79.29 0.0 OUTLIER 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.784 177.531 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.548 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -98.31 28.43 4.1 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 177.487 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.491 ' HB3' ' O ' ' A' ' 41' ' ' GLY . 6.9 m 148.83 179.21 0.0 OUTLIER 'General case' 0 C--N 1.343 0.293 0 CA-C-N 113.749 -1.569 . . . . 0.0 107.047 -178.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -104.14 101.34 11.09 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 119.1 0.864 . . . . 0.0 111.908 -178.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.615 ' NE2' ' C ' ' A' ' 39' ' ' PHE . 0.6 OUTLIER -169.46 165.05 10.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.308 178.434 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.432 ' HG2' HG12 ' A' ' 59' ' ' VAL . 1.8 tpt -165.21 142.46 5.88 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.3 0.572 . . . . 0.0 112.008 178.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.456 ' CG2' ' CZ ' ' A' ' 39' ' ' PHE . 0.5 OUTLIER -104.83 159.55 15.7 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.709 179.112 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.658 ' HB3' ' CG2' ' A' ' 16' ' ' VAL . 0.9 OUTLIER -46.44 -55.75 6.96 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.357 0.599 . . . . 0.0 109.977 179.411 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . 0.862 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 2.2 tp-100 -53.05 -66.7 0.34 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.791 -179.214 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . 0.833 ' O ' HG22 ' A' ' 115' ' ' VAL . 7.5 m-20 -44.61 -37.57 3.7 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.525 0.679 . . . . 0.0 110.746 -179.699 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . 0.494 ' CB ' ' CZ ' ' A' ' 55' ' ' PHE . . . -62.63 -44.24 96.79 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.384 179.205 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.862 ' HD2' ' HA ' ' A' ' 111' ' ' GLN . 0.0 OUTLIER -79.28 -21.9 45.41 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.77 -179.578 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.833 HG22 ' O ' ' A' ' 112' ' ' ASP . 13.2 m -69.55 -48.87 63.64 Favored 'Isoleucine or valine' 0 C--O 1.242 0.688 0 CA-C-O 122.165 0.984 . . . . 0.0 109.209 179.164 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.605 ' HB3' ' CG2' ' A' ' 63' ' ' VAL . 1.2 mp -71.5 -36.82 71.24 Favored 'General case' 0 N--CA 1.433 -1.3 0 CA-C-N 114.148 -1.387 . . . . 0.0 110.068 179.525 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.631 ' HA ' ' HB2' ' A' ' 120' ' ' ALA . 0.2 OUTLIER -75.83 -20.12 58.39 Favored 'General case' 0 CA--C 1.51 -0.578 0 C-N-CA 120.421 -0.512 . . . . 0.0 110.767 178.935 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.431 ' HA ' HD23 ' A' ' 121' ' ' LEU . 28.6 tp10 -71.66 -50.23 32.42 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 177.531 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . 0.522 ' HA ' ' HB3' ' A' ' 122' ' ' ARG . . . -72.28 -33.27 67.31 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.863 177.287 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.631 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . . . -60.82 -64.82 0.82 Allowed 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.824 179.367 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -58.42 -31.5 67.78 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.716 179.077 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.522 ' HB3' ' HA ' ' A' ' 119' ' ' ALA . 0.0 OUTLIER -59.5 -65.15 0.72 Allowed 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.958 -179.798 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.461 ' CB ' HG13 ' A' ' 66' ' ' VAL . 1.4 tm0? -86.71 -4.7 59.21 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 113.376 0.88 . . . . 0.0 113.376 -177.486 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . 0.402 ' HG2' HG11 ' A' ' 66' ' ' VAL . 5.0 mm-40 -93.83 -67.34 0.86 Allowed 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 119.895 -0.722 . . . . 0.0 111.614 -179.675 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 9.8 p . . . . . 0 C--N 1.323 -0.558 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.492 -179.832 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.6 p30 . . . . . 0 CA--C 1.531 0.217 0 CA-C-O 120.81 0.338 . . . . 0.0 111.373 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.404 HD22 ' O ' ' A' ' 29' ' ' GLY . 5.7 mp -73.23 -72.5 0.25 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.341 0.591 . . . . 0.0 110.455 179.374 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 167.73 -159.21 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.109 -0.951 . . . . 0.0 109.087 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.555 HD23 ' CG ' ' A' ' 62' ' ' HIS . 0.0 OUTLIER -95.25 -60.98 1.55 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.887 0.375 . . . . 0.0 111.413 179.567 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.8 p -53.74 -45.05 70.41 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.888 -0.597 . . . . 0.0 112.242 -179.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . 0.421 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -73.18 -62.47 1.46 Allowed 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 120.901 0.381 . . . . 0.0 110.192 -179.679 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.437 ' HB3' ' CD2' ' A' ' 117' ' ' LEU . 6.5 tp -45.05 -45.74 11.04 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.313 179.203 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.45 ' CG ' HD21 ' A' ' 121' ' ' LEU . 63.4 t60 -62.16 -48.78 78.58 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.581 178.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.432 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 4.1 mmt180 -48.92 -54.92 13.46 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.755 -179.416 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.527 ' HG3' ' CG1' ' A' ' 31' ' ' VAL . 0.0 OUTLIER -67.5 -54.89 16.24 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -179.353 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.452 ' O ' ' HB2' ' A' ' 15' ' ' LEU . 8.6 p -55.98 -46.87 80.68 Favored 'Isoleucine or valine' 0 C--O 1.242 0.698 0 CA-C-O 121.292 0.568 . . . . 0.0 111.18 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.525 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 9.2 t -58.99 -57.97 10.74 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.965 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.432 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -58.13 -25.73 61.77 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.697 -179.863 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.452 ' HB2' ' O ' ' A' ' 12' ' ' VAL . 12.9 mt -67.97 -65.37 0.7 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.687 -179.519 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.57 ' HB ' ' NZ ' ' A' ' 114' ' ' LYS . 1.4 t -73.43 -25.0 20.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 120.148 -0.621 . . . . 0.0 110.977 -179.538 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.426 ' CG ' ' O ' ' A' ' 13' ' ' SER . 7.2 mm-40 -75.96 -23.42 55.37 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.253 179.384 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -154.3 57.87 0.71 Allowed 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 120.73 0.3 . . . . 0.0 111.274 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 175.89 -61.8 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.52 ' HB2' ' HA ' ' A' ' 16' ' ' VAL . 20.4 m -85.44 -77.85 0.28 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.894 0.378 . . . . 0.0 111.97 -178.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . 0.549 ' H ' ' HA ' ' A' ' 16' ' ' VAL . . . 118.57 -36.64 3.52 Favored Glycine 0 N--CA 1.449 -0.473 0 N-CA-C 111.553 -0.619 . . . . 0.0 111.553 -179.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.405 ' O ' ' O ' ' A' ' 23' ' ' CYS . 0.2 OUTLIER -177.08 5.24 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.719 0.295 . . . . 0.0 111.636 179.895 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.49 ' HB3' ' O ' ' A' ' 34' ' ' ASN . 88.5 m -52.65 -165.96 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.495 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.593 ' CB ' ' HB3' ' A' ' 34' ' ' ASN . 0.2 OUTLIER -103.77 164.47 11.66 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.142 179.758 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -109.21 136.26 13.44 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.301 -0.952 . . . . 0.0 113.716 -178.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.529 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 2.1 tmmm? -105.68 116.65 32.31 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 178.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.456 ' O ' ' CB ' ' A' ' 28' ' ' ARG . 8.6 tt -104.11 146.77 28.26 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.033 0.444 . . . . 0.0 111.849 -179.05 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.456 ' CB ' ' O ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER 153.81 64.59 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.271 -179.863 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . 0.404 ' O ' HD22 ' A' ' 3' ' ' LEU . . . 89.94 -12.43 67.55 Favored Glycine 0 CA--C 1.519 0.289 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.764 -178.56 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.485 ' C ' ' ND2' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -165.9 165.16 18.39 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.529 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -110.37 121.35 63.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 C-N-CA 120.439 -0.504 . . . . 0.0 109.939 177.781 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.456 ' CB ' ' HB3' ' A' ' 26' ' ' LYS . . . -104.07 166.5 10.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.771 -179.217 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.429 ' CB ' ' OG ' ' A' ' 20' ' ' SER . . . -103.15 104.76 14.94 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.26 0.553 . . . . 0.0 111.72 -178.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.593 ' HB3' ' CB ' ' A' ' 24' ' ' THR . 49.5 t30 -76.25 86.75 3.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.998 179.303 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.91 74.49 2.64 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.836 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 179.62 -36.66 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.46 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.426 HG22 ' CE1' ' A' ' 39' ' ' PHE . 0.2 OUTLIER -100.72 -166.62 1.33 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.794 179.862 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -168.83 102.22 0.39 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.682 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.646 ' CZ ' ' HA ' ' A' ' 48' ' ' ALA . 20.6 m-30 -114.92 145.03 42.65 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -178.209 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.479 ' O ' ' HG2' ' A' ' 40' ' ' GLN . 2.1 pm0 -153.75 65.23 0.73 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.229 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.446 ' HA3' ' HB2' ' A' ' 87' ' ' ASN . . . 78.31 106.39 0.19 Allowed Glycine 0 CA--C 1.519 0.332 0 CA-C-N 115.352 -0.84 . . . . 0.0 113.084 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.644 ' N ' ' HB3' ' A' ' 105' ' ' SER . 0.0 OUTLIER -154.81 -135.23 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 178.86 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -170.52 35.28 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 O-C-N 121.859 -0.525 . . . . 0.0 111.493 -179.656 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 4.9 mt 63.29 3.49 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -88.63 -56.39 3.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.916 0.389 . . . . 0.0 110.752 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.4 t -60.39 -22.59 63.51 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.727 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 135.5 46.6 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.295 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.646 ' HA ' ' CZ ' ' A' ' 39' ' ' PHE . . . -102.68 -169.02 1.6 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.087 0.47 . . . . 0.0 111.457 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.8 142.08 28.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.977 179.315 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.474 ' HA ' ' HD2' ' A' ' 53' ' ' LYS . 10.1 tt0 -44.52 -29.27 0.69 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.818 0.342 . . . . 0.0 111.654 -179.324 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' SER . . . . . 0.413 ' CB ' ' HG2' ' A' ' 26' ' ' LYS . 5.2 m -56.54 -65.18 0.65 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.742 -179.612 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 108' ' ' MET . 0.7 OUTLIER -53.77 -63.77 1.04 Allowed 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 111.911 0.338 . . . . 0.0 111.911 -179.164 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.488 ' HB3' ' O ' ' A' ' 106' ' ' ASP . 0.7 OUTLIER -44.78 -51.89 8.98 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 120.686 0.279 . . . . 0.0 111.426 -179.802 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.476 ' H ' ' HG3' ' A' ' 53' ' ' LYS . 74.9 t -58.81 -34.32 51.87 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 CA-C-O 121.055 0.455 . . . . 0.0 109.788 179.188 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.454 ' HB3' ' HB3' ' A' ' 108' ' ' MET . 0.3 OUTLIER -63.67 -46.37 85.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.737 178.883 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -57.51 -46.61 83.58 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.455 179.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -62.91 -45.32 93.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.451 179.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 59.5 m -59.86 -57.76 11.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.917 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.544 ' CG2' ' HB2' ' A' ' 116' ' ' LEU . 7.7 p -59.04 -48.7 85.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.811 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 12.9 tp -54.83 -34.28 62.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.906 0.384 . . . . 0.0 110.615 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 49.2 m -72.27 -50.8 24.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.156 -179.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . 0.555 ' CG ' HD23 ' A' ' 5' ' ' LEU . 0.4 OUTLIER -66.63 -25.09 66.42 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 120.928 0.394 . . . . 0.0 110.733 -179.54 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.592 ' HB ' HD21 ' A' ' 100' ' ' LEU . 7.0 t -98.66 31.2 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.489 179.188 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.572 ' O ' ' HB2' ' A' ' 65' ' ' ASN . . . -68.85 61.73 0.1 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.288 -179.299 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.572 ' HB2' ' O ' ' A' ' 64' ' ' ALA . 0.7 OUTLIER 142.19 -73.13 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.095 0.558 . . . . 0.0 111.407 179.722 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.563 HG12 HG13 ' A' ' 63' ' ' VAL . 29.2 m 39.55 -146.15 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.912 -179.092 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.484 ' O ' ' O ' ' A' ' 98' ' ' SER . 4.1 p -158.51 -24.02 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 N-CA-C 112.284 0.476 . . . . 0.0 112.284 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.571 ' HB3' ' HB2' ' A' ' 72' ' ' ASP . 0.7 OUTLIER 36.89 92.6 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 179.093 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 15.7 p -64.34 177.02 0.92 Allowed 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 178.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -42.21 -33.2 0.57 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.807 0.337 . . . . 0.0 111.329 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -65.27 -63.81 1.01 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.468 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.591 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 48.5 m-20 -59.85 -33.51 71.89 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.859 0.362 . . . . 0.0 110.472 179.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.1 m -56.48 -62.81 1.47 Allowed 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 178.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -57.78 -27.48 63.11 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.449 0.642 . . . . 0.0 109.28 177.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.591 ' HB2' ' HA ' ' A' ' 72' ' ' ASP . 0.1 OUTLIER -56.99 -65.15 0.67 Allowed 'General case' 0 C--O 1.238 0.469 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.302 178.956 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.552 HD11 HG11 ' A' ' 115' ' ' VAL . 0.5 OUTLIER -56.21 -39.06 71.87 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.434 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.96 -49.18 74.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.398 179.522 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -60.69 -58.1 9.89 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.423 -179.626 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.65 -61.6 1.99 Allowed 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.566 -179.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.772 -179.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . 0.446 ' HB2' ' HA3' ' A' ' 41' ' ' GLY . 25.8 t30 . . . . . 0 C--O 1.241 0.645 0 CA-C-O 121.311 0.577 . . . . 0.0 110.632 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.524 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 4.1 m-85 -106.94 142.26 36.85 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.914 -179.01 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.666 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.2 OUTLIER -110.4 150.76 28.35 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 115.299 -0.864 . . . . 0.0 108.982 -179.4 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.435 ' CD2' ' CD1' ' A' ' 76' ' ' LEU . 2.0 mt -138.74 156.17 47.61 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -177.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.602 ' O ' ' CB ' ' A' ' 98' ' ' SER . 56.2 mmm-85 -128.19 149.8 50.29 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 114.695 -1.138 . . . . 0.0 108.536 177.866 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.43 ' O ' ' CG1' ' A' ' 93' ' ' VAL . 53.4 p -103.76 154.29 19.73 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.985 0.898 . . . . 0.0 113.065 -178.302 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.558 ' O ' ' O ' ' A' ' 97' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.433 -1.316 0 CA-C-N 113.594 -1.639 . . . . 0.0 107.531 -179.31 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.558 ' O ' ' O ' ' A' ' 93' ' ' VAL . 0.2 OUTLIER . . . . . 0 N--CA 1.454 -0.24 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.602 ' CB ' ' O ' ' A' ' 91' ' ' ARG . 0.6 OUTLIER -146.78 161.86 39.76 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.528 0.68 . . . . 0.0 111.451 179.942 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -103.87 155.04 5.76 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.176 179.604 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.592 HD21 ' HB ' ' A' ' 63' ' ' VAL . 1.4 tp -103.05 108.89 20.24 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-O 121.937 0.875 . . . . 0.0 112.389 -179.319 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.666 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -122.12 105.19 15.89 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.027 0 N-CA-C 104.073 -2.566 . . . . 0.0 104.073 175.49 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 0.73 ' O ' ' HB2' ' A' ' 103' ' ' LEU . 0.1 OUTLIER -144.34 165.15 28.72 Favored 'General case' 0 C--N 1.307 -1.265 0 C-N-CA 119.01 -1.076 . . . . 0.0 113.734 -173.917 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.73 ' HB2' ' O ' ' A' ' 102' ' ' SER . 0.5 OUTLIER 132.57 70.85 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 113.469 -1.696 . . . . 0.0 112.533 176.465 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.431 ' O ' ' OG ' ' A' ' 105' ' ' SER . 0.0 OUTLIER -98.32 13.21 32.25 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.757 -1.11 . . . . 0.0 108.132 177.001 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.644 ' HB3' ' N ' ' A' ' 42' ' ' LEU . 5.0 m 160.15 172.07 0.01 OUTLIER 'General case' 0 C--O 1.231 0.099 0 CA-C-N 114.108 -1.406 . . . . 0.0 107.335 -179.151 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.488 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.4 OUTLIER -104.75 101.7 11.3 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 119.61 -0.836 . . . . 0.0 112.194 -178.965 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.505 ' NE2' ' HB2' ' A' ' 42' ' ' LEU . 1.6 mt-30 -169.6 165.23 10.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.776 178.024 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.475 ' CE ' ' CE1' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -165.56 138.14 4.24 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.12 0.486 . . . . 0.0 111.799 178.48 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.45 HG23 HG22 ' A' ' 24' ' ' THR . 0.1 OUTLIER -103.91 159.58 15.53 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.38 178.759 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.514 ' HB3' ' CG2' ' A' ' 16' ' ' VAL . 6.8 mt -46.92 -55.55 7.87 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 121.174 -0.211 . . . . 0.0 110.908 -179.481 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . 0.546 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 2.1 tp60 -46.87 -65.52 0.55 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.691 0.281 . . . . 0.0 110.826 179.708 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . 0.504 ' O ' ' HB ' ' A' ' 115' ' ' VAL . 58.9 m-20 -45.52 -54.14 7.94 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 121.158 0.504 . . . . 0.0 110.867 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . 0.462 ' O ' HD13 ' A' ' 117' ' ' LEU . . . -44.31 -64.94 0.58 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.944 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.57 ' NZ ' ' HB ' ' A' ' 16' ' ' VAL . 0.0 OUTLIER -64.97 -22.08 66.94 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.473 -179.847 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.552 ' CG2' ' CG ' ' A' ' 75' ' ' LYS . 53.1 t -60.06 -64.94 0.51 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.815 0 CA-C-O 121.995 0.902 . . . . 0.0 109.786 179.535 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.544 ' HB2' ' CG2' ' A' ' 59' ' ' VAL . 0.2 OUTLIER -64.05 -35.83 82.02 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.85 179.67 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.535 ' CD2' HD12 ' A' ' 5' ' ' LEU . 0.4 OUTLIER -70.86 -19.14 62.66 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-O 121.044 0.449 . . . . 0.0 110.812 179.437 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.553 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 6.9 tp10 -75.34 -47.5 27.43 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 106.598 -1.63 . . . . 0.0 106.598 177.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . 0.403 ' CB ' ' HG ' ' A' ' 68' ' ' LEU . . . -77.93 -18.19 56.37 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 114.606 -1.179 . . . . 0.0 111.08 178.303 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.526 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . . . -82.44 -52.17 7.14 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.186 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.459 ' HB3' ' O ' ' A' ' 117' ' ' LEU . 0.0 OUTLIER -63.85 -30.06 71.19 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 178.148 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.553 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 4.3 ttm-85 -71.91 -55.98 6.53 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.422 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -92.7 -29.87 15.84 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 -177.024 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . 0.406 ' CB ' ' O ' ' A' ' 120' ' ' ALA . 4.4 mm-40 -75.73 -65.99 0.84 Allowed 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.514 -0.474 . . . . 0.0 112.038 -178.382 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.325 -0.482 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.97 -178.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.1 p30 . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.929 0.395 . . . . 0.0 111.278 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.566 ' C ' ' CD2' ' A' ' 3' ' ' LEU . 0.0 OUTLIER -91.38 -66.64 0.91 Allowed 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.405 -179.668 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.598 ' O ' ' HB2' ' A' ' 8' ' ' LEU . 39.9 t 172.81 -169.18 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 179.391 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.561 HD12 ' HB1' ' A' ' 120' ' ' ALA . 0.0 OUTLIER -96.7 -65.42 0.97 Allowed 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.661 -0.416 . . . . 0.0 111.406 179.049 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.4 p -51.18 -49.01 61.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.695 -179.078 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . 0.418 ' HB2' ' CD1' ' A' ' 3' ' ' LEU . 2.9 m-20 -67.9 -44.59 76.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.904 0.383 . . . . 0.0 110.19 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.598 ' HB2' ' O ' ' A' ' 4' ' ' SER . 18.6 tp -61.53 -64.75 0.84 Allowed 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.279 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.48 ' CD2' ' CD2' ' A' ' 121' ' ' LEU . 71.7 t60 -45.19 -50.53 11.43 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.392 0.615 . . . . 0.0 109.865 178.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.458 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 17.3 mmt85 -56.39 -51.43 68.37 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.298 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.683 ' HG3' HG12 ' A' ' 31' ' ' VAL . 4.6 pt20 -71.05 -53.31 15.14 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.728 -179.587 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.712 ' HA ' HG11 ' A' ' 31' ' ' VAL . 10.0 p -55.58 -50.04 69.5 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-O 120.705 0.288 . . . . 0.0 111.455 179.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.424 ' O ' ' HB2' ' A' ' 17' ' ' GLN . 4.6 t -64.51 -43.66 93.35 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.354 179.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.458 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -53.79 -43.92 69.69 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -179.441 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.487 ' CD2' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -75.36 -51.13 13.88 Favored 'General case' 0 CA--C 1.517 -0.29 0 C-N-CA 119.879 -0.728 . . . . 0.0 111.102 -179.692 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.664 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 8.8 p -73.92 -4.83 5.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 113.569 0.951 . . . . 0.0 113.569 -178.293 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.427 ' HG2' ' CE ' ' A' ' 114' ' ' LYS . 5.9 mm-40 -93.38 -4.71 50.98 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.221 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -153.34 -40.53 0.1 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.694 0.283 . . . . 0.0 111.278 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.409 ' N ' ' O ' ' A' ' 15' ' ' LEU . 3.2 tt0 -89.45 -66.7 0.9 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.751 0.31 . . . . 0.0 111.268 -179.838 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.664 ' HB2' ' HA ' ' A' ' 16' ' ' VAL . 0.7 OUTLIER -69.77 -32.74 71.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.853 -179.827 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 76.22 -56.23 3.21 Favored Glycine 0 CA--C 1.52 0.368 0 C-N-CA 120.954 -0.641 . . . . 0.0 113.67 179.118 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.463 ' HA ' ' CG2' ' A' ' 16' ' ' VAL . 0.1 OUTLIER -176.92 8.31 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.701 0.25 . . . . 0.0 111.635 -179.158 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.418 ' O ' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -56.49 -152.88 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.048 -179.599 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.464 ' HA ' ' HB ' ' A' ' 109' ' ' THR . 0.0 OUTLIER -103.62 153.16 20.92 Favored 'General case' 0 CA--C 1.52 -0.187 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.34 -179.871 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.451 ' CA ' ' HG ' ' A' ' 110' ' ' LEU . . . -113.17 124.95 6.79 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.337 -0.935 . . . . 0.0 113.459 -178.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.425 ' O ' ' HG3' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -109.01 127.78 54.38 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 178.483 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.972 ' HB3' ' HA ' ' A' ' 31' ' ' VAL . 0.4 OUTLIER -164.02 165.91 22.01 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 114.864 1.431 . . . . 0.0 114.864 -178.08 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.0 mpt_? -142.65 -48.03 0.33 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 113.226 -1.806 . . . . 0.0 108.526 177.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . 0.402 ' O ' ' HB2' ' A' ' 3' ' ' LEU . . . -130.74 4.53 5.78 Favored Glycine 0 CA--C 1.524 0.621 0 CA-C-N 115.054 -0.976 . . . . 0.0 110.752 177.468 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.799 ' O ' ' CB ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -166.36 157.41 12.94 Favored 'General case' 0 C--O 1.222 -0.372 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 -179.992 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.972 ' HA ' ' HB3' ' A' ' 27' ' ' LEU . 8.8 p -102.36 131.65 50.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 122.179 0.99 . . . . 0.0 113.22 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -113.38 166.0 11.91 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 113.407 -1.724 . . . . 0.0 109.411 178.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -103.3 135.5 44.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.306 0.574 . . . . 0.0 111.785 -178.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.486 ' ND2' ' CE2' ' A' ' 39' ' ' PHE . 28.9 t30 -116.02 117.82 31.19 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.679 -179.575 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -123.05 -31.26 3.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.743 179.707 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -61.01 -54.45 44.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.523 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.453 ' HB ' ' CE1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -83.65 -166.13 1.31 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.355 179.596 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 35.8 p -154.54 101.05 2.31 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.887 0.375 . . . . 0.0 111.441 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.554 ' HB3' ' HG2' ' A' ' 107' ' ' GLN . 1.6 m-85 -113.98 127.96 56.18 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.833 179.191 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -118.04 -35.01 3.97 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.265 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.562 ' HA3' ' HB3' ' A' ' 87' ' ' ASN . . . 171.54 -14.89 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.891 -0.671 . . . . 0.0 113.412 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.674 ' HG ' ' OE1' ' A' ' 107' ' ' GLN . 0.1 OUTLIER -44.75 174.0 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 117.332 0.566 . . . . 0.0 111.834 -179.799 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.474 ' C ' ' H ' ' A' ' 45' ' ' ALA . 20.8 m -109.72 46.61 1.0 Allowed 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -178.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.408 ' HA ' ' CB ' ' A' ' 48' ' ' ALA . 0.7 OUTLIER 59.94 -5.33 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 179.244 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.474 ' H ' ' C ' ' A' ' 43' ' ' THR . . . -63.76 -64.09 0.99 Allowed 'General case' 0 CA--C 1.522 -0.13 0 CA-C-O 120.969 0.414 . . . . 0.0 110.621 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.5 t -46.44 -41.64 14.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.962 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 151.55 37.16 0.03 OUTLIER Glycine 0 CA--C 1.519 0.314 0 C-N-CA 120.46 -0.876 . . . . 0.0 113.432 179.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.469 ' HB2' ' OE1' ' A' ' 52' ' ' GLU . . . -90.82 -171.27 2.97 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 117.151 0.476 . . . . 0.0 111.281 179.75 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.429 ' HG3' ' CZ ' ' A' ' 39' ' ' PHE . 12.4 mtp85 -115.94 -165.97 1.09 Allowed 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.523 -179.545 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.748 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 0.6 OUTLIER -95.27 -52.45 4.17 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.311 -0.404 . . . . 0.0 112.012 -179.259 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' SER . . . . . 0.518 ' O ' HG23 ' A' ' 54' ' ' VAL . 1.4 p -39.96 -40.33 1.0 Allowed 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.098 0.475 . . . . 0.0 111.312 -179.592 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.547 ' HB3' ' CD2' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -63.02 -66.21 0.57 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.491 179.66 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.748 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -46.33 -55.62 7.03 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.881 179.936 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.518 HG23 ' O ' ' A' ' 51' ' ' SER . 0.2 OUTLIER -54.07 -39.83 43.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.184 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.591 ' CZ ' ' CB ' ' A' ' 113' ' ' ALA . 1.3 t80 -52.78 -49.03 66.38 Favored 'General case' 0 C--O 1.231 0.132 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.735 178.42 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.422 ' CA ' ' HB2' ' A' ' 108' ' ' MET . . . -58.99 -42.81 90.93 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.305 179.119 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -58.69 -43.09 89.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.807 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 27.2 p -64.54 -60.36 3.23 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.162 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.455 ' CG2' ' CD1' ' A' ' 117' ' ' LEU . 8.9 p -60.72 -47.53 92.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.532 -179.523 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.459 ' CD2' ' HG ' ' A' ' 103' ' ' LEU . 6.0 tp -58.45 -43.0 88.66 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.67 0.271 . . . . 0.0 111.409 -179.569 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 9.9 t -75.3 -34.61 61.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.289 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . 0.444 ' HB3' ' CD2' ' A' ' 5' ' ' LEU . 0.1 OUTLIER -70.01 -25.22 63.48 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 120.727 0.298 . . . . 0.0 110.323 179.521 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.523 ' HB ' HG12 ' A' ' 66' ' ' VAL . 28.0 m -91.93 -55.55 6.06 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.233 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.179 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.478 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 29.88 36.66 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 O-C-N 123.38 0.425 . . . . 0.0 112.009 179.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.48 ' O ' ' CG2' ' A' ' 66' ' ' VAL . 4.5 m-20 160.25 -84.45 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.262 0.468 . . . . 0.0 112.262 -179.031 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.526 HG13 ' HA ' ' A' ' 120' ' ' ALA . 22.9 m 50.97 -160.56 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.59 -178.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.492 ' O ' ' O ' ' A' ' 98' ' ' SER . 7.3 p -147.34 -15.48 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 -178.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.476 ' HB3' ' CB ' ' A' ' 72' ' ' ASP . 0.4 OUTLIER 29.58 95.06 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.426 0.899 . . . . 0.0 113.426 178.81 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.402 ' CG2' ' CZ ' ' A' ' 122' ' ' ARG . 79.4 p -62.53 -161.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 178.619 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.08 -36.52 77.56 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.03 0.443 . . . . 0.0 110.393 179.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.46 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 13.7 tt0 -62.72 -65.34 0.7 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.242 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.577 ' O ' ' HB3' ' A' ' 75' ' ' LYS . 1.3 m-20 -53.26 -36.89 61.62 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.969 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.488 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 85.4 m -57.29 -65.25 0.66 Allowed 'General case' 0 C--O 1.238 0.455 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.644 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.86 -25.97 57.67 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 177.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.577 ' HB3' ' O ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -59.06 -51.43 70.1 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.723 178.715 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.41 ' CD2' HD12 ' A' ' 116' ' ' LEU . 1.2 mp -64.44 -49.68 70.5 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 178.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 73' ' ' THR . 2.8 mt -57.08 -32.92 66.75 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.426 179.639 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.16 -49.21 58.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.686 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' SER . . . . . 0.401 ' HB3' ' HG2' ' A' ' 111' ' ' GLN . 0.0 OUTLIER -61.17 -30.94 70.71 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.466 179.706 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.521 HG22 ' CZ ' ' A' ' 88' ' ' TYR . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.207 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . 0.562 ' HB3' ' HA3' ' A' ' 41' ' ' GLY . 9.4 p-10 . . . . . 0 C--O 1.238 0.469 0 CA-C-O 120.811 0.339 . . . . 0.0 111.428 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.555 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 4.4 p90 -104.52 145.99 29.51 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 119.981 -0.687 . . . . 0.0 110.817 179.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.73 ' HB3' ' O ' ' A' ' 101' ' ' VAL . 0.5 OUTLIER -109.45 141.56 41.69 Favored 'General case' 0 N--CA 1.436 -1.145 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.184 -179.056 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.403 HD21 ' HA ' ' A' ' 100' ' ' LEU . 66.4 mt -126.36 165.07 19.7 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.916 0.865 . . . . 0.0 113.289 -177.438 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.486 ' O ' ' OG ' ' A' ' 98' ' ' SER . 0.4 OUTLIER -153.53 130.15 10.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 113.997 -1.456 . . . . 0.0 107.223 178.447 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.415 ' HA ' ' CB ' ' A' ' 98' ' ' SER . 60.4 p -103.68 145.83 29.48 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 -176.681 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.423 ' O ' ' O ' ' A' ' 97' ' ' ASN . 3.7 m . . . . . 0 CA--C 1.541 0.599 0 CA-C-N 113.553 -1.658 . . . . 0.0 108.621 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.423 ' O ' ' O ' ' A' ' 93' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.518 -0.267 0 CA-C-O 120.892 0.377 . . . . 0.0 110.551 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.492 ' O ' ' O ' ' A' ' 67' ' ' VAL . 11.2 t -142.23 154.18 44.57 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.209 0.528 . . . . 0.0 111.138 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -103.74 159.91 4.79 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 178.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.777 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 0.1 OUTLIER -126.47 113.74 17.23 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -179.152 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.73 ' O ' ' HB3' ' A' ' 89' ' ' ASP . 0.2 OUTLIER -105.08 108.97 26.2 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 N-CA-C 103.213 -2.884 . . . . 0.0 103.213 174.481 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 0.768 ' O ' ' HB2' ' A' ' 103' ' ' LEU . 13.8 p -138.54 165.11 27.7 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -173.243 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.768 ' HB2' ' O ' ' A' ' 102' ' ' SER . 0.9 OUTLIER 126.74 82.55 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 112.508 -2.133 . . . . 0.0 112.658 176.61 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.406 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -104.65 19.14 20.94 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.619 -1.173 . . . . 0.0 108.284 177.441 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.52 ' CB ' ' O ' ' A' ' 41' ' ' GLY . 3.5 m 157.97 175.25 0.01 OUTLIER 'General case' 0 C--O 1.231 0.116 0 N-CA-C 107.14 -1.43 . . . . 0.0 107.14 -179.046 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.409 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.6 OUTLIER -106.69 101.95 11.36 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 119.596 -0.842 . . . . 0.0 112.097 -178.988 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.674 ' OE1' ' HG ' ' A' ' 42' ' ' LEU . 1.1 mt-30 -169.04 163.47 11.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.612 178.147 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.422 ' HB2' ' CA ' ' A' ' 56' ' ' ALA . 1.0 OUTLIER -165.71 133.71 3.01 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.395 0.617 . . . . 0.0 112.347 178.76 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.464 ' HB ' ' HA ' ' A' ' 24' ' ' THR . 0.8 OUTLIER -103.24 159.8 15.23 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.983 -1.008 . . . . 0.0 109.316 178.823 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.48 ' CD1' ' HB3' ' A' ' 20' ' ' SER . 17.1 mt -46.91 -62.88 1.2 Allowed 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 121.222 -0.191 . . . . 0.0 110.92 -179.639 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . 0.641 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 6.5 tp60 -44.38 -62.07 1.3 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.76 0.314 . . . . 0.0 110.499 179.456 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . 0.445 ' N ' ' OD1' ' A' ' 112' ' ' ASP . 0.8 OUTLIER -45.42 -47.76 13.67 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 121.373 0.606 . . . . 0.0 110.436 179.529 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . 0.591 ' CB ' ' CZ ' ' A' ' 55' ' ' PHE . . . -58.83 -65.74 0.61 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.923 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.641 ' HD2' ' HA ' ' A' ' 111' ' ' GLN . 0.0 OUTLIER -52.21 -25.72 9.88 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 121.06 -0.256 . . . . 0.0 110.898 179.825 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.56 ' CG2' ' CG ' ' A' ' 75' ' ' LYS . 88.2 t -64.39 -65.03 0.58 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.767 0 CA-C-O 122.082 0.944 . . . . 0.0 109.636 178.616 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.649 ' O ' ' HB2' ' A' ' 120' ' ' ALA . 1.7 mp -63.59 -34.06 76.98 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 114.572 -1.194 . . . . 0.0 109.678 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.529 ' CD2' HD13 ' A' ' 5' ' ' LEU . 0.2 OUTLIER -72.67 -23.08 60.84 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.97 179.691 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.436 ' HA ' ' CE1' ' A' ' 9' ' ' HIS . 5.7 tt0 -71.84 -44.17 64.29 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 106.521 -1.659 . . . . 0.0 106.521 177.467 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . 0.517 ' HB3' ' HB ' ' A' ' 66' ' ' VAL . . . -77.9 -19.11 55.32 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 114.151 -1.386 . . . . 0.0 110.11 177.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.649 ' HB2' ' O ' ' A' ' 116' ' ' LEU . . . -81.19 -48.07 12.59 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.928 179.557 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.48 ' CD2' ' CD2' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -68.8 -30.52 69.11 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.697 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.427 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 1.0 OUTLIER -74.08 -50.4 19.78 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.615 -0.72 . . . . 0.0 112.29 -179.404 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.08 -31.98 13.32 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -177.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -92.1 -65.61 0.99 Allowed 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -178.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' SER . . . . . 0.427 ' CB ' ' HA ' ' A' ' 121' ' ' LEU . 3.9 t . . . . . 0 C--N 1.326 -0.413 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.614 -178.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.528 0.117 0 CA-C-O 120.835 0.35 . . . . 0.0 110.846 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 10.5 mp -90.01 164.88 14.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.679 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 51.4 p -60.95 -162.77 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.271 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.486 ' CD2' ' HB3' ' A' ' 62' ' ' HIS . 0.0 OUTLIER -93.5 -61.25 1.59 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.619 0.247 . . . . 0.0 111.391 179.811 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.9 p -47.33 -51.06 20.49 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -179.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.99 -55.72 15.31 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 121.164 0.507 . . . . 0.0 110.274 -179.346 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.6 tp -52.65 -60.06 3.71 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.425 179.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.439 ' HB3' ' O ' ' A' ' 5' ' ' LEU . 1.7 t-80 -45.63 -56.43 5.2 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.111 178.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.5 -43.42 71.78 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.172 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.42 ' HG2' ' CG1' ' A' ' 31' ' ' VAL . 19.9 tp60 -58.86 -65.35 0.68 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.668 179.361 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 9.2 p -56.56 -45.8 82.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.965 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.665 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 8.8 t -60.49 -55.09 37.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.454 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.3 ttp180 -63.99 -22.73 67.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.091 -179.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.6 mt -73.16 -63.01 1.27 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.72 -179.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.627 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 0.8 OUTLIER -70.3 -27.0 30.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.3 -179.538 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.413 ' HB2' ' O ' ' A' ' 13' ' ' SER . 8.1 mm-40 -78.14 -16.6 57.79 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.167 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -144.78 42.25 1.33 Allowed 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.84 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 173.56 -69.01 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 179.561 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.627 ' HB2' ' HA ' ' A' ' 16' ' ' VAL . 14.9 m -70.8 -31.75 68.6 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -178.088 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . 0.438 ' O ' HG13 ' A' ' 16' ' ' VAL . . . 78.04 -57.8 3.96 Favored Glycine 0 CA--C 1.521 0.462 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.933 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.493 ' HA ' HG23 ' A' ' 16' ' ' VAL . 0.4 OUTLIER -177.3 30.42 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 120.831 0.348 . . . . 0.0 111.05 -179.879 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -74.81 -157.96 0.07 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.938 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.509 ' HB ' ' HB3' ' A' ' 34' ' ' ASN . 4.2 m -103.53 145.17 30.43 Favored 'General case' 0 C--O 1.231 0.108 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.42 ' HA2' ' O ' ' A' ' 32' ' ' ALA . . . -104.62 134.01 11.8 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.332 -0.937 . . . . 0.0 113.706 -178.46 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.516 ' HB2' ' CB ' ' A' ' 51' ' ' SER . 0.0 OUTLIER -104.96 128.87 53.42 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.932 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.451 ' HB2' ' CD2' ' A' ' 55' ' ' PHE . 0.9 OUTLIER -104.82 146.55 28.83 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.378 0.608 . . . . 0.0 112.139 -178.863 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 169.22 55.47 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 114.924 -1.035 . . . . 0.0 108.965 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 87.52 -5.48 84.95 Favored Glycine 0 CA--C 1.52 0.348 0 N-CA-C 111.231 -0.747 . . . . 0.0 111.231 -177.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.4 ' ND2' ' C ' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -165.46 165.07 19.42 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 179.838 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.42 ' CG1' ' HG2' ' A' ' 11' ' ' GLN . 0.7 OUTLIER -112.76 120.96 64.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 121.432 0.634 . . . . 0.0 111.213 179.411 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.465 ' CB ' ' CG ' ' A' ' 26' ' ' LYS . . . -110.51 166.34 11.07 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.273 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.421 ' CB ' ' OG ' ' A' ' 20' ' ' SER . . . -103.58 137.43 41.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.221 0.534 . . . . 0.0 111.952 -178.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.509 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 5.8 t30 -119.04 121.33 39.61 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.302 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 14.3 ttpp -121.78 -28.72 4.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.146 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -51.17 -77.19 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.961 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 7.9 t -77.45 -176.51 4.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.465 179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 78.2 p -136.42 107.69 6.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.85 0.357 . . . . 0.0 111.235 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.494 ' C ' ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -61.18 -178.77 0.12 Allowed 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.19 179.62 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.472 ' N ' ' CG ' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -171.64 22.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.772 0.32 . . . . 0.0 111.568 179.6 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.52 ' O ' ' CB ' ' A' ' 105' ' ' SER . . . 79.16 -17.0 8.03 Favored Glycine 0 C--O 1.228 -0.255 0 CA-C-O 119.754 -0.47 . . . . 0.0 113.176 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.579 ' HG ' ' OE1' ' A' ' 107' ' ' GLN . 0.1 OUTLIER -48.08 178.15 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 117.235 0.517 . . . . 0.0 111.361 -179.935 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 29.3 m -118.21 57.49 0.84 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.753 0.311 . . . . 0.0 111.67 -179.043 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.489 ' O ' ' C ' ' A' ' 45' ' ' ALA . 3.3 mp 69.93 -58.76 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.714 179.592 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.489 ' C ' ' O ' ' A' ' 44' ' ' ILE . . . -18.54 -77.27 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 58.8 m -43.86 -59.36 2.29 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.429 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 168.8 51.6 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.427 -0.892 . . . . 0.0 113.061 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.415 ' CB ' ' OE1' ' A' ' 107' ' ' GLN . . . -110.99 172.7 6.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.893 0.377 . . . . 0.0 111.053 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.458 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 2.2 tpm_? -91.49 158.5 16.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.713 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.502 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 0.8 OUTLIER -71.92 -22.96 61.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.046 0.451 . . . . 0.0 110.494 179.507 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' SER . . . . . 0.516 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 59.9 p -63.3 -62.81 1.44 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.256 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.55 ' HB2' ' HG2' ' A' ' 107' ' ' GLN . 1.5 pm0 -44.86 -60.69 1.92 Allowed 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.592 0.234 . . . . 0.0 111.414 -179.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.515 ' HD2' HG22 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -52.35 -50.71 61.79 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.702 -0.226 . . . . 0.0 110.997 179.931 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.515 HG22 ' HD2' ' A' ' 53' ' ' LYS . 73.5 t -57.55 -39.43 69.32 Favored 'Isoleucine or valine' 0 C--O 1.231 0.105 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.645 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.451 ' CD2' ' HB2' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -61.48 -45.15 95.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.581 178.756 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.11 -45.82 75.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.577 179.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -64.3 -41.96 96.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.045 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 9.9 p -61.56 -57.78 10.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.882 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.421 ' O ' ' CG2' ' A' ' 63' ' ' VAL . 8.7 p -65.24 -49.72 77.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.08 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.2 tp -50.79 -40.2 54.63 Favored 'General case' 0 C--O 1.231 0.125 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.394 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 70.2 m -67.83 -53.49 26.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.331 179.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . 0.486 ' HB3' ' CD2' ' A' ' 5' ' ' LEU . 0.3 OUTLIER -60.83 -20.63 62.04 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 121.079 0.466 . . . . 0.0 110.299 179.598 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.635 ' CG2' ' HB3' ' A' ' 116' ' ' LEU . 3.4 t -109.61 55.07 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.491 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.493 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . -81.04 39.6 0.51 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.44 -179.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.493 ' CB ' ' O ' ' A' ' 64' ' ' ALA . 3.9 m-20 153.63 -65.38 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 122.652 0.381 . . . . 0.0 111.123 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.563 HG13 HG12 ' A' ' 63' ' ' VAL . 35.5 m 42.36 -171.09 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -179.699 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.559 ' HB ' ' HB3' ' A' ' 97' ' ' ASN . 16.8 m -145.2 67.64 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 CA-C-O 121.133 0.492 . . . . 0.0 110.877 -178.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.713 ' N ' ' O ' ' A' ' 98' ' ' SER . 0.7 OUTLIER -60.24 107.73 0.69 Allowed 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.995 -179.391 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.637 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 7.2 p -80.17 177.62 8.82 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.244 179.197 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -35.42 -37.05 0.08 Allowed 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.952 0.406 . . . . 0.0 111.401 -179.645 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 4.8 tp10 -68.38 -65.11 0.74 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.023 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.531 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 65.0 m-20 -58.75 -32.26 69.1 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.414 -179.622 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -64.46 -57.82 8.17 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.626 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.525 ' HA ' ' CG ' ' A' ' 77' ' ' LEU . . . -56.24 -27.88 56.54 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 177.019 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.577 ' CG ' ' CG2' ' A' ' 115' ' ' VAL . 0.4 OUTLIER -61.78 -49.08 77.81 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 114.334 -1.303 . . . . 0.0 110.976 179.184 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.422 HD13 ' CD2' ' A' ' 68' ' ' LEU . 0.3 OUTLIER -68.27 -52.63 31.63 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.775 0.322 . . . . 0.0 110.729 179.572 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.525 ' CG ' ' HA ' ' A' ' 74' ' ' ALA . 3.8 pp -60.61 -26.86 67.31 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.095 -179.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.438 ' HB2' ' O ' ' A' ' 74' ' ' ALA . 34.0 tt0 -75.87 -47.96 23.33 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.16 0.505 . . . . 0.0 110.4 179.311 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 3.1 t -61.1 -33.24 73.04 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.94 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 14.2 t . . . . . 0 C--N 1.331 -0.205 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.614 -179.641 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 . . . . . 0 C--O 1.234 0.289 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.574 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 25.8 m-85 -100.64 139.94 35.61 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 120.399 -0.52 . . . . 0.0 110.924 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.672 ' O ' ' O ' ' A' ' 101' ' ' VAL . 1.0 OUTLIER -117.3 149.77 39.9 Favored 'General case' 0 N--CA 1.428 -1.529 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 -179.267 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.503 ' N ' ' CD1' ' A' ' 90' ' ' LEU . 0.0 OUTLIER -149.36 161.72 41.5 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 121.693 0.758 . . . . 0.0 112.696 -178.883 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.407 ' O ' ' HB3' ' A' ' 98' ' ' SER . 2.6 ptm180 -140.95 135.29 31.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.501 -1.227 . . . . 0.0 108.062 178.301 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.503 ' HA ' ' CB ' ' A' ' 98' ' ' SER . 26.4 p -104.9 146.49 28.94 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.85 1.055 . . . . 0.0 113.85 -177.604 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.418 ' O ' ' O ' ' A' ' 97' ' ' ASN . 6.7 m . . . . . 0 N--CA 1.446 -0.643 0 CA-C-N 113.889 -1.505 . . . . 0.0 108.536 178.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.637 ' HA ' ' HA ' ' A' ' 69' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.434 -1.226 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.713 ' O ' ' N ' ' A' ' 68' ' ' LEU . 3.0 m -148.42 157.16 43.3 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.914 -178.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . 0.427 ' HA ' ' O ' ' A' ' 65' ' ' ASN . 2.5 t -104.08 150.17 7.41 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.043 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.547 HD22 HG11 ' A' ' 63' ' ' VAL . 0.1 OUTLIER -103.91 127.77 51.43 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 122.059 0.933 . . . . 0.0 113.198 -178.505 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.672 ' O ' ' O ' ' A' ' 89' ' ' ASP . 1.5 p -131.7 104.12 8.04 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 N-CA-C 104.295 -2.483 . . . . 0.0 104.295 174.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 0.574 ' HB2' ' HA ' ' A' ' 88' ' ' TYR . 32.8 p -148.22 165.28 31.42 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 118.785 -1.166 . . . . 0.0 113.653 -174.621 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.497 HD23 ' O ' ' A' ' 102' ' ' SER . 0.2 OUTLIER 157.2 -83.34 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 113.661 -1.609 . . . . 0.0 111.73 176.509 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.501 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 52.4 28.12 5.53 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -179.162 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.52 ' CB ' ' O ' ' A' ' 41' ' ' GLY . 13.3 m 140.04 165.96 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 -178.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.403 ' HB3' ' HB2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -104.85 101.92 11.49 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 119.677 -0.809 . . . . 0.0 112.853 -178.093 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.579 ' OE1' ' HG ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -168.61 164.73 12.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.41 177.694 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.513 ' CE ' ' CE1' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -165.58 141.91 5.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.118 0.485 . . . . 0.0 111.885 179.293 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.473 HG21 ' CD1' ' A' ' 39' ' ' PHE . 0.8 OUTLIER -104.32 165.22 11.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.258 179.47 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.415 ' HB3' ' NZ ' ' A' ' 114' ' ' LYS . 3.4 mt -49.19 -58.04 5.69 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.692 0.282 . . . . 0.0 110.502 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . 0.544 ' O ' ' HG2' ' A' ' 114' ' ' LYS . 2.6 tp60 -50.42 -64.77 0.71 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.849 0.357 . . . . 0.0 110.839 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . 0.524 ' HA ' HG23 ' A' ' 115' ' ' VAL . 0.8 OUTLIER -44.34 -46.67 9.41 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.17 0.51 . . . . 0.0 110.95 179.847 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . 0.419 ' O ' ' HB2' ' A' ' 117' ' ' LEU . . . -55.6 -62.45 1.68 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.424 179.416 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.665 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 3.8 ptpp? -57.83 -27.01 62.8 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.037 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.577 ' CG2' ' CG ' ' A' ' 75' ' ' LYS . 99.4 t -61.05 -62.66 1.01 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.728 0 CA-C-O 122.149 0.976 . . . . 0.0 110.25 179.569 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.635 ' HB3' ' CG2' ' A' ' 63' ' ' VAL . 0.1 OUTLIER -68.64 -32.7 72.75 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.156 -179.199 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.446 ' HG ' HD13 ' A' ' 5' ' ' LEU . 0.1 OUTLIER -73.37 -22.9 60.17 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 120.901 0.382 . . . . 0.0 110.49 179.359 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.553 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 2.2 tp10 -72.49 -43.44 63.66 Favored 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 106.243 -1.762 . . . . 0.0 106.243 177.09 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . 0.458 ' O ' ' CB ' ' A' ' 123' ' ' GLN . . . -75.46 -22.55 57.19 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 114.309 -1.314 . . . . 0.0 109.881 177.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.456 ' N ' ' O ' ' A' ' 116' ' ' LEU . . . -79.45 -49.93 11.57 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.503 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.445 ' HB3' ' O ' ' A' ' 117' ' ' LEU . 0.0 OUTLIER -63.91 -38.32 90.64 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.86 179.806 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.553 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -79.72 -33.93 40.47 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -179.285 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.458 ' CB ' ' O ' ' A' ' 119' ' ' ALA . 12.1 tm0? -95.12 -19.43 20.12 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -177.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -93.6 -68.76 0.78 Allowed 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 119.743 -0.783 . . . . 0.0 111.976 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 2.0 t . . . . . 0 C--N 1.326 -0.445 0 CA-C-O 121.649 0.737 . . . . 0.0 111.31 179.271 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . 0.402 ' ND2' ' CG2' ' A' ' 58' ' ' THR . 6.0 p-10 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.775 0.322 . . . . 0.0 110.868 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.422 ' CD2' ' OE1' ' A' ' 11' ' ' GLN . 4.7 mp -78.18 -175.29 4.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.623 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.405 ' O ' ' N ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -103.04 153.13 20.57 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.01 179.201 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.444 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 75.4 mt -47.02 -61.83 1.69 Allowed 'General case' 0 CA--C 1.509 -0.607 0 CA-C-O 121.499 0.666 . . . . 0.0 110.993 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 5.2 t -42.77 -61.6 1.22 Allowed 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.278 -179.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -69.57 -56.74 6.48 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.971 0.415 . . . . 0.0 110.867 -179.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.478 ' O ' ' HG2' ' A' ' 11' ' ' GLN . 23.5 tp -45.54 -45.84 13.66 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.751 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.548 ' HA ' HG13 ' A' ' 12' ' ' VAL . 56.4 t-80 -66.06 -40.27 90.77 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.424 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.4 -53.74 41.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.776 -1.102 . . . . 0.0 111.198 179.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.478 ' HG2' ' O ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -69.16 -55.39 10.79 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 120.791 0.329 . . . . 0.0 111.235 -179.795 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.548 HG13 ' HA ' ' A' ' 9' ' ' HIS . 3.8 p -51.9 -49.63 36.59 Favored 'Isoleucine or valine' 0 C--O 1.242 0.694 0 CA-C-O 121.22 0.533 . . . . 0.0 110.659 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.76 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 52.9 m -62.73 -41.89 99.4 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.557 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.45 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -67.25 -17.7 64.91 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.385 179.629 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.49 HD12 HG12 ' A' ' 31' ' ' VAL . 6.1 mt -83.14 -61.43 1.86 Allowed 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -179.795 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.549 ' CG2' ' HB3' ' A' ' 110' ' ' LEU . 0.9 OUTLIER -69.38 -34.27 61.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 C-N-CA 120.015 -0.674 . . . . 0.0 111.34 -179.068 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.457 ' HB2' ' O ' ' A' ' 13' ' ' SER . 3.5 mm-40 -69.62 -16.16 63.33 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.176 -179.507 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.45 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 2.8 pt20 -163.57 56.86 0.17 Allowed 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 120.854 -0.338 . . . . 0.0 111.44 179.301 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 176.52 -63.1 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.454 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.445 ' OG ' ' CB ' ' A' ' 33' ' ' ALA . 0.5 OUTLIER -79.08 -80.47 0.12 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.374 -179.324 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . 0.554 ' O ' ' HB3' ' A' ' 22' ' ' ASP . . . 113.28 -18.7 20.69 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.481 -179.599 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.63 ' O ' ' O ' ' A' ' 23' ' ' CYS . 21.9 p-10 166.46 -14.98 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.355 0.262 . . . . 0.0 111.388 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.63 ' O ' ' O ' ' A' ' 22' ' ' ASP . 58.0 m -42.13 -164.75 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.368 0.667 . . . . 0.0 112.718 -179.386 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.518 ' HA ' ' HA ' ' A' ' 109' ' ' THR . 20.4 m -103.75 162.15 13.33 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.781 -179.387 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.571 ' HA2' ' CD2' ' A' ' 110' ' ' LEU . . . -105.12 135.7 12.71 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.495 -0.86 . . . . 0.0 113.912 -178.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.563 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 1.3 tmmm? -104.92 119.52 39.21 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 178.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.587 ' O ' ' HB2' ' A' ' 28' ' ' ARG . 1.6 tt -104.63 165.25 11.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.665 -178.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.587 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER 140.1 56.2 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.618 1.167 . . . . 0.0 109.492 -179.862 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . 0.402 ' O ' HD21 ' A' ' 3' ' ' LEU . . . 88.53 -4.94 85.15 Favored Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.877 -0.678 . . . . 0.0 111.764 -178.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.423 ' ND2' ' C ' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -165.7 165.46 18.6 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 -179.95 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.563 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 3.7 p -112.58 136.65 48.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.251 0.548 . . . . 0.0 110.911 178.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.468 ' CB ' ' HB3' ' A' ' 26' ' ' LYS . . . -129.3 167.43 17.72 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.629 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.445 ' CB ' ' OG ' ' A' ' 20' ' ' SER . . . -102.77 121.3 42.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.235 0.541 . . . . 0.0 111.588 -178.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.496 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 2.4 t30 -105.05 115.7 30.72 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.542 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.02 -25.78 15.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.391 -179.848 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.469 ' O ' ' HB ' ' A' ' 37' ' ' THR . 14.0 mm-40 -42.93 -82.21 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.717 -179.314 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.469 ' HB ' ' O ' ' A' ' 36' ' ' GLU . 7.5 t 172.0 -168.79 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.879 0.371 . . . . 0.0 110.945 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.573 ' O ' ' HB3' ' A' ' 39' ' ' PHE . 2.8 p 62.77 121.04 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.96 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.688 ' O ' ' HB3' ' A' ' 107' ' ' GLN . 11.3 p90 169.15 -31.67 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.688 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.472 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -54.78 67.99 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.602 -0.727 . . . . 0.0 112.478 -178.704 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.605 ' N ' ' O ' ' A' ' 39' ' ' PHE . . . 36.01 87.15 0.01 OUTLIER Glycine 0 C--N 1.332 0.31 0 CA-C-N 116.018 -0.537 . . . . 0.0 113.621 179.032 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.511 ' H ' ' HB2' ' A' ' 107' ' ' GLN . 0.1 OUTLIER -141.8 169.99 16.55 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 179.168 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.456 ' C ' ' H ' ' A' ' 45' ' ' ALA . 0.7 OUTLIER -103.28 41.31 1.28 Allowed 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 -177.698 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.409 ' CD1' ' N ' ' A' ' 44' ' ' ILE . 3.4 mp 53.54 5.14 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 179.012 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.456 ' H ' ' C ' ' A' ' 43' ' ' THR . . . -74.41 -41.29 61.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.928 0.394 . . . . 0.0 110.846 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' SER . . . . . 0.431 ' HB2' HD13 ' A' ' 42' ' ' LEU . 0.5 OUTLIER -72.31 -32.18 66.34 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.477 179.664 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 142.62 34.33 0.1 OUTLIER Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.618 -0.801 . . . . 0.0 113.381 179.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.409 ' HA ' ' HB ' ' A' ' 38' ' ' THR . . . -85.89 149.78 24.98 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 117.118 0.459 . . . . 0.0 111.049 179.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 7.4 mtm180 -81.45 159.89 24.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.738 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.452 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -67.32 -21.38 65.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.952 179.873 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' SER . . . . . 0.462 ' OG ' ' N ' ' A' ' 52' ' ' GLU . 1.0 OUTLIER -61.0 -65.1 0.75 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.379 -179.585 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.462 ' N ' ' OG ' ' A' ' 51' ' ' SER . 0.0 OUTLIER -49.08 -65.84 0.5 Allowed 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.977 0.417 . . . . 0.0 110.809 -179.824 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.639 ' HA ' ' HA ' ' A' ' 107' ' ' GLN . 0.0 OUTLIER -43.82 -51.25 7.51 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.094 179.872 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.512 ' H ' ' HG3' ' A' ' 53' ' ' LYS . 53.4 t -61.13 -31.14 49.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.083 0.468 . . . . 0.0 110.244 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.7 ' HB3' ' HB3' ' A' ' 108' ' ' MET . 0.3 OUTLIER -66.61 -48.0 70.9 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.615 179.649 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.45 -45.87 92.11 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.966 0.412 . . . . 0.0 110.201 179.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 21.1 mm-40 -55.26 -55.55 30.09 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.604 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.402 ' CG2' ' ND2' ' A' ' 2' ' ' ASN . 0.7 OUTLIER -67.38 -30.54 70.35 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.005 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.421 ' CG1' ' OH ' ' A' ' 88' ' ' TYR . 0.9 OUTLIER -60.56 -57.09 13.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.258 -179.556 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.725 ' HA ' ' CG2' ' A' ' 63' ' ' VAL . 42.3 mt -75.49 -34.71 60.89 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 121.339 0.59 . . . . 0.0 111.335 -179.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 45.5 m -57.83 -42.12 83.71 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.18 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -75.62 -50.27 16.02 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-O 120.751 0.31 . . . . 0.0 110.611 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.725 ' CG2' ' HA ' ' A' ' 60' ' ' LEU . 11.6 m -60.06 -50.37 80.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.943 0.401 . . . . 0.0 110.55 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.452 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 34.92 34.71 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.56 -0.745 . . . . 0.0 112.148 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.476 ' O ' ' CG2' ' A' ' 66' ' ' VAL . 0.5 OUTLIER 163.47 -81.12 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -179.679 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.547 ' CG1' ' HB ' ' A' ' 63' ' ' VAL . 11.3 m 54.63 -160.15 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 122.725 0.41 . . . . 0.0 110.911 -177.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.526 ' O ' ' O ' ' A' ' 98' ' ' SER . 9.9 p -151.72 -28.02 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.663 ' HB3' ' HB2' ' A' ' 72' ' ' ASP . 0.3 OUTLIER 32.27 95.24 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.976 -0.556 . . . . 0.0 112.407 179.193 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.632 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 14.5 p -66.11 -117.67 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.69 179.701 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.455 ' N ' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER -95.06 -38.94 10.4 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.062 0.458 . . . . 0.0 110.963 179.974 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -64.0 -61.12 2.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.089 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.663 ' HB2' ' HB3' ' A' ' 68' ' ' LEU . 0.8 OUTLIER -59.27 -30.26 68.16 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.21 -179.646 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.432 ' OG1' ' HA ' ' A' ' 70' ' ' GLN . 0.9 OUTLIER -63.39 -59.05 5.2 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 178.323 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -57.52 -24.75 57.78 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.619 ' HB2' ' HA ' ' A' ' 72' ' ' ASP . 0.1 OUTLIER -62.25 -56.88 14.2 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 114.742 -1.117 . . . . 0.0 110.066 178.773 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.412 ' CD2' HD11 ' A' ' 116' ' ' LEU . 0.4 OUTLIER -59.23 -38.58 80.32 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.33 0.586 . . . . 0.0 109.438 178.613 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.9 -48.7 79.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.078 -0.965 . . . . 0.0 111.35 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.8 mm-40 -72.42 -42.42 65.11 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.311 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 4.7 p -68.91 -27.63 65.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.272 -179.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 81.2 m . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.573 -179.626 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 14.2 p30 . . . . . 0 C--O 1.238 0.5 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.558 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 2.4 m-85 -99.62 148.95 23.78 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 120.329 -0.548 . . . . 0.0 111.485 -179.331 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.686 ' O ' ' O ' ' A' ' 101' ' ' VAL . 0.0 OUTLIER -119.68 148.64 43.14 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.509 -179.116 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.441 ' N ' ' CD1' ' A' ' 90' ' ' LEU . 0.0 OUTLIER -148.9 150.61 33.25 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.307 0.575 . . . . 0.0 112.18 -179.335 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 18.0 tpt180 -121.94 141.65 51.1 Favored 'General case' 0 C--O 1.221 -0.435 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.476 ' O ' ' CG1' ' A' ' 93' ' ' VAL . 55.4 p -104.71 145.85 29.78 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.879 1.066 . . . . 0.0 113.879 -177.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.476 ' CG1' ' O ' ' A' ' 92' ' ' SER . 3.6 m . . . . . 0 CA--C 1.539 0.553 0 CA-C-N 113.297 -1.774 . . . . 0.0 107.908 179.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.632 ' HA ' ' HA ' ' A' ' 69' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.452 -0.346 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.526 ' O ' ' O ' ' A' ' 67' ' ' VAL . 1.5 t -137.39 165.4 26.32 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.431 0.634 . . . . 0.0 111.165 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -103.68 147.63 9.67 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 179.225 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.583 HD13 ' HB3' ' A' ' 102' ' ' SER . 7.6 tp -103.77 105.76 16.06 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 121.909 0.862 . . . . 0.0 113.302 -177.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.686 ' O ' ' O ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -123.14 120.57 60.77 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 N-CA-C 103.743 -2.688 . . . . 0.0 103.743 175.467 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 0.596 ' HB2' ' H ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -157.96 166.17 33.27 Favored 'General case' 0 C--N 1.305 -1.341 0 C-N-CA 117.529 -1.669 . . . . 0.0 114.395 -173.895 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.602 HD21 ' CD1' ' A' ' 60' ' ' LEU . 0.1 OUTLIER 161.9 -90.16 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.105 0 CA-C-N 113.502 -1.681 . . . . 0.0 111.835 175.59 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.555 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 53.75 27.61 7.2 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 -179.416 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.555 ' CB ' ' O ' ' A' ' 104' ' ' ARG . 17.6 m 133.99 160.5 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.552 1.141 . . . . 0.0 108.1 -178.543 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.571 ' O ' ' HG3' ' A' ' 107' ' ' GLN . 1.0 OUTLIER -104.82 101.0 10.62 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 120.038 -0.665 . . . . 0.0 112.243 -178.703 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.688 ' HB3' ' O ' ' A' ' 39' ' ' PHE . 5.5 mt-30 -169.85 159.82 8.16 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.415 177.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.7 ' HB3' ' HB3' ' A' ' 55' ' ' PHE . 2.4 tpt -158.56 153.73 25.47 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.629 0.604 . . . . 0.0 112.629 179.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.518 ' HA ' ' HA ' ' A' ' 24' ' ' THR . 0.1 OUTLIER -115.47 165.29 13.15 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.857 178.662 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.571 ' CD2' ' HA2' ' A' ' 25' ' ' GLY . 0.2 OUTLIER -50.94 -55.78 15.58 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.696 0.284 . . . . 0.0 111.288 -179.933 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . 0.685 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 0.9 OUTLIER -49.17 -65.96 0.48 Allowed 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.355 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . 0.464 ' O ' ' HB ' ' A' ' 115' ' ' VAL . 0.0 OUTLIER -49.57 -56.94 8.14 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.025 0.44 . . . . 0.0 110.83 -179.224 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . 0.458 ' CB ' ' CZ ' ' A' ' 55' ' ' PHE . . . -40.44 -54.57 2.44 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.843 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.76 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -67.31 -33.34 75.07 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.099 179.708 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.53 ' CG2' ' CG ' ' A' ' 75' ' ' LYS . 54.9 t -54.36 -61.69 0.91 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.746 0 CA-C-O 121.756 0.788 . . . . 0.0 110.72 179.697 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.508 ' O ' ' HB3' ' A' ' 120' ' ' ALA . 0.1 OUTLIER -62.26 -43.2 99.37 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.177 -179.534 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.466 ' HA ' ' HB3' ' A' ' 120' ' ' ALA . 0.7 OUTLIER -66.99 -19.08 65.66 Favored 'General case' 0 CA--C 1.51 -0.565 0 C-N-CA 120.764 -0.375 . . . . 0.0 111.156 179.624 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.728 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 10.1 tt0 -70.7 -54.18 12.81 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 106.095 -1.817 . . . . 0.0 106.095 176.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . 0.484 ' O ' ' HB2' ' A' ' 123' ' ' GLN . . . -69.83 -18.86 63.47 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.478 -1.237 . . . . 0.0 110.675 177.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.508 ' HB3' ' O ' ' A' ' 116' ' ' LEU . . . -79.88 -62.72 1.6 Allowed 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 121.151 0.5 . . . . 0.0 110.432 179.543 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.556 HD22 ' HA ' ' A' ' 118' ' ' GLU . 0.1 OUTLIER -60.01 -24.78 64.76 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.525 -179.619 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.728 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -87.01 -41.69 13.68 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -179.903 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.484 ' HB2' ' O ' ' A' ' 119' ' ' ALA . 1.1 tm0? -84.8 -29.76 25.14 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -178.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -95.24 -65.97 0.94 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.543 0.571 . . . . 0.0 112.543 -178.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.325 -0.468 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.423 -178.17 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 30.4 t30 . . . . . 0 CA--C 1.528 0.118 0 CA-C-O 120.874 0.369 . . . . 0.0 110.679 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.401 HD12 ' CD1' ' A' ' 8' ' ' LEU . 0.3 OUTLIER -66.57 172.28 4.3 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.374 -179.487 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 53.5 p -74.0 -151.34 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.877 179.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.679 ' O ' ' CD2' ' A' ' 9' ' ' HIS . 1.1 mt -95.27 -66.56 0.9 Allowed 'General case' 0 CA--C 1.504 -0.826 0 CA-C-O 121.531 0.681 . . . . 0.0 111.757 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.44 ' O ' ' HG2' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -35.73 -46.78 0.46 Allowed 'General case' 0 N--CA 1.435 -1.223 0 CA-C-N 115.205 -0.907 . . . . 0.0 112.914 -178.422 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -78.97 -42.49 26.68 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -179.584 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.554 ' HB3' ' HD2' ' A' ' 9' ' ' HIS . 11.2 tp -64.23 -35.47 80.93 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.545 0.688 . . . . 0.0 110.868 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.679 ' CD2' ' O ' ' A' ' 5' ' ' LEU . 3.4 m170 -79.62 -43.1 23.52 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.727 -1.124 . . . . 0.0 110.873 -178.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.479 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 5.2 mmt85 -60.2 -37.57 80.66 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 178.375 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.495 ' HG2' HG12 ' A' ' 31' ' ' VAL . 5.9 tt0 -65.59 -65.91 0.61 Allowed 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.455 178.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.51 ' HB ' HG11 ' A' ' 31' ' ' VAL . 7.4 p -55.08 -48.11 76.39 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.517 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.43 ' O ' ' CG ' ' A' ' 17' ' ' GLN . 83.9 p -54.81 -60.05 3.9 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.383 -179.454 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.479 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -53.97 -48.19 70.58 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -178.698 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.485 ' CD1' ' CD2' ' A' ' 110' ' ' LEU . 0.2 OUTLIER -60.28 -57.75 11.43 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 119.61 -0.836 . . . . 0.0 111.084 -179.267 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.827 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 9.9 p -69.28 -11.67 15.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -178.627 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.694 ' HG2' ' HE3' ' A' ' 114' ' ' LYS . 3.8 mm-40 -95.6 -4.36 44.68 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -148.83 -47.17 0.15 Allowed 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -87.81 -61.33 1.74 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -178.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.827 ' HB2' ' HA ' ' A' ' 16' ' ' VAL . 4.6 m -73.76 -47.24 40.5 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.037 -0.529 . . . . 0.0 112.318 -178.479 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 85.07 -39.85 2.99 Favored Glycine 0 CA--C 1.519 0.308 0 C-N-CA 120.519 -0.848 . . . . 0.0 111.782 -178.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.569 ' O ' ' O ' ' A' ' 23' ' ' CYS . 7.5 t70 -170.59 -66.44 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.569 ' O ' ' O ' ' A' ' 22' ' ' ASP . 0.1 OUTLIER 28.46 -159.22 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.624 0.769 . . . . 0.0 112.506 178.945 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.582 ' HA ' HG22 ' A' ' 109' ' ' THR . 0.1 OUTLIER -104.03 156.08 18.15 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.063 -0.718 . . . . 0.0 109.063 179.005 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.47 ' H ' ' HA ' ' A' ' 109' ' ' THR . . . -104.68 119.69 6.33 Favored Glycine 0 N--CA 1.443 -0.85 0 C-N-CA 120.172 -1.013 . . . . 0.0 113.184 -178.551 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.638 ' HB2' ' CB ' ' A' ' 51' ' ' SER . 0.0 OUTLIER -104.58 115.5 30.46 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 178.67 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.487 ' HB2' ' CG ' ' A' ' 55' ' ' PHE . 2.8 tt -110.09 151.8 26.77 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.574 0.702 . . . . 0.0 112.605 -177.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.467 ' HG2' ' C ' ' A' ' 27' ' ' LEU . 4.9 ptp180 160.78 52.49 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 114.63 -1.168 . . . . 0.0 108.888 179.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 100.76 -6.81 57.27 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.137 -178.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -166.36 165.55 17.14 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.51 HG11 ' HB ' ' A' ' 12' ' ' VAL . 0.2 OUTLIER -116.77 122.53 70.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.227 0.537 . . . . 0.0 110.432 178.709 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.457 ' CB ' ' CG ' ' A' ' 26' ' ' LYS . . . -120.22 167.1 12.6 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.008 -179.387 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.471 ' HB3' HD11 ' A' ' 110' ' ' LEU . . . -102.2 127.72 49.02 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.274 0.559 . . . . 0.0 111.542 -179.024 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.435 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 6.3 t30 -111.89 132.53 54.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.643 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.1 -22.04 3.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.228 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -57.72 -23.52 52.29 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.427 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 4.6 t -154.97 155.04 33.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.062 0.458 . . . . 0.0 110.626 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 23.2 p -81.84 -122.63 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.609 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.526 ' CG ' ' N ' ' A' ' 40' ' ' GLN . 0.2 OUTLIER -176.32 -85.48 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 121.351 -0.14 . . . . 0.0 111.131 179.962 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.537 ' O ' ' C ' ' A' ' 41' ' ' GLY . 0.0 OUTLIER 56.06 88.68 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 122.45 0.3 . . . . 0.0 111.141 179.667 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.537 ' C ' ' O ' ' A' ' 40' ' ' GLN . . . 14.4 98.41 0.0 OUTLIER Glycine 0 C--N 1.346 1.108 0 O-C-N 123.498 0.499 . . . . 0.0 112.738 -179.193 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.546 ' N ' ' NE2' ' A' ' 107' ' ' GLN . 6.2 tp -151.08 159.9 44.22 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.481 -0.192 . . . . 0.0 110.481 -178.157 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.472 ' C ' ' H ' ' A' ' 45' ' ' ALA . 0.0 OUTLIER -107.37 33.1 4.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.942 0.401 . . . . 0.0 111.282 -179.457 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.516 ' CD1' ' N ' ' A' ' 44' ' ' ILE . 0.9 OUTLIER 59.13 -0.54 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.13 179.777 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.472 ' H ' ' C ' ' A' ' 43' ' ' THR . . . -77.97 -40.94 37.74 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.914 0.388 . . . . 0.0 110.719 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' SER . . . . . 0.413 ' HB2' ' CD1' ' A' ' 42' ' ' LEU . 0.5 OUTLIER -71.25 -31.16 67.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.712 179.81 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 143.92 52.92 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.989 179.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.493 ' HB1' ' OE1' ' A' ' 107' ' ' GLN . . . -121.09 -173.72 2.67 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.739 0.304 . . . . 0.0 111.256 179.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 14.7 ttm180 -109.74 139.4 44.84 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.091 -179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.685 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 12.2 mt-10 -56.66 -18.1 11.08 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.412 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' SER . . . . . 0.638 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 0.8 OUTLIER -71.97 -56.98 4.71 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.316 -179.91 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -48.25 -44.23 33.19 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.033 0.444 . . . . 0.0 110.796 179.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.685 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -65.59 -58.69 5.15 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.507 -179.971 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.512 HG21 ' O ' ' A' ' 51' ' ' SER . 14.1 m -49.27 -45.2 18.03 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-O 121.051 0.453 . . . . 0.0 110.352 179.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.487 ' CG ' ' HB2' ' A' ' 27' ' ' LEU . 0.2 OUTLIER -55.38 -53.62 53.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.827 178.649 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -48.28 -45.85 35.16 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.577 179.176 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -64.07 -45.82 87.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.887 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.424 ' OG1' ' HA ' ' A' ' 55' ' ' PHE . 0.6 OUTLIER -64.35 -53.68 44.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.289 -179.528 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.723 ' CG2' ' HB2' ' A' ' 116' ' ' LEU . 4.6 p -60.66 -38.28 78.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.064 179.544 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.2 tp -61.23 -39.14 89.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.845 0.355 . . . . 0.0 110.268 178.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 33.8 m -69.53 -60.42 2.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.905 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 14.2 m-70 -52.94 -27.67 19.97 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.837 0.351 . . . . 0.0 111.226 -179.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.646 ' CG2' ' HB3' ' A' ' 116' ' ' LEU . 3.8 t -102.41 46.78 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.045 -179.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.629 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . -76.56 57.77 1.27 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.412 -179.681 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.629 ' CB ' ' O ' ' A' ' 64' ' ' ALA . 26.0 t-20 132.31 -63.68 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.21 0.604 . . . . 0.0 111.381 179.632 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.544 HG12 HG11 ' A' ' 63' ' ' VAL . 35.4 m 42.47 -137.28 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.602 -179.455 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.51 ' O ' ' O ' ' A' ' 98' ' ' SER . 2.8 p -158.89 -31.95 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 121.027 0.441 . . . . 0.0 111.926 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.53 ' HA ' ' HB1' ' A' ' 119' ' ' ALA . 0.7 OUTLIER 40.85 95.67 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.647 179.226 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 22.0 p -66.78 -165.38 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.91 -34.15 71.36 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.017 0.437 . . . . 0.0 110.697 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -68.19 -51.33 46.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.63 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.532 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 3.3 m-20 -60.46 -42.12 95.54 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.779 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 70.6 m -61.89 -44.64 96.39 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-O 121.103 0.478 . . . . 0.0 110.122 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.497 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . . . -68.81 -28.98 67.24 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 178.055 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.706 ' HB3' ' HB ' ' A' ' 115' ' ' VAL . 0.0 OUTLIER -56.4 -57.52 11.95 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 114.061 -1.427 . . . . 0.0 109.834 178.354 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.453 ' HG ' HG22 ' A' ' 115' ' ' VAL . 5.9 mp -62.64 -53.43 54.66 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.164 179.244 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.497 ' CD2' ' HA ' ' A' ' 74' ' ' ALA . 0.3 OUTLIER -54.52 -32.12 57.54 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.72 -179.763 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -67.87 -65.03 0.74 Allowed 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.917 0.389 . . . . 0.0 109.994 179.115 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.03 -22.46 60.73 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.743 179.282 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 31.4 m . . . . . 0 C--N 1.332 -0.174 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.967 179.984 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 37.3 p-10 . . . . . 0 C--O 1.236 0.385 0 CA-C-O 120.761 0.315 . . . . 0.0 111.176 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.603 ' CG ' ' HB2' ' A' ' 102' ' ' SER . 2.8 m-85 -103.13 139.69 38.32 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.835 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.654 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.7 OUTLIER -109.63 146.24 35.11 Favored 'General case' 0 N--CA 1.436 -1.134 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -178.985 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.43 ' N ' ' OD1' ' A' ' 89' ' ' ASP . 36.7 mt -136.01 153.58 51.33 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 113.364 0.875 . . . . 0.0 113.364 -177.449 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.447 ' O ' ' OG ' ' A' ' 98' ' ' SER . 25.2 ttp180 -130.71 142.65 50.43 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 114.69 -1.141 . . . . 0.0 108.193 178.031 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 3.8 p -104.66 140.64 37.74 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 113.796 1.036 . . . . 0.0 113.796 -178.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 27.8 m . . . . . 0 N--CA 1.443 -0.82 0 CA-C-N 113.833 -1.53 . . . . 0.0 107.769 178.376 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.521 -0.169 0 N-CA-C 110.221 -0.289 . . . . 0.0 110.221 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.51 ' O ' ' O ' ' A' ' 67' ' ' VAL . 0.9 OUTLIER -140.73 164.01 31.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.485 0.659 . . . . 0.0 111.308 -179.927 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -104.19 151.21 6.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 178.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.508 HD23 HG13 ' A' ' 63' ' ' VAL . 1.0 OUTLIER -103.94 111.54 24.13 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -178.995 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.654 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 1.4 p -124.27 104.68 14.26 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 104.352 -2.462 . . . . 0.0 104.352 175.143 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 0.603 ' HB2' ' CG ' ' A' ' 88' ' ' TYR . 9.0 p -148.92 165.35 31.84 Favored 'General case' 0 C--N 1.311 -1.106 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -173.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.463 ' CB ' ' O ' ' A' ' 102' ' ' SER . 0.0 OUTLIER 158.62 -91.08 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.077 0 CA-C-N 113.07 -1.877 . . . . 0.0 111.864 176.03 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.512 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 56.87 23.07 7.72 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 -178.641 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.512 ' CB ' ' O ' ' A' ' 104' ' ' ARG . 5.1 m 138.9 168.22 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.859 1.264 . . . . 0.0 108.154 -178.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.428 ' O ' ' O ' ' A' ' 42' ' ' LEU . 1.3 m-20 -104.89 102.59 12.11 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.082 -0.647 . . . . 0.0 112.348 -179.076 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.546 ' NE2' ' N ' ' A' ' 42' ' ' LEU . 0.6 OUTLIER -168.1 157.47 9.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.699 177.991 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.462 ' CE ' ' CE1' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -165.64 145.03 6.4 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.21 0.529 . . . . 0.0 112.293 179.268 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.582 HG22 ' HA ' ' A' ' 24' ' ' THR . 0.7 OUTLIER -104.26 163.47 12.39 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 178.256 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.554 ' HB2' ' O ' ' A' ' 22' ' ' ASP . 5.2 mt -52.8 -61.39 2.32 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 120.165 -0.614 . . . . 0.0 109.838 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . 0.419 ' O ' ' HG2' ' A' ' 114' ' ' LYS . 2.5 tp60 -40.15 -63.38 0.62 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 120.713 0.292 . . . . 0.0 110.603 179.145 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . 1.043 ' O ' HG21 ' A' ' 115' ' ' VAL . 8.0 m-20 -51.5 -58.51 6.1 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 121.265 0.555 . . . . 0.0 110.154 179.384 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . 0.577 ' O ' ' HB2' ' A' ' 117' ' ' LEU . . . -48.4 -39.87 23.93 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.12 0.486 . . . . 0.0 110.108 178.798 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.694 ' HE3' ' HG2' ' A' ' 17' ' ' GLN . 0.0 OUTLIER -72.22 -26.97 62.24 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.877 179.729 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 1.043 HG21 ' O ' ' A' ' 112' ' ' ASP . 10.8 m -70.48 -51.82 34.44 Favored 'Isoleucine or valine' 0 C--O 1.249 1.038 0 CA-C-O 121.406 0.622 . . . . 0.0 111.892 -179.079 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.723 ' HB2' ' CG2' ' A' ' 59' ' ' VAL . 0.5 OUTLIER -70.0 -37.84 75.82 Favored 'General case' 0 N--CA 1.439 -1.017 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 179.433 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.77 ' HA ' ' HB2' ' A' ' 120' ' ' ALA . 5.1 mp -65.6 -32.28 73.77 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.905 178.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.474 ' HA ' HD23 ' A' ' 121' ' ' LEU . 26.4 tp10 -62.17 -53.24 58.14 Favored 'General case' 0 C--N 1.31 -1.112 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 178.51 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . 0.53 ' HB1' ' HA ' ' A' ' 68' ' ' LEU . . . -74.47 -16.56 60.85 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 119.382 -0.927 . . . . 0.0 110.741 177.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.77 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . . . -77.99 -61.51 1.98 Allowed 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.409 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.67 ' HB3' ' ND1' ' A' ' 9' ' ' HIS . 0.4 OUTLIER -56.55 -34.71 67.36 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 118.736 -1.186 . . . . 0.0 108.785 178.111 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.478 ' N ' ' HG ' ' A' ' 121' ' ' LEU . 0.1 OUTLIER -55.03 -65.28 0.61 Allowed 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 114.918 -1.037 . . . . 0.0 112.223 179.797 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.77 -13.25 24.27 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -177.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . 0.629 ' HB2' ' O ' ' A' ' 120' ' ' ALA . 5.0 mm-40 -97.68 -67.06 0.86 Allowed 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 -177.449 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' SER . . . . . 0.601 ' HB2' ' HA ' ' A' ' 121' ' ' LEU . 10.1 t . . . . . 0 CA--C 1.5 -0.981 0 CA-C-N 114.293 -1.321 . . . . 0.0 112.496 -176.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . 0.452 ' ND2' ' H ' ' A' ' 3' ' ' LEU . 11.2 t-20 . . . . . 0 C--O 1.231 0.111 0 CA-C-O 121.043 0.449 . . . . 0.0 110.885 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.469 ' HG ' ' HA2' ' A' ' 29' ' ' GLY . 0.0 OUTLIER -79.88 -76.02 0.23 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.098 179.579 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.503 ' O ' ' CB ' ' A' ' 8' ' ' LEU . 36.1 t -178.48 -151.72 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.766 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.548 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 23.1 mt -96.04 -64.7 1.03 Allowed 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 121.365 0.602 . . . . 0.0 111.453 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.425 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 0.9 OUTLIER -36.19 -59.16 0.64 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.766 -1.106 . . . . 0.0 112.958 -178.288 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.32 -54.32 8.66 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 120.757 0.313 . . . . 0.0 110.733 -179.387 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.503 ' CB ' ' O ' ' A' ' 4' ' ' SER . 46.0 tp -42.5 -51.19 5.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.254 0.549 . . . . 0.0 110.166 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.507 ' CG ' ' CD2' ' A' ' 121' ' ' LEU . 9.6 t60 -64.34 -46.53 83.07 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 177.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.425 ' HB2' ' O ' ' A' ' 6' ' ' SER . 0.0 OUTLIER -50.84 -57.15 9.15 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.21 -1.359 . . . . 0.0 111.741 -179.545 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.55 ' HG3' ' CG2' ' A' ' 31' ' ' VAL . 2.3 pt20 -65.41 -51.37 60.78 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -179.145 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.444 ' HA ' HD12 ' A' ' 15' ' ' LEU . 8.9 p -58.75 -46.22 90.82 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-O 121.206 0.527 . . . . 0.0 110.614 179.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.818 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 24.5 t -56.56 -49.2 75.53 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.329 179.649 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.8 ttt85 -63.82 -30.5 71.59 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.952 0.405 . . . . 0.0 110.533 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.5 ' CD1' ' CG2' ' A' ' 31' ' ' VAL . 6.4 mt -67.56 -65.47 0.68 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.353 -179.422 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.476 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 0.9 OUTLIER -68.04 -27.7 38.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -178.566 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.412 ' HB2' ' O ' ' A' ' 13' ' ' SER . 1.8 mm-40 -87.09 -9.95 54.12 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.672 -179.523 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -151.94 38.44 0.59 Allowed 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 120.821 -0.351 . . . . 0.0 111.925 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 179.35 -67.69 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 179.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.476 ' HB2' ' HA ' ' A' ' 16' ' ' VAL . 15.3 m -72.33 -40.34 67.5 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -178.219 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . 0.438 ' H ' ' HA ' ' A' ' 16' ' ' VAL . . . 82.3 -50.42 4.32 Favored Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.374 -0.917 . . . . 0.0 112.192 -179.06 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -175.93 30.69 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.74 0.305 . . . . 0.0 111.412 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.455 ' HB2' ' HB3' ' A' ' 20' ' ' SER . 1.0 OUTLIER -79.22 -163.14 0.46 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.503 179.734 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.431 ' HA ' ' HA ' ' A' ' 109' ' ' THR . 40.5 m -104.13 149.44 25.23 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.401 ' CA ' ' HG ' ' A' ' 110' ' ' LEU . . . -107.21 145.29 16.0 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.2 -1.0 . . . . 0.0 113.639 -178.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.648 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 0.0 OUTLIER -108.86 123.6 49.31 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 178.939 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.606 ' O ' ' HD3' ' A' ' 28' ' ' ARG . 6.6 tt -104.27 163.52 12.36 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -178.304 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.606 ' HD3' ' O ' ' A' ' 27' ' ' LEU . 0.1 OUTLIER 145.86 58.67 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.425 1.09 . . . . 0.0 109.368 179.966 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . 0.469 ' HA2' ' HG ' ' A' ' 3' ' ' LEU . . . 75.91 6.7 82.84 Favored Glycine 0 C--N 1.335 0.524 0 C-N-CA 120.109 -1.043 . . . . 0.0 110.727 -177.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.471 ' C ' ' ND2' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -166.12 165.9 17.43 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 -179.52 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.648 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 0.7 OUTLIER -131.89 118.09 36.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.522 0.677 . . . . 0.0 111.215 178.763 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -104.92 166.07 10.63 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.901 -179.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -103.9 116.36 32.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.239 0.542 . . . . 0.0 111.344 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.424 ' ND2' ' HB ' ' A' ' 24' ' ' THR . 5.9 t30 -97.74 120.59 38.4 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.718 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.0 ttpp -114.15 -25.47 8.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.986 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -60.01 -55.0 39.45 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.818 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.57 -169.44 2.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.548 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.489 ' O ' ' HB3' ' A' ' 39' ' ' PHE . 29.7 p -132.67 -43.17 0.91 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.465 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.574 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 0.0 OUTLIER 91.2 175.02 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.269 0.628 . . . . 0.0 110.746 -179.545 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.574 ' HB3' ' O ' ' A' ' 39' ' ' PHE . 0.1 OUTLIER 150.08 62.82 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.878 0.871 . . . . 0.0 109.803 -179.667 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.772 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . 67.27 -88.78 0.16 Allowed Glycine 0 CA--C 1.522 0.511 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.072 -178.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.625 ' O ' ' O ' ' A' ' 41' ' ' GLY . 13.6 tp 42.86 172.07 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 117.41 0.605 . . . . 0.0 111.915 179.257 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -127.85 34.79 4.57 Favored 'General case' 0 C--N 1.329 -0.285 0 O-C-N 121.81 -0.556 . . . . 0.0 111.655 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.451 ' HA ' ' HB2' ' A' ' 48' ' ' ALA . 30.2 mm 56.61 7.34 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 179.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -91.6 -31.23 15.97 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.723 0.297 . . . . 0.0 111.456 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -91.78 -53.26 4.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.22 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 177.52 71.36 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.585 -0.816 . . . . 0.0 112.799 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.451 ' HB2' ' HA ' ' A' ' 44' ' ' ILE . . . -135.31 161.67 34.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.674 0.273 . . . . 0.0 110.775 179.731 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 29.4 mtt180 -93.83 134.22 36.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.115 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.6 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 7.0 mt-10 -51.29 -27.0 8.27 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.164 0.507 . . . . 0.0 110.732 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' SER . . . . . 0.5 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 31.1 p -69.82 -57.87 4.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.346 179.542 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -44.28 -50.69 8.85 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.183 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.6 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -65.04 -51.73 59.92 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.425 -179.815 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.504 ' H ' ' HG3' ' A' ' 53' ' ' LYS . 53.7 t -56.6 -37.48 52.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.516 ' CG ' ' HB2' ' A' ' 27' ' ' LEU . 0.2 OUTLIER -59.96 -47.61 85.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.179 -0.918 . . . . 0.0 109.429 178.746 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.511 ' O ' ' CD1' ' A' ' 60' ' ' LEU . . . -54.79 -64.55 0.8 Allowed 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.83 178.75 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.4 ' O ' ' CB ' ' A' ' 61' ' ' SER . 2.6 mm-40 -39.87 -48.73 2.35 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.814 179.25 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.457 ' O ' ' CE1' ' A' ' 62' ' ' HIS . 0.9 OUTLIER -65.19 -54.05 35.53 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.557 179.787 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.535 ' CG2' ' HA ' ' A' ' 113' ' ' ALA . 0.6 OUTLIER -48.42 -41.15 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 N-CA-C 112.562 0.579 . . . . 0.0 112.562 -178.74 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.567 ' CD2' HD22 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -93.36 -17.06 23.98 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.414 -0.515 . . . . 0.0 110.674 179.875 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.455 ' HB2' ' HA ' ' A' ' 58' ' ' THR . 1.8 m -66.57 -63.21 1.12 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.702 178.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . 0.519 ' CE1' HD11 ' A' ' 117' ' ' LEU . 4.7 p-80 -64.19 -43.34 95.38 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 121.159 0.504 . . . . 0.0 109.674 179.572 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.666 HG21 ' HB3' ' A' ' 116' ' ' LEU . 4.8 t -54.77 -60.03 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.555 178.35 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.532 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 40.45 26.06 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 115.374 -0.83 . . . . 0.0 113.152 178.673 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.532 ' CB ' ' O ' ' A' ' 64' ' ' ALA . 7.3 t30 149.92 -68.89 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 122.788 0.435 . . . . 0.0 110.848 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.656 HG12 HG13 ' A' ' 63' ' ' VAL . 23.4 m 45.24 -162.5 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.664 ' HB ' ' HB3' ' A' ' 97' ' ' ASN . 10.7 m -142.16 77.05 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.099 0 CA-C-O 121.012 0.434 . . . . 0.0 110.432 -178.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.684 ' HB2' ' HB2' ' A' ' 98' ' ' SER . 0.2 OUTLIER -70.93 80.73 0.65 Allowed 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.971 -179.026 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 69.0 p -48.11 166.61 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 178.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -39.81 -35.02 0.3 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.043 0.449 . . . . 0.0 111.753 -179.491 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.431 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 3.2 tp10 -64.19 -48.2 76.85 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.189 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.546 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 81.0 m-20 -70.96 -52.13 21.64 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.447 179.612 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.654 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 89.9 m -45.68 -39.41 7.91 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.136 0.493 . . . . 0.0 110.207 178.69 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.468 ' HA ' ' HG ' ' A' ' 77' ' ' LEU . . . -73.65 -41.85 62.17 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 178.203 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.923 ' HB3' ' CG2' ' A' ' 115' ' ' VAL . 0.1 OUTLIER -50.29 -44.97 54.14 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 113.684 -1.598 . . . . 0.0 108.636 176.971 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.467 HD11 ' HA ' ' A' ' 73' ' ' THR . 2.1 mp -64.24 -54.14 38.13 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.561 178.282 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.654 ' HG ' ' O ' ' A' ' 73' ' ' THR . 5.1 mt -49.18 -39.87 31.05 Favored 'General case' 0 C--N 1.34 0.192 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 179.273 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 16.1 mt-30 -59.96 -53.33 59.1 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.75 178.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' SER . . . . . 0.518 ' CB ' ' HG3' ' A' ' 111' ' ' GLN . 0.0 OUTLIER -49.26 -49.25 44.24 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.297 179.337 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.454 ' OG1' ' CE1' ' A' ' 88' ' ' TYR . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.808 -179.144 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . 0.457 ' O ' ' HB2' ' A' ' 104' ' ' ARG . 5.6 p-10 . . . . . 0 C--O 1.233 0.232 0 CA-C-O 120.884 0.373 . . . . 0.0 110.565 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.594 ' HA ' ' CB ' ' A' ' 102' ' ' SER . 0.3 OUTLIER -80.64 132.57 35.62 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-O 121.216 0.531 . . . . 0.0 112.053 -179.474 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.792 ' O ' ' O ' ' A' ' 101' ' ' VAL . 0.5 OUTLIER -105.96 125.83 51.46 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 104.891 -2.263 . . . . 0.0 104.891 176.611 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.501 HD21 HD21 ' A' ' 100' ' ' LEU . 3.1 mt -122.17 134.49 54.72 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 115.45 1.648 . . . . 0.0 115.45 -174.276 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.8 ttt-85 -129.04 104.49 7.6 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 104.628 -2.36 . . . . 0.0 104.628 175.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.451 ' CB ' ' HB3' ' A' ' 98' ' ' SER . 2.7 m -104.21 165.35 11.11 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 115.842 1.793 . . . . 0.0 115.842 -174.119 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.702 ' C ' ' O ' ' A' ' 97' ' ' ASN . 0.2 OUTLIER . . . . . 0 C--N 1.324 -0.517 0 CA-C-N 111.733 -2.485 . . . . 0.0 107.023 178.23 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.702 ' O ' ' C ' ' A' ' 93' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.216 -0.704 0 CA-C-O 121.236 0.541 . . . . 0.0 112.34 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.684 ' HB2' ' HB2' ' A' ' 68' ' ' LEU . 3.9 m -155.25 142.34 19.25 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.239 178.714 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 84.1 t -104.12 133.45 48.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.835 -177.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.708 ' CD1' ' HB3' ' A' ' 102' ' ' SER . 3.3 tm? -104.42 120.9 42.29 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 113.848 1.055 . . . . 0.0 113.848 -178.205 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.792 ' O ' ' O ' ' A' ' 89' ' ' ASP . 1.5 p -124.07 103.91 13.29 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 N-CA-C 103.686 -2.709 . . . . 0.0 103.686 174.299 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 0.708 ' HB3' ' CD1' ' A' ' 100' ' ' LEU . 1.2 t -144.2 165.58 27.44 Favored 'General case' 0 CA--C 1.492 -1.255 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -173.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.567 HD22 ' CD2' ' A' ' 60' ' ' LEU . 0.0 OUTLIER 161.86 -81.71 0.0 OUTLIER 'General case' 0 N--CA 1.428 -1.549 0 CA-C-N 112.669 -2.059 . . . . 0.0 110.744 175.78 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.574 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 46.66 31.46 1.4 Allowed 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.341 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.574 ' CB ' ' O ' ' A' ' 104' ' ' ARG . 58.3 m 129.68 164.82 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.597 1.159 . . . . 0.0 108.453 -178.219 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.538 ' HB3' ' HB2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -104.96 102.19 11.72 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -177.737 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.772 ' HB2' ' O ' ' A' ' 41' ' ' GLY . 2.1 mt-30 -169.43 162.59 10.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.84 177.26 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.423 ' HB2' ' CA ' ' A' ' 56' ' ' ALA . 1.2 tpt -164.76 147.34 8.47 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.363 -0.535 . . . . 0.0 112.002 178.495 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.436 HG21 ' CD1' ' A' ' 39' ' ' PHE . 0.3 OUTLIER -109.25 164.84 12.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.348 179.474 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.42 ' HB3' ' CG2' ' A' ' 16' ' ' VAL . 1.0 OUTLIER -50.44 -53.9 26.1 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.199 0.523 . . . . 0.0 110.17 179.316 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . 0.799 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 1.9 tp-100 -51.22 -65.94 0.47 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.281 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . 0.626 ' O ' HG12 ' A' ' 115' ' ' VAL . 1.2 t0 -50.14 -47.48 54.19 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-O 121.542 0.687 . . . . 0.0 110.782 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . 0.535 ' HA ' ' CG2' ' A' ' 59' ' ' VAL . . . -53.47 -50.16 65.93 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.86 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.818 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -70.67 -33.58 71.09 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.797 -178.648 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.923 ' CG2' ' HB3' ' A' ' 75' ' ' LYS . 4.0 p -62.45 -52.18 63.08 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.104 0 C-N-CA 119.082 -1.047 . . . . 0.0 110.229 179.524 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.666 ' HB3' HG21 ' A' ' 63' ' ' VAL . 3.1 mp -64.2 -39.77 94.69 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-N 114.44 -1.255 . . . . 0.0 110.182 -178.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.548 ' CD2' ' HA ' ' A' ' 5' ' ' LEU . 0.1 OUTLIER -74.26 -16.67 60.94 Favored 'General case' 0 CA--C 1.511 -0.52 0 C-N-CA 120.369 -0.532 . . . . 0.0 111.161 178.99 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.703 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 0.0 OUTLIER -72.17 -47.96 46.94 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 106.152 -1.795 . . . . 0.0 106.152 176.77 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -72.46 -28.19 62.77 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.846 177.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.561 ' HA ' ' CG1' ' A' ' 66' ' ' VAL . . . -68.89 -62.35 1.42 Allowed 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.948 179.571 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.609 HD21 ' HA ' ' A' ' 118' ' ' GLU . 0.1 OUTLIER -60.47 -37.57 81.44 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.718 -179.502 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.703 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.1 OUTLIER -70.17 -34.46 73.02 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -179.836 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.4 ' N ' ' HG2' ' A' ' 122' ' ' ARG . 0.0 OUTLIER -90.95 -26.63 19.17 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.554 0.575 . . . . 0.0 112.554 -178.542 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -95.68 -66.26 0.92 Allowed 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 -178.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.327 -0.383 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -178.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 5.4 p30 . . . . . 0 N--CA 1.461 0.095 0 CA-C-O 121.009 0.433 . . . . 0.0 111.137 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.613 HD11 ' HB2' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -95.48 -94.98 0.18 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.383 179.048 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.422 ' OG ' ' N ' ' A' ' 5' ' ' LEU . 40.6 t -141.96 -168.74 2.76 Favored 'General case' 0 C--N 1.335 -0.062 0 CA-C-O 120.742 0.306 . . . . 0.0 110.592 179.459 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.511 ' O ' HD23 ' A' ' 117' ' ' LEU . 0.8 OUTLIER -95.51 -66.18 0.93 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.457 0.646 . . . . 0.0 111.397 -179.914 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.58 -37.55 87.95 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.492 -178.698 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . 0.508 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 0.5 OUTLIER -66.12 -52.25 50.3 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 178.469 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.613 ' HB2' HD11 ' A' ' 3' ' ' LEU . 42.5 tp -49.24 -54.22 17.82 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.113 178.328 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.438 ' O ' ' CB ' ' A' ' 13' ' ' SER . 42.7 t-80 -53.45 -41.44 66.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.883 178.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.508 ' HB2' ' O ' ' A' ' 7' ' ' ASP . 3.1 mmt85 -56.47 -57.76 10.93 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.691 -179.506 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.447 ' CG ' HG11 ' A' ' 31' ' ' VAL . 0.6 OUTLIER -64.81 -49.95 68.65 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 120.444 -0.502 . . . . 0.0 111.624 -179.313 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.524 HG11 ' CB ' ' A' ' 114' ' ' LYS . 9.8 p -60.08 -47.9 90.06 Favored 'Isoleucine or valine' 0 C--O 1.24 0.578 0 CA-C-O 121.119 0.485 . . . . 0.0 110.803 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.644 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 53.0 m -63.59 -49.35 73.7 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.28 179.305 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.42 ' O ' ' CG ' ' A' ' 18' ' ' GLN . 13.3 mtp180 -61.76 -23.5 66.21 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.414 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.411 ' HB2' ' O ' ' A' ' 12' ' ' VAL . 8.7 mt -72.61 -61.89 1.64 Allowed 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 121.009 0.433 . . . . 0.0 110.656 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.577 ' CG2' ' HB3' ' A' ' 110' ' ' LEU . 23.1 t -70.24 -30.92 45.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.242 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.437 ' CG ' ' O ' ' A' ' 13' ' ' SER . 0.4 OUTLIER -71.71 -19.09 62.1 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.132 -179.51 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.42 ' CG ' ' O ' ' A' ' 14' ' ' ARG . 1.8 pt20 -155.63 50.4 0.55 Allowed 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.697 178.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -178.75 -66.5 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.814 0.34 . . . . 0.0 111.885 179.511 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.429 ' HB2' ' HA ' ' A' ' 16' ' ' VAL . 1.8 m -77.27 -81.37 0.09 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.536 -178.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . 0.529 ' H ' ' HA ' ' A' ' 16' ' ' VAL . . . 124.55 -45.25 1.19 Allowed Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 121.081 -0.581 . . . . 0.0 111.802 -179.591 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 179.94 32.08 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.101 0.477 . . . . 0.0 110.141 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.401 ' HB3' ' O ' ' A' ' 34' ' ' ASN . 21.4 m -80.36 -163.3 0.54 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.202 -179.586 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.596 HG22 ' CD2' ' A' ' 39' ' ' PHE . 20.5 m -104.56 142.34 34.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.946 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -105.3 139.91 14.86 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.437 -0.887 . . . . 0.0 113.49 -178.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.579 ' HB2' ' CB ' ' A' ' 51' ' ' SER . 0.0 OUTLIER -110.59 135.38 51.32 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 179.193 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.483 ' O ' ' HD3' ' A' ' 28' ' ' ARG . 4.4 tt -104.89 160.58 14.9 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -178.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.483 ' HD3' ' O ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER 158.75 55.31 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.202 -179.947 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . 0.445 ' O ' HD23 ' A' ' 3' ' ' LEU . . . 76.7 2.74 77.18 Favored Glycine 0 C--N 1.334 0.426 0 N-CA-C 110.632 -0.987 . . . . 0.0 110.632 -177.561 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.448 ' C ' ' ND2' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -166.18 165.47 17.58 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 -179.845 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.447 HG11 ' CG ' ' A' ' 11' ' ' GLN . 1.7 p -116.35 128.92 73.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 121.4 0.619 . . . . 0.0 111.205 178.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.423 ' CB ' ' HG3' ' A' ' 26' ' ' LYS . . . -115.56 165.68 12.75 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.076 -0.965 . . . . 0.0 110.416 179.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.463 ' HA ' ' CD1' ' A' ' 110' ' ' LEU . . . -104.0 137.99 41.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.199 0.524 . . . . 0.0 111.855 -179.327 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.495 ' ND2' ' HB ' ' A' ' 24' ' ' THR . 2.9 t30 -122.27 113.81 19.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.319 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.86 -23.53 10.52 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.258 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -50.92 -45.02 60.29 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.891 0.377 . . . . 0.0 110.742 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.441 HG23 ' CE1' ' A' ' 39' ' ' PHE . 10.2 t -128.2 -158.12 0.86 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.259 179.404 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 26.0 p -155.11 100.93 2.21 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.953 0.406 . . . . 0.0 111.036 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.596 ' CD2' HG22 ' A' ' 24' ' ' THR . 10.9 m-85 -86.26 131.85 34.13 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.682 0.754 . . . . 0.0 111.911 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.619 ' H ' ' NE2' ' A' ' 107' ' ' GLN . 0.1 OUTLIER -160.03 81.88 0.71 Allowed 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.519 -1.218 . . . . 0.0 109.811 179.728 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 69.32 101.34 0.04 OUTLIER Glycine 0 CA--C 1.525 0.662 0 CA-C-N 115.954 -0.566 . . . . 0.0 113.179 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.717 ' HB2' ' NE2' ' A' ' 107' ' ' GLN . 0.0 OUTLIER -159.71 -144.34 0.11 Allowed 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 110.256 -0.275 . . . . 0.0 110.256 179.096 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -162.19 21.95 0.1 Allowed 'General case' 0 CA--C 1.529 0.145 0 O-C-N 121.832 -0.543 . . . . 0.0 112.088 -179.515 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.472 ' HA ' ' HB1' ' A' ' 48' ' ' ALA . 1.8 mp 66.44 4.45 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 179.512 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.62 -57.15 3.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.902 0.382 . . . . 0.0 111.184 -179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.0 p -61.63 -59.6 4.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.989 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -179.78 76.81 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.327 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.497 ' HA ' ' CE1' ' A' ' 39' ' ' PHE . . . -138.4 -158.61 0.87 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.552 0.215 . . . . 0.0 111.151 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.415 ' O ' ' OE2' ' A' ' 52' ' ' GLU . 9.6 mtm180 -140.5 -174.54 3.99 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 120.874 0.369 . . . . 0.0 111.253 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.496 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 21.7 tt0 -85.29 -30.83 23.44 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.979 0.418 . . . . 0.0 111.212 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' SER . . . . . 0.579 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 0.3 OUTLIER -59.14 -65.31 0.69 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.842 -179.999 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.479 ' HB3' ' CD2' ' A' ' 39' ' ' PHE . 0.1 OUTLIER -35.59 -65.38 0.25 Allowed 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.662 179.947 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.496 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -51.08 -52.31 44.75 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.522 179.822 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 94.6 t -55.91 -35.35 40.18 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 CA-C-O 121.007 0.432 . . . . 0.0 109.941 179.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.415 ' CE1' ' HB3' ' A' ' 113' ' ' ALA . 0.2 OUTLIER -70.86 -45.23 64.81 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.409 179.299 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.77 -46.93 87.44 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.39 179.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 -62.82 -44.04 97.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.648 179.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 16.7 p -64.53 -56.54 13.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.933 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.418 ' CG2' ' HB2' ' A' ' 116' ' ' LEU . 12.3 p -60.4 -44.18 95.55 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.59 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.7 tp -55.96 -42.77 76.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.903 0.383 . . . . 0.0 110.226 179.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 62.7 m -61.83 -58.77 6.68 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.832 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 10.8 m-70 -55.16 -32.74 62.38 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.136 0.493 . . . . 0.0 110.312 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.553 HG13 HG13 ' A' ' 66' ' ' VAL . 3.6 t -100.26 59.2 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.282 179.393 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.492 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . -83.4 34.67 0.48 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.61 -179.509 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.492 ' CB ' ' O ' ' A' ' 64' ' ' ALA . 7.4 t-20 153.82 -61.78 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 122.855 0.462 . . . . 0.0 110.379 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.553 HG13 HG13 ' A' ' 63' ' ' VAL . 18.8 m 40.77 -163.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.525 ' CG2' ' HB2' ' A' ' 123' ' ' GLN . 29.3 m -148.44 75.23 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.437 -1.112 0 CA-C-O 120.939 0.399 . . . . 0.0 111.131 -178.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.556 ' CA ' ' HB2' ' A' ' 72' ' ' ASP . 0.3 OUTLIER -65.0 98.73 0.31 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.874 -179.849 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.795 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 1.4 p -66.92 -172.3 0.18 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.61 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.72 -34.62 12.41 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 120.97 0.414 . . . . 0.0 110.702 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.571 ' O ' ' HE2' ' A' ' 75' ' ' LYS . 0.1 OUTLIER -72.28 -65.72 0.74 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.41 179.776 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.652 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 0.6 OUTLIER -52.84 -33.98 51.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.45 179.583 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 11.7 p -62.55 -55.87 23.25 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 178.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.67 -24.39 61.15 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 108.609 -0.885 . . . . 0.0 108.609 177.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.652 ' HB2' ' HA ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -62.52 -65.2 0.72 Allowed 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.733 -1.122 . . . . 0.0 109.981 178.716 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.416 ' CB ' HD21 ' A' ' 90' ' ' LEU . 4.3 mp -50.73 -39.94 53.09 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 178.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.86 -64.17 0.92 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.706 178.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -58.52 -52.39 65.84 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.832 -179.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' SER . . . . . 0.458 ' CB ' ' HG2' ' A' ' 111' ' ' GLN . 1.3 t -53.83 -27.65 30.96 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.485 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 89.0 m . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.321 -179.326 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . 0.495 ' C ' ' OD1' ' A' ' 87' ' ' ASN . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.079 0 CA-C-O 120.394 0.14 . . . . 0.0 111.187 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.496 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 5.0 m-85 -92.4 138.43 31.52 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 120.257 -0.577 . . . . 0.0 111.026 -179.623 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.701 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 1.2 t0 -120.23 148.01 44.22 Favored 'General case' 0 N--CA 1.436 -1.129 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -179.129 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.5 ' N ' ' CD1' ' A' ' 90' ' ' LEU . 0.0 OUTLIER -147.72 165.44 30.49 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -177.966 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.594 ' O ' ' CB ' ' A' ' 98' ' ' SER . 10.9 ttm105 -137.4 158.72 43.8 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 114.414 -1.266 . . . . 0.0 108.869 178.705 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.467 ' O ' ' CG1' ' A' ' 93' ' ' VAL . 56.8 p -104.42 159.35 15.8 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.714 0.769 . . . . 0.0 112.567 -179.013 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.566 ' O ' ' O ' ' A' ' 97' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.44 -0.948 0 CA-C-N 113.931 -1.486 . . . . 0.0 108.17 -179.057 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.795 ' HA ' ' HA ' ' A' ' 69' ' ' THR . 0.6 OUTLIER . . . . . 0 N--CA 1.45 -0.429 0 N-CA-C 109.959 -0.386 . . . . 0.0 109.959 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.594 ' CB ' ' O ' ' A' ' 91' ' ' ARG . 0.2 OUTLIER -140.79 164.53 29.97 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.493 0.663 . . . . 0.0 110.878 179.663 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . 0.464 ' HA ' ' O ' ' A' ' 65' ' ' ASN . 0.5 OUTLIER -104.2 145.61 12.73 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.328 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.539 HD21 ' HG ' ' A' ' 116' ' ' LEU . 0.3 OUTLIER -103.55 104.88 15.0 Favored 'General case' 0 CA--C 1.507 -0.695 0 C-N-CA 119.431 -0.908 . . . . 0.0 112.557 -179.131 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.701 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 1.3 p -116.35 103.24 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.186 0 N-CA-C 103.256 -2.868 . . . . 0.0 103.256 173.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 0.506 ' O ' HD22 ' A' ' 103' ' ' LEU . 0.1 OUTLIER -144.85 163.6 33.59 Favored 'General case' 0 C--N 1.303 -1.452 0 C-N-CA 119.131 -1.028 . . . . 0.0 112.597 -174.613 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.506 HD22 ' O ' ' A' ' 102' ' ' SER . 0.1 OUTLIER 159.45 -82.3 0.0 OUTLIER 'General case' 0 N--CA 1.435 -1.197 0 CA-C-N 113.801 -1.545 . . . . 0.0 111.39 176.967 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.569 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 46.28 32.98 1.65 Allowed 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.999 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.624 ' HB3' ' N ' ' A' ' 42' ' ' LEU . 52.7 m 129.55 162.96 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.674 1.19 . . . . 0.0 108.104 -178.021 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -104.84 102.11 11.67 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 119.838 -0.745 . . . . 0.0 112.394 -178.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.717 ' NE2' ' HB2' ' A' ' 42' ' ' LEU . 1.3 mt-30 -168.29 127.98 1.24 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.397 177.698 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -130.85 143.29 50.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.353 0.597 . . . . 0.0 112.324 -179.575 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.519 ' HA ' HG23 ' A' ' 24' ' ' THR . 0.3 OUTLIER -104.55 165.12 11.27 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.432 179.378 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.577 ' HB3' ' CG2' ' A' ' 16' ' ' VAL . 0.3 OUTLIER -53.75 -59.53 4.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.779 0.323 . . . . 0.0 110.673 179.983 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . 0.57 ' O ' ' HD2' ' A' ' 114' ' ' LYS . 1.2 tp60 -49.26 -59.57 3.57 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 121.1 0.476 . . . . 0.0 110.986 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . 0.482 ' O ' ' HB ' ' A' ' 115' ' ' VAL . 1.3 m-20 -50.68 -47.47 58.86 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.139 0.495 . . . . 0.0 110.59 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . 0.419 ' O ' HD12 ' A' ' 117' ' ' LEU . . . -49.94 -60.04 3.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.692 179.426 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.644 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -66.13 -21.5 66.34 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.153 179.87 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.561 ' CG2' ' CG ' ' A' ' 75' ' ' LYS . 46.0 t -62.62 -61.64 1.55 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.82 0 CA-C-O 121.876 0.846 . . . . 0.0 109.839 179.521 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.539 ' HG ' HD21 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -63.99 -39.8 94.94 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 114.8 -1.091 . . . . 0.0 109.879 179.837 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.661 ' HA ' ' HB1' ' A' ' 120' ' ' ALA . 0.2 OUTLIER -71.06 -18.63 62.55 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.946 179.86 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.543 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 2.7 tt0 -71.99 -54.09 10.98 Favored 'General case' 0 N--CA 1.441 -0.923 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 176.815 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -71.33 -22.56 61.91 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 114.679 -1.146 . . . . 0.0 111.028 177.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.661 ' HB1' ' HA ' ' A' ' 117' ' ' LEU . . . -76.01 -54.42 6.89 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.214 179.754 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.513 HD22 ' HA ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -63.71 -27.94 69.56 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.83 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.543 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -73.18 -43.7 61.01 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.917 -0.583 . . . . 0.0 112.064 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.525 ' HB2' ' CG2' ' A' ' 67' ' ' VAL . 1.5 tt0 -95.11 -25.79 16.29 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 113.496 0.924 . . . . 0.0 113.496 -178.169 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . 0.402 ' CG ' ' O ' ' A' ' 120' ' ' ALA . 2.5 mm-40 -85.24 -66.41 0.9 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 -177.551 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 4.7 p . . . . . 0 C--N 1.325 -0.473 0 CA-C-O 120.989 0.423 . . . . 0.0 112.079 -178.652 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 5.4 p-10 . . . . . 0 CA--C 1.528 0.118 0 CA-C-O 120.732 0.301 . . . . 0.0 110.776 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.662 ' CD2' ' O ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER -138.57 103.11 4.78 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 121.221 0.534 . . . . 0.0 111.225 179.816 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.612 ' O ' ' O ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER 40.15 175.1 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.707 0.765 . . . . 0.0 112.853 179.679 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.441 HD23 ' CB ' ' A' ' 121' ' ' LEU . 0.3 OUTLIER -95.93 -65.84 0.95 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.718 179.308 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -60.18 -33.05 71.67 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.677 -1.147 . . . . 0.0 111.706 -179.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -65.48 -50.49 65.13 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 178.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.509 ' O ' ' HG2' ' A' ' 11' ' ' GLN . 22.3 tp -55.32 -44.58 75.95 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.887 179.252 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.49 ' HB2' ' HB3' ' A' ' 117' ' ' LEU . 79.9 t60 -64.82 -41.32 95.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.557 0.694 . . . . 0.0 110.0 179.238 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -57.91 -50.13 74.38 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.996 -179.34 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.671 ' HG3' ' CG1' ' A' ' 31' ' ' VAL . 1.4 pt20 -66.63 -56.67 9.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.487 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.482 ' HA ' ' CD1' ' A' ' 15' ' ' LEU . 10.8 p -53.74 -48.32 61.17 Favored 'Isoleucine or valine' 0 C--O 1.242 0.704 0 CA-C-O 121.322 0.582 . . . . 0.0 111.142 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.665 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 62.7 m -62.52 -40.46 96.84 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.256 -179.798 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.442 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 1.2 tpm_? -64.69 -30.89 71.92 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.979 0.418 . . . . 0.0 110.095 -179.797 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.534 ' O ' ' N ' ' A' ' 19' ' ' GLU . 4.6 mt -71.33 -65.08 0.8 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.844 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.686 ' CG2' ' HB3' ' A' ' 110' ' ' LEU . 50.2 t -58.77 -45.95 91.02 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.403 0 C-N-CA 120.556 -0.458 . . . . 0.0 111.434 -179.003 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.45 ' CG ' ' O ' ' A' ' 13' ' ' SER . 6.1 mm-40 -62.7 -12.69 25.29 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.604 -178.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.457 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 3.6 pt20 -170.59 60.18 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.163 0 CA-C-O 120.786 0.326 . . . . 0.0 111.56 178.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.534 ' N ' ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER 177.79 -58.72 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 179.817 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.1 m -87.93 -79.63 0.29 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.853 0.359 . . . . 0.0 111.748 -178.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . 0.414 ' O ' ' CB ' ' A' ' 22' ' ' ASP . . . 107.64 54.11 0.65 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.726 -179.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.414 ' CB ' ' O ' ' A' ' 21' ' ' GLY . 0.0 OUTLIER 83.2 0.43 1.13 Allowed 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 179.338 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -60.73 -167.03 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 110.37 -0.233 . . . . 0.0 110.37 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.7 m -104.47 138.31 41.05 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.52 ' CA ' ' HG ' ' A' ' 110' ' ' LEU . . . -114.57 156.24 15.79 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.209 -0.996 . . . . 0.0 113.236 -179.067 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.579 ' HD2' ' HG2' ' A' ' 28' ' ' ARG . 0.0 OUTLIER -114.73 151.04 34.35 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.35 -0.241 . . . . 0.0 110.35 179.407 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.46 ' HB2' ' CG ' ' A' ' 55' ' ' PHE . 5.9 tt -130.18 106.93 8.93 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.141 0.496 . . . . 0.0 112.037 -179.588 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.579 ' HG2' ' HD2' ' A' ' 26' ' ' LYS . 0.2 OUTLIER -134.33 52.28 2.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.584 -0.734 . . . . 0.0 109.253 178.457 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 83.79 4.22 88.94 Favored Glycine 0 C--N 1.332 0.358 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 -176.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.463 ' C ' ' ND2' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -166.07 166.7 17.0 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 106.701 -1.592 . . . . 0.0 106.701 -179.512 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.671 ' CG1' ' HG3' ' A' ' 11' ' ' GLN . 11.3 p -113.54 137.96 44.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 C-N-CA 120.003 -0.679 . . . . 0.0 112.281 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.473 ' HB1' ' HE3' ' A' ' 26' ' ' LYS . . . -126.74 164.88 20.35 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.654 178.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -104.51 148.19 26.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.139 0.495 . . . . 0.0 111.623 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 42.2 t30 -135.97 117.52 14.85 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.301 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.14 3.33 9.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.4 -179.774 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -61.46 -53.08 61.14 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.951 0.405 . . . . 0.0 110.537 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.424 ' O ' ' CB ' ' A' ' 38' ' ' THR . 0.0 OUTLIER -128.04 -89.37 0.53 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.193 179.626 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.586 ' O ' ' HB3' ' A' ' 39' ' ' PHE . 0.1 OUTLIER 166.01 -105.45 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 110.259 -0.275 . . . . 0.0 110.259 179.457 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.586 ' HB3' ' O ' ' A' ' 38' ' ' THR . 0.1 OUTLIER 169.25 -164.46 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 179.63 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.563 ' HB3' ' O ' ' A' ' 39' ' ' PHE . 0.1 OUTLIER 150.86 55.44 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.371 0.669 . . . . 0.0 110.441 179.833 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.549 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . 67.1 -65.39 0.21 Allowed Glycine 0 CA--C 1.523 0.578 0 C-N-CA 120.995 -0.621 . . . . 0.0 112.616 -179.379 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.808 ' O ' ' HB3' ' A' ' 105' ' ' SER . 0.4 OUTLIER 24.28 -138.83 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.203 0.601 . . . . 0.0 112.58 179.444 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -172.64 22.43 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 O-C-N 121.849 -0.532 . . . . 0.0 112.065 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.521 ' CD1' ' N ' ' A' ' 44' ' ' ILE . 1.3 mp 63.37 2.42 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 120.822 0.344 . . . . 0.0 111.687 179.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.93 -22.15 25.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.839 0.352 . . . . 0.0 111.003 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.8 -30.91 11.01 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.397 -179.705 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 177.94 -30.03 0.07 OUTLIER Glycine 0 CA--C 1.519 0.342 0 C-N-CA 120.169 -1.015 . . . . 0.0 113.556 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.462 ' HB1' HD22 ' A' ' 42' ' ' LEU . . . -48.32 173.46 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 117.1 0.45 . . . . 0.0 111.488 -179.584 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.417 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 23.0 mtp85 -121.89 173.24 7.63 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.527 -179.592 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.569 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 0.8 OUTLIER -66.81 -29.97 70.05 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.115 0.483 . . . . 0.0 110.54 179.762 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' SER . . . . . 0.654 ' O ' HG21 ' A' ' 54' ' ' VAL . 0.3 OUTLIER -49.75 -65.18 0.61 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.461 179.548 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.468 ' HB2' ' HG2' ' A' ' 107' ' ' GLN . 0.2 OUTLIER -52.56 -62.21 1.79 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.264 -179.15 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.569 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -46.68 -59.14 3.22 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 -178.563 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.654 HG21 ' O ' ' A' ' 51' ' ' SER . 15.9 m -51.91 -47.36 41.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.46 0 CA-C-O 120.887 0.375 . . . . 0.0 110.732 -179.783 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.46 ' CG ' ' HB2' ' A' ' 27' ' ' LEU . 0.1 OUTLIER -57.29 -46.68 82.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.553 179.156 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.407 ' CB ' ' HB2' ' A' ' 108' ' ' MET . . . -54.69 -50.99 66.94 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-O 120.85 0.357 . . . . 0.0 110.681 179.52 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -57.92 -40.24 79.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.4 179.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.45 HG22 ' CD2' ' A' ' 62' ' ' HIS . 0.9 OUTLIER -67.28 -63.98 0.95 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.978 179.791 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.531 ' CG2' ' HB2' ' A' ' 116' ' ' LEU . 14.4 p -53.36 -40.88 42.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.793 0.33 . . . . 0.0 110.342 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.602 ' O ' HG21 ' A' ' 63' ' ' VAL . 0.5 OUTLIER -64.09 -38.8 92.37 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.758 179.464 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 61.3 m -72.69 -44.86 61.23 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.167 179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . 0.45 ' CD2' HG22 ' A' ' 58' ' ' THR . 53.3 m-70 -51.72 -54.4 28.74 Favored 'General case' 0 CA--C 1.521 -0.163 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.126 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.602 HG21 ' O ' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -54.11 -78.8 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.806 179.266 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.485 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 60.96 17.0 7.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.354 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.485 ' CB ' ' O ' ' A' ' 64' ' ' ALA . 0.6 OUTLIER 153.1 -68.22 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 122.765 0.426 . . . . 0.0 110.943 -179.831 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.498 ' CG1' ' HA ' ' A' ' 63' ' ' VAL . 23.1 m 49.01 -164.95 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.054 -179.473 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.732 ' HB ' ' HB3' ' A' ' 97' ' ' ASN . 15.8 m -152.26 50.26 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.169 0 CA-C-O 121.129 0.49 . . . . 0.0 110.842 -178.52 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.609 HD13 ' HB2' ' A' ' 100' ' ' LEU . 1.0 OUTLIER -43.33 103.93 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.343 -179.485 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 15.7 p -71.67 -164.82 0.13 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.773 178.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.1 -34.91 68.8 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.912 0.386 . . . . 0.0 110.808 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -70.69 -50.07 40.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.076 0.465 . . . . 0.0 110.434 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.606 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 66.7 m-20 -66.71 -36.25 82.05 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.641 179.774 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 38.8 m -65.87 -40.78 91.94 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.05 0.452 . . . . 0.0 109.812 178.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.13 -27.11 62.41 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 177.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.675 ' HB3' ' HB ' ' A' ' 115' ' ' VAL . 0.0 OUTLIER -57.1 -59.72 4.67 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 114.044 -1.434 . . . . 0.0 109.642 178.228 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.535 ' HG ' HG23 ' A' ' 115' ' ' VAL . 3.2 mp -61.65 -49.89 74.71 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 178.707 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -44.07 -58.45 2.82 Favored 'General case' 0 CA--C 1.523 -0.086 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.263 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -61.07 -44.42 97.4 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.401 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -62.1 -22.44 65.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.96 179.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.278 -179.66 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 22.1 p-10 . . . . . 0 C--O 1.235 0.337 0 CA-C-O 120.635 0.255 . . . . 0.0 111.302 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.459 ' CD2' ' OG ' ' A' ' 102' ' ' SER . 24.8 m-85 -98.43 139.45 34.15 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 120.841 0.353 . . . . 0.0 110.376 179.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.686 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.4 OUTLIER -112.87 144.74 41.91 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 179.301 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.415 HD22 HD11 ' A' ' 68' ' ' LEU . 14.7 mt -137.62 132.46 33.05 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 114.618 1.34 . . . . 0.0 114.618 -176.399 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.526 ' HB3' ' HB ' ' A' ' 99' ' ' VAL . 4.1 ttp180 -104.78 165.48 11.04 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 105.291 -2.114 . . . . 0.0 105.291 175.137 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.524 ' HA ' ' HA ' ' A' ' 98' ' ' SER . 9.7 p -134.33 164.15 28.05 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 116.235 1.939 . . . . 0.0 116.235 -177.258 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.676 ' C ' ' O ' ' A' ' 97' ' ' ASN . 1.5 t . . . . . 0 C--O 1.237 0.429 0 CA-C-N 111.5 -2.591 . . . . 0.0 107.142 178.148 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.732 ' HB3' ' HB ' ' A' ' 67' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.433 -1.325 0 CA-C-O 121.842 0.83 . . . . 0.0 113.019 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.524 ' HA ' ' HA ' ' A' ' 92' ' ' SER . 1.6 m -152.92 149.91 28.72 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 114.434 -1.257 . . . . 0.0 107.758 178.699 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . 0.526 ' HB ' ' HB3' ' A' ' 91' ' ' ARG . 38.9 t -104.07 156.1 5.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 C-N-CA 120.634 -0.427 . . . . 0.0 111.787 -177.259 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.609 ' HB2' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -109.2 128.14 54.8 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -177.899 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.686 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 17.7 t -141.3 104.31 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.929 0 N-CA-C 104.712 -2.329 . . . . 0.0 104.712 174.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 0.512 ' O ' ' CB ' ' A' ' 103' ' ' LEU . 0.1 OUTLIER -145.78 165.23 29.45 Favored 'General case' 0 C--N 1.311 -1.082 0 C-N-CA 118.495 -1.282 . . . . 0.0 113.788 -174.909 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.512 ' CB ' ' O ' ' A' ' 102' ' ' SER . 0.0 OUTLIER 154.51 -89.36 0.0 OUTLIER 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 113.456 -1.702 . . . . 0.0 111.358 176.896 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.533 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 59.07 21.33 9.26 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 -179.52 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.808 ' HB3' ' O ' ' A' ' 42' ' ' LEU . 5.4 m 140.92 173.26 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.432 1.093 . . . . 0.0 108.612 -178.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.81 102.22 11.78 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 119.986 -0.685 . . . . 0.0 112.545 -178.834 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.549 ' HB2' ' O ' ' A' ' 41' ' ' GLY . 0.0 OUTLIER -168.15 165.06 13.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.4 177.621 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.438 ' CE ' ' CG ' ' A' ' 55' ' ' PHE . 2.1 ttp -165.75 147.45 7.2 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.062 0.458 . . . . 0.0 111.916 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.465 HG21 ' CE1' ' A' ' 39' ' ' PHE . 0.6 OUTLIER -114.7 161.38 18.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.794 178.867 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.686 ' HB3' ' CG2' ' A' ' 16' ' ' VAL . 18.2 mt -50.35 -59.22 4.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.89 0.376 . . . . 0.0 110.61 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . 0.469 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 14.6 tp60 -45.13 -64.63 0.67 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.935 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . 0.865 ' O ' HG22 ' A' ' 115' ' ' VAL . 0.4 OUTLIER -51.31 -38.14 51.4 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-O 121.526 0.679 . . . . 0.0 110.405 179.516 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . 0.421 ' HB3' ' HE1' ' A' ' 108' ' ' MET . . . -55.05 -52.36 63.44 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.116 179.672 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.665 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -79.63 -20.57 46.47 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.824 -178.866 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.865 HG22 ' O ' ' A' ' 112' ' ' ASP . 9.0 m -65.17 -50.63 72.94 Favored 'Isoleucine or valine' 0 C--O 1.244 0.767 0 CA-C-O 122.129 0.966 . . . . 0.0 109.243 179.173 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.531 ' HB2' ' CG2' ' A' ' 59' ' ' VAL . 7.5 mp -69.31 -45.67 68.98 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 114.298 -1.319 . . . . 0.0 109.548 178.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.49 ' HB3' ' HB2' ' A' ' 9' ' ' HIS . 0.1 OUTLIER -68.89 -15.2 63.43 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.805 179.328 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.635 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 8.6 tp10 -74.03 -51.74 14.91 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 106.295 -1.742 . . . . 0.0 106.295 177.101 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . 0.451 ' CB ' ' HG ' ' A' ' 68' ' ' LEU . . . -72.34 -28.8 63.27 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.572 177.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.468 ' HB1' ' O ' ' A' ' 116' ' ' LEU . . . -69.27 -55.16 11.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.98 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.593 ' HG ' ' N ' ' A' ' 122' ' ' ARG . 0.0 OUTLIER -64.24 -48.93 73.92 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.262 -179.73 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.635 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -59.28 -39.88 84.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.906 -179.833 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.453 ' N ' ' HG2' ' A' ' 122' ' ' ARG . 12.0 tm0? -84.84 -34.04 22.74 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -178.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -96.48 -68.4 0.8 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -177.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.22 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -178.219 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . 0.407 ' HB3' HG21 ' A' ' 58' ' ' THR . 0.7 OUTLIER . . . . . 0 N--CA 1.465 0.309 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.459 ' CD1' ' HB2' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -159.69 -46.37 0.05 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.831 0.348 . . . . 0.0 110.983 -179.752 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 169.59 138.65 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.423 -179.855 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.586 HD13 ' CD2' ' A' ' 117' ' ' LEU . 0.0 OUTLIER -55.97 -65.46 0.6 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.739 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p -49.98 -42.8 49.72 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.092 0.405 . . . . 0.0 112.092 -179.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . 0.422 ' O ' ' NE2' ' A' ' 11' ' ' GLN . 1.4 m-20 -73.42 -60.51 2.21 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 121.116 0.484 . . . . 0.0 110.009 179.724 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.528 ' HB3' ' CD2' ' A' ' 117' ' ' LEU . 12.4 tp -47.0 -44.18 20.03 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.394 179.157 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.544 ' HB2' HD22 ' A' ' 117' ' ' LEU . 38.4 t-80 -65.26 -44.84 86.8 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.644 0.735 . . . . 0.0 109.35 178.477 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.8 mmt85 -54.78 -54.67 39.08 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.772 -1.104 . . . . 0.0 111.584 -179.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.422 ' NE2' ' O ' ' A' ' 7' ' ' ASP . 0.0 OUTLIER -65.95 -48.14 72.32 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 120.951 -0.3 . . . . 0.0 111.757 -179.274 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.465 HG13 ' O ' ' A' ' 8' ' ' LEU . 9.6 p -63.52 -49.6 81.89 Favored 'Isoleucine or valine' 0 C--O 1.243 0.725 0 CA-C-O 121.056 0.455 . . . . 0.0 111.266 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.626 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 72.8 m -56.41 -57.88 10.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.38 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.433 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 30.8 ttm180 -59.69 -35.47 74.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.149 0.5 . . . . 0.0 110.628 -179.645 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.416 HD13 HG23 ' A' ' 31' ' ' VAL . 10.6 mt -56.92 -65.33 0.63 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.866 -0.606 . . . . 0.0 112.155 -179.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.535 ' HB ' ' NZ ' ' A' ' 114' ' ' LYS . 1.4 t -70.93 -26.44 27.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 C-N-CA 120.276 -0.57 . . . . 0.0 110.724 -179.429 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.47 ' CG ' ' O ' ' A' ' 13' ' ' SER . 8.1 mm-40 -72.83 -21.87 60.89 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.367 179.596 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.433 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 11.7 pt20 -161.66 60.85 0.26 Allowed 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.767 0.317 . . . . 0.0 111.189 179.323 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 176.39 -61.62 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.778 179.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.422 ' OG ' ' CB ' ' A' ' 33' ' ' ALA . 0.4 OUTLIER -78.43 -81.28 0.1 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.78 0.324 . . . . 0.0 111.647 -179.229 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 106.06 60.32 0.61 Allowed Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.327 -179.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.8 t70 68.76 28.4 5.53 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.783 0.325 . . . . 0.0 111.142 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -91.02 -162.92 0.96 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.369 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.492 ' HA ' ' HB ' ' A' ' 109' ' ' THR . 0.0 OUTLIER -103.96 165.24 11.17 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 179.579 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.502 ' HA2' ' O ' ' A' ' 32' ' ' ALA . . . -133.67 153.02 20.67 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.013 -1.089 . . . . 0.0 113.276 -179.182 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.626 ' HB2' ' CB ' ' A' ' 51' ' ' SER . 0.0 OUTLIER -116.9 131.38 56.97 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 179.491 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.9 tt -105.93 146.75 29.6 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.168 0.509 . . . . 0.0 111.777 -179.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.31 53.94 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.032 -179.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 86.27 -0.65 87.34 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 110.261 -1.135 . . . . 0.0 110.261 -177.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.432 ' C ' ' ND2' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -165.95 165.49 18.05 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 179.683 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.428 ' O ' ' CG2' ' A' ' 31' ' ' VAL . 0.9 OUTLIER -121.02 116.62 50.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 C-N-CA 120.151 -0.62 . . . . 0.0 111.351 179.794 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.502 ' O ' ' HA2' ' A' ' 25' ' ' GLY . . . -104.74 166.99 10.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.596 -179.694 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.422 ' CB ' ' OG ' ' A' ' 20' ' ' SER . . . -102.8 138.42 39.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.345 0.593 . . . . 0.0 111.872 -178.778 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 17.5 t30 -118.98 118.08 30.52 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.487 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.74 -29.79 5.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.226 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -59.38 -44.33 92.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.924 0.392 . . . . 0.0 110.911 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 30.6 p -121.33 -174.86 2.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.711 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 45.3 p -124.0 -115.64 0.29 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.14 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.56 ' CG ' ' N ' ' A' ' 40' ' ' GLN . 0.4 OUTLIER -171.47 -84.81 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.529 179.712 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.56 ' N ' ' CG ' ' A' ' 39' ' ' PHE . 0.5 OUTLIER 80.74 32.26 0.15 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 122.726 0.41 . . . . 0.0 112.001 179.872 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.499 ' CA ' ' HB3' ' A' ' 105' ' ' SER . . . 71.55 -20.11 0.83 Allowed Glycine 0 CA--C 1.526 0.746 0 C-N-CA 121.286 -0.483 . . . . 0.0 113.447 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.622 ' N ' ' NE2' ' A' ' 107' ' ' GLN . 7.0 tp -25.95 140.33 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.292 0.637 . . . . 0.0 112.635 179.175 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -99.15 30.47 3.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.392 -179.799 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.405 ' CD1' ' CE ' ' A' ' 53' ' ' LYS . 1.2 mp 67.5 3.24 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 179.79 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.71 -27.97 23.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.692 0.282 . . . . 0.0 111.475 -179.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' SER . . . . . 0.411 ' CB ' HD12 ' A' ' 42' ' ' LEU . 0.3 OUTLIER -91.32 -36.21 13.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.511 -179.632 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . 0.409 ' N ' HD23 ' A' ' 42' ' ' LEU . . . 156.13 48.49 0.01 OUTLIER Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.368 -0.92 . . . . 0.0 113.163 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.496 ' CB ' ' OE1' ' A' ' 107' ' ' GLN . . . -119.15 -172.46 2.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.851 0.358 . . . . 0.0 110.749 179.566 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -119.69 129.32 54.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.132 179.268 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -43.42 -30.06 0.51 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.96 0.41 . . . . 0.0 111.043 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' SER . . . . . 0.626 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -51.32 -59.92 3.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.303 179.769 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.59 ' CB ' ' HG2' ' A' ' 107' ' ' GLN . 3.3 mm-40 -53.57 -40.07 65.31 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.348 0.594 . . . . 0.0 109.886 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.557 ' HG3' ' HB3' ' A' ' 106' ' ' ASP . 0.1 OUTLIER -62.79 -65.49 0.68 Allowed 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.941 179.254 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.581 HG22 ' O ' ' A' ' 51' ' ' SER . 0.5 OUTLIER -51.37 -40.65 24.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 CA-C-O 120.862 0.363 . . . . 0.0 110.319 179.919 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.495 ' O ' ' OG1' ' A' ' 58' ' ' THR . 0.8 OUTLIER -56.76 -44.86 82.2 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 178.586 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.459 ' O ' ' CD1' ' A' ' 60' ' ' LEU . . . -56.61 -60.21 3.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.145 0.498 . . . . 0.0 109.794 178.56 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.452 ' O ' ' CB ' ' A' ' 61' ' ' SER . 2.0 mm-40 -46.95 -37.38 8.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.323 179.547 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.495 ' OG1' ' O ' ' A' ' 55' ' ' PHE . 26.3 p -66.87 -50.78 61.41 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.608 -179.423 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.654 HG12 HD21 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -62.2 -46.33 96.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 120.187 -0.605 . . . . 0.0 112.349 -179.065 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.571 ' CD2' HD22 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -73.86 -28.48 61.6 Favored 'General case' 0 CA--C 1.515 -0.404 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.412 -179.313 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.452 ' CB ' ' O ' ' A' ' 57' ' ' GLN . 7.0 t -65.26 -54.58 27.22 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.019 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . 0.491 ' CD2' HD21 ' A' ' 5' ' ' LEU . 0.1 OUTLIER -69.06 -20.86 64.11 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 177.894 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.592 ' HA ' HG13 ' A' ' 66' ' ' VAL . 94.3 t -110.73 60.19 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.039 178.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -80.77 21.94 0.63 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.137 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 164.95 -53.08 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.908 0.385 . . . . 0.0 110.387 -179.55 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.592 HG13 ' HA ' ' A' ' 63' ' ' VAL . 27.2 m 43.49 -134.87 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.895 179.727 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.526 ' O ' ' O ' ' A' ' 98' ' ' SER . 3.5 p -156.4 -31.74 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 C-N-CA 120.586 -0.446 . . . . 0.0 111.835 -179.836 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.605 ' HB3' ' HB2' ' A' ' 72' ' ' ASP . 1.1 mt 37.84 98.73 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.434 -0.803 . . . . 0.0 113.052 178.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 33.9 p -73.46 -179.0 3.26 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.236 -0.654 . . . . 0.0 109.236 178.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.49 -34.09 3.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.998 0.428 . . . . 0.0 110.964 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -64.92 -63.06 1.2 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.929 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.605 ' HB2' ' HB3' ' A' ' 68' ' ' LEU . 0.6 OUTLIER -55.86 -39.3 71.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.761 -179.899 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.67 -59.84 4.29 Favored 'General case' 0 C--O 1.241 0.625 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.794 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.496 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . . . -56.9 -28.86 62.43 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 177.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.566 ' HB2' ' HA ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -60.91 -54.82 40.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.651 -1.159 . . . . 0.0 110.412 179.057 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.409 ' HG ' ' CG1' ' A' ' 115' ' ' VAL . 4.0 mp -60.71 -54.09 49.46 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.674 179.651 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.496 ' CD2' ' HA ' ' A' ' 74' ' ' ALA . 3.7 pp -57.88 -29.2 64.85 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 120.462 -0.495 . . . . 0.0 110.583 -179.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 44.4 tt0 -66.26 -59.41 3.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.985 0.421 . . . . 0.0 110.215 179.063 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 84.1 p -57.91 -28.25 64.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.799 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 4.3 m . . . . . 0 C--N 1.331 -0.238 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.284 -179.964 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 30.6 p30 . . . . . 0 C--O 1.236 0.346 0 CA-C-O 120.718 0.294 . . . . 0.0 111.556 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.543 ' CD2' HD11 ' A' ' 100' ' ' LEU . 0.9 OUTLIER -99.06 141.75 31.42 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.226 -179.499 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.664 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.0 OUTLIER -113.42 139.55 48.82 Favored 'General case' 0 N--CA 1.436 -1.157 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 179.945 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 22.8 mt -137.37 147.18 45.31 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 112.909 0.707 . . . . 0.0 112.909 -177.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.439 ' O ' ' CB ' ' A' ' 98' ' ' SER . 25.9 mtm180 -125.32 142.69 51.35 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 177.797 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.402 ' O ' ' CG1' ' A' ' 93' ' ' VAL . 4.0 p -105.3 139.13 40.41 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 113.49 0.922 . . . . 0.0 113.49 -178.567 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.402 ' CG1' ' O ' ' A' ' 92' ' ' SER . 20.5 m . . . . . 0 N--CA 1.444 -0.774 0 CA-C-N 113.674 -1.603 . . . . 0.0 107.641 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.425 ' HB3' ' O ' ' A' ' 67' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.226 -0.17 0 N-CA-C 110.545 -0.168 . . . . 0.0 110.545 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.526 ' O ' ' O ' ' A' ' 67' ' ' VAL . 0.9 OUTLIER -135.78 165.43 25.62 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.523 0.678 . . . . 0.0 111.384 -179.895 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -103.52 148.92 7.88 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.227 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.543 HD11 ' CD2' ' A' ' 88' ' ' TYR . 0.2 OUTLIER -103.72 108.34 19.59 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 -177.699 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.664 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -127.04 106.18 15.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 N-CA-C 104.735 -2.32 . . . . 0.0 104.735 175.378 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 0.569 ' OG ' ' N ' ' A' ' 89' ' ' ASP . 37.2 m -151.49 164.66 36.3 Favored 'General case' 0 C--N 1.309 -1.184 0 C-N-CA 117.922 -1.511 . . . . 0.0 114.776 -174.57 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.571 HD22 ' CD2' ' A' ' 60' ' ' LEU . 0.0 OUTLIER 157.16 -90.92 0.0 OUTLIER 'General case' 0 N--CA 1.435 -1.2 0 CA-C-N 112.877 -1.965 . . . . 0.0 111.745 175.635 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.656 ' O ' ' HB2' ' A' ' 105' ' ' SER . 0.0 OUTLIER 60.74 12.36 3.69 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 120.692 -0.403 . . . . 0.0 109.97 -179.218 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.656 ' HB2' ' O ' ' A' ' 104' ' ' ARG . 0.3 OUTLIER 157.94 162.25 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 -178.948 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.557 ' HB3' ' HG3' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -107.3 101.03 10.44 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 119.482 -0.887 . . . . 0.0 112.793 -179.08 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.622 ' NE2' ' N ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -169.12 164.33 11.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.714 177.033 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.46 ' CE ' ' HA ' ' A' ' 108' ' ' MET . 0.7 OUTLIER -165.16 147.88 8.1 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 179.68 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.523 ' CG2' ' CZ ' ' A' ' 39' ' ' PHE . 2.3 p -107.92 165.22 11.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.751 179.04 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.478 ' HB3' ' CG2' ' A' ' 16' ' ' VAL . 2.6 mt -56.21 -53.2 59.93 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.716 -0.393 . . . . 0.0 110.18 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . 0.554 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 1.1 tp60 -49.22 -65.57 0.54 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.985 0.422 . . . . 0.0 110.089 179.431 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . 0.531 ' O ' ' HB ' ' A' ' 115' ' ' VAL . 0.6 OUTLIER -48.71 -43.34 37.2 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.883 179.201 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . 0.456 ' O ' HD11 ' A' ' 117' ' ' LEU . . . -52.51 -62.7 1.47 Allowed 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.928 179.361 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.626 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -62.65 -26.98 68.91 Favored 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.75 179.975 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.55 ' CG2' ' CG ' ' A' ' 75' ' ' LYS . 59.1 t -56.89 -65.3 0.41 Allowed 'Isoleucine or valine' 0 C--O 1.248 0.99 0 CA-C-O 122.252 1.025 . . . . 0.0 110.495 179.101 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.654 HD21 HG12 ' A' ' 59' ' ' VAL . 0.0 OUTLIER -60.33 -41.43 93.53 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 114.554 -1.203 . . . . 0.0 109.349 -179.7 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.586 ' CD2' HD13 ' A' ' 5' ' ' LEU . 0.2 OUTLIER -67.41 -18.39 65.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.001 179.169 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.636 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 0.9 OUTLIER -73.23 -44.59 59.29 Favored 'General case' 0 CA--C 1.503 -0.845 0 N-CA-C 106.721 -1.585 . . . . 0.0 106.721 177.968 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -78.04 -28.6 49.05 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.106 177.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.526 ' HB3' ' CG2' ' A' ' 63' ' ' VAL . . . -69.37 -53.99 16.75 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.46 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.511 ' HG ' ' N ' ' A' ' 122' ' ' ARG . 0.0 OUTLIER -65.08 -44.47 88.79 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.765 179.869 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.636 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -56.62 -46.2 81.07 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.638 179.819 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 19.9 mm100 -86.96 -28.94 22.41 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -177.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . 0.462 ' CG ' ' O ' ' A' ' 120' ' ' ALA . 0.5 OUTLIER -96.04 -67.03 0.87 Allowed 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 113.761 1.023 . . . . 0.0 113.761 -177.992 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.478 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -177.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . 0.425 ' CB ' ' CG2' ' A' ' 58' ' ' THR . 1.2 p-10 . . . . . 0 N--CA 1.457 -0.116 0 CA-C-O 121.021 0.439 . . . . 0.0 110.88 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.51 ' CD1' ' HB2' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -106.91 -176.01 2.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.238 179.133 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -59.66 -176.91 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.905 0.384 . . . . 0.0 111.109 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.515 ' CD1' ' CD2' ' A' ' 117' ' ' LEU . 0.1 OUTLIER -90.72 -62.77 1.38 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.218 179.718 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.465 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 93.0 p -44.14 -38.51 3.72 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.773 -179.41 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.42 -47.61 32.72 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.878 0.37 . . . . 0.0 110.138 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.516 ' O ' ' HG2' ' A' ' 11' ' ' GLN . 26.9 tp -60.4 -48.71 80.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.117 179.313 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.48 ' HA ' ' CG1' ' A' ' 12' ' ' VAL . 35.9 t-80 -61.99 -40.59 96.15 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 178.654 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.465 ' HB2' ' O ' ' A' ' 6' ' ' SER . 7.8 mtp180 -60.32 -55.13 37.35 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.34 179.815 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.674 ' HG3' ' CG1' ' A' ' 31' ' ' VAL . 2.6 pt20 -60.56 -55.42 33.55 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.643 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.585 ' HA ' ' CD1' ' A' ' 15' ' ' LEU . 14.6 p -56.63 -51.71 62.79 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 CA-C-O 120.854 0.359 . . . . 0.0 111.371 179.774 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.596 ' HA ' ' HE2' ' A' ' 114' ' ' LYS . 44.1 t -65.05 -23.85 67.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 0.0 112.021 -179.669 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -77.54 -40.67 41.76 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 120.721 -0.392 . . . . 0.0 111.429 -179.014 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.585 ' CD1' ' HA ' ' A' ' 12' ' ' VAL . 0.0 OUTLIER -72.0 -46.84 55.73 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 119.472 -0.891 . . . . 0.0 109.224 179.343 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.609 ' HB ' ' CE ' ' A' ' 114' ' ' LYS . 42.0 t -57.84 -55.85 19.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.529 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.433 ' HG2' ' HE3' ' A' ' 114' ' ' LYS . 0.0 OUTLIER -70.5 -6.48 36.41 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.154 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.453 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 7.3 pt20 -171.87 64.47 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.586 -0.446 . . . . 0.0 111.883 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.453 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 1.9 tt0 174.58 -59.62 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.112 179.467 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.409 ' CB ' ' CD1' ' A' ' 110' ' ' LEU . 58.5 m -102.06 -42.32 6.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.402 -179.348 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 94.15 -46.7 2.22 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.643 -0.789 . . . . 0.0 111.766 -179.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.422 ' O ' ' O ' ' A' ' 23' ' ' CYS . 0.0 OUTLIER -176.71 12.5 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 111.636 0.236 . . . . 0.0 111.636 179.794 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.453 ' HB3' ' O ' ' A' ' 34' ' ' ASN . 48.2 m -57.06 -154.08 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.935 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.599 HG21 ' H ' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -104.28 151.13 23.78 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 121.068 0.461 . . . . 0.0 111.061 -179.727 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -104.81 135.97 12.83 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.651 -0.785 . . . . 0.0 113.481 -178.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.728 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 2.5 tmtm? -104.7 120.65 41.84 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.098 -0.705 . . . . 0.0 109.098 179.078 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.452 HD12 ' CD1' ' A' ' 55' ' ' PHE . 0.4 OUTLIER -104.42 145.86 29.67 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.44 0.638 . . . . 0.0 112.578 -178.488 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 162.23 63.97 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.621 179.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.03 -4.45 46.53 Favored Glycine 0 C--N 1.336 0.569 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.098 -177.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.532 ' C ' ' ND2' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -166.36 166.23 16.72 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 -179.927 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.728 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 13.9 p -111.04 143.71 20.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.193 0.52 . . . . 0.0 111.592 178.667 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.596 ' CB ' ' HB3' ' A' ' 26' ' ' LYS . . . -124.9 165.32 18.28 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.538 178.625 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -104.82 115.3 30.07 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -178.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.58 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 33.3 t30 -102.55 136.67 41.95 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.659 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.1 ptmt -154.43 36.32 0.42 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.044 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -115.4 -23.06 9.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.265 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.423 ' O ' ' OG1' ' A' ' 38' ' ' THR . 3.4 m -125.99 -47.72 1.64 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.997 0.427 . . . . 0.0 110.88 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.423 ' OG1' ' O ' ' A' ' 37' ' ' THR . 2.5 p 82.83 86.46 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 122.046 0.927 . . . . 0.0 111.469 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.599 ' H ' HG21 ' A' ' 24' ' ' THR . 2.0 m-85 -82.02 131.85 35.25 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 113.952 -1.477 . . . . 0.0 110.575 179.348 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 2.4 pm0 -115.74 -34.57 4.78 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.439 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.548 ' O ' ' HB2' ' A' ' 105' ' ' SER . . . 151.98 50.75 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 N-CA-C 111.372 -0.691 . . . . 0.0 111.372 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.473 ' HG ' ' N ' ' A' ' 43' ' ' THR . 0.0 OUTLIER -108.14 -173.8 2.37 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.962 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.511 ' O ' ' N ' ' A' ' 45' ' ' ALA . 94.1 m -119.08 67.43 0.79 Allowed 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -178.016 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.402 HG12 ' HE3' ' A' ' 53' ' ' LYS . 1.0 OUTLIER 45.76 5.97 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 178.591 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.511 ' N ' ' O ' ' A' ' 43' ' ' THR . . . -72.0 -57.35 4.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.693 0.282 . . . . 0.0 111.584 -179.145 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' SER . . . . . 0.422 ' H ' ' CD1' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -58.31 -61.31 2.67 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.867 0.365 . . . . 0.0 110.687 -179.773 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -179.69 31.06 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.672 179.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.47 ' CB ' ' OE1' ' A' ' 107' ' ' GLN . . . -80.58 -166.91 1.18 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.014 0.435 . . . . 0.0 111.216 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.537 ' N ' ' OE2' ' A' ' 52' ' ' GLU . 3.2 mmt180 -137.82 -159.15 0.93 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.165 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.514 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 3.6 mp0 -95.17 -30.71 13.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.594 0.235 . . . . 0.0 111.606 -179.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' SER . . . . . 0.554 ' O ' HG22 ' A' ' 54' ' ' VAL . 0.6 OUTLIER -62.04 -45.41 93.67 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.283 -0.417 . . . . 0.0 112.051 -179.228 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.537 ' OE2' ' N ' ' A' ' 49' ' ' ARG . 0.8 OUTLIER -59.28 -65.24 0.7 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.029 0.443 . . . . 0.0 110.294 179.94 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.601 ' HB3' ' O ' ' A' ' 106' ' ' ASP . 0.0 OUTLIER -46.44 -59.44 2.96 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.604 179.648 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.554 HG22 ' O ' ' A' ' 51' ' ' SER . 11.7 m -49.09 -44.12 16.08 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-O 120.988 0.423 . . . . 0.0 110.308 179.561 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.452 ' CD1' HD12 ' A' ' 27' ' ' LEU . 0.4 OUTLIER -53.5 -53.14 55.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.805 178.768 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.07 -46.44 75.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.811 179.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -66.12 -42.25 89.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.221 0.534 . . . . 0.0 110.561 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.425 ' CG2' ' CB ' ' A' ' 2' ' ' ASN . 93.0 m -60.01 -47.54 85.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.956 -179.858 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.505 ' CG2' ' HB2' ' A' ' 116' ' ' LEU . 11.1 p -69.96 -38.03 74.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.853 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.505 ' N ' HG11 ' A' ' 59' ' ' VAL . 4.0 tp -59.29 -37.59 78.06 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 121.146 0.498 . . . . 0.0 109.766 179.551 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 15.5 t -72.2 -52.96 14.08 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.032 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . 0.421 ' HB3' ' CD2' ' A' ' 5' ' ' LEU . 7.2 m-70 -55.49 -35.06 65.15 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 121.092 0.472 . . . . 0.0 110.322 179.573 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.575 HG13 HG13 ' A' ' 66' ' ' VAL . 57.0 t -83.7 -69.97 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.176 179.172 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.493 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 42.82 28.67 0.14 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.605 178.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.493 ' CB ' ' O ' ' A' ' 64' ' ' ALA . 0.7 OUTLIER 157.37 -75.97 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.782 0 CA-C-O 120.709 0.29 . . . . 0.0 111.647 179.853 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.575 HG13 HG13 ' A' ' 63' ' ' VAL . 35.4 m 46.52 -139.25 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.614 -179.475 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.506 ' O ' ' O ' ' A' ' 98' ' ' SER . 3.5 p -158.05 -20.84 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -179.199 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.534 ' HB3' ' HB2' ' A' ' 72' ' ' ASP . 2.0 mp 36.68 90.13 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 179.705 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 30.5 p -67.18 -173.69 0.29 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 179.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.5 -30.49 8.43 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.954 0.406 . . . . 0.0 110.749 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.09 -65.04 0.72 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.691 179.661 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.534 ' HB2' ' HB3' ' A' ' 68' ' ' LEU . 0.9 OUTLIER -54.95 -35.06 63.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.978 -179.942 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.0 m -59.36 -61.69 2.44 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 109.125 -0.695 . . . . 0.0 109.125 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.522 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . . . -56.86 -26.24 58.24 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 121.501 0.667 . . . . 0.0 109.241 177.744 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.546 ' HB3' ' CG1' ' A' ' 115' ' ' VAL . 1.0 OUTLIER -62.18 -62.32 1.85 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.718 -1.128 . . . . 0.0 111.005 179.4 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.433 ' HG ' HG11 ' A' ' 115' ' ' VAL . 0.6 OUTLIER -59.33 -49.52 77.5 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.691 179.891 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.522 ' CD2' ' HA ' ' A' ' 74' ' ' ALA . 1.5 pp -61.16 -29.43 69.78 Favored 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.222 179.653 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.1 -56.95 11.28 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 178.73 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.13 -29.2 67.23 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.289 179.113 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 51.6 m . . . . . 0 C--N 1.331 -0.214 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.181 179.945 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . 0.489 ' CB ' ' HA3' ' A' ' 41' ' ' GLY . 0.6 OUTLIER . . . . . 0 C--O 1.251 1.162 0 CA-C-O 121.051 0.453 . . . . 0.0 111.006 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 1.344 ' HA ' ' OG ' ' A' ' 102' ' ' SER . 95.0 m-85 -99.13 125.42 44.66 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 115.608 -0.724 . . . . 0.0 112.179 -178.353 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.655 ' HB3' ' O ' ' A' ' 101' ' ' VAL . 0.7 OUTLIER -104.64 136.54 43.98 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 -179.966 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.443 HD23 ' O ' ' A' ' 99' ' ' VAL . 30.6 mt -129.48 155.08 46.3 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 -176.352 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.689 ' O ' ' CB ' ' A' ' 98' ' ' SER . 0.0 OUTLIER -132.31 161.71 32.86 Favored 'General case' 0 C--O 1.215 -0.746 0 CA-C-N 114.703 -1.135 . . . . 0.0 108.558 177.585 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.444 ' O ' ' CG1' ' A' ' 93' ' ' VAL . 22.9 p -103.64 158.64 16.23 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.882 0.849 . . . . 0.0 112.676 -178.87 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.576 ' O ' ' O ' ' A' ' 97' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.437 -1.117 0 CA-C-N 113.695 -1.593 . . . . 0.0 107.884 -179.141 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.576 ' O ' ' O ' ' A' ' 93' ' ' VAL . 0.4 OUTLIER . . . . . 0 N--CA 1.454 -0.264 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.689 ' CB ' ' O ' ' A' ' 91' ' ' ARG . 0.2 OUTLIER -139.27 164.98 28.39 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.294 0.569 . . . . 0.0 110.784 179.772 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . 0.457 HG11 ' HB2' ' A' ' 91' ' ' ARG . 0.5 OUTLIER -104.2 152.25 6.57 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.292 179.636 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.559 ' CD2' HG11 ' A' ' 63' ' ' VAL . 7.5 tp -103.19 105.24 15.48 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 121.638 0.732 . . . . 0.0 112.56 -178.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.655 ' O ' ' HB3' ' A' ' 89' ' ' ASP . 1.6 p -123.68 110.04 24.8 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.96 0 N-CA-C 104.982 -2.229 . . . . 0.0 104.982 175.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 1.344 ' OG ' ' HA ' ' A' ' 88' ' ' TYR . 2.5 t -166.85 166.79 15.42 Favored 'General case' 0 CA--C 1.495 -1.171 0 N-CA-C 115.27 1.582 . . . . 0.0 115.27 -174.178 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.637 ' O ' ' C ' ' A' ' 104' ' ' ARG . 0.1 OUTLIER 168.99 -45.41 0.01 OUTLIER 'General case' 0 N--CA 1.435 -1.215 0 CA-C-N 113.721 -1.581 . . . . 0.0 112.09 174.032 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.637 ' C ' ' O ' ' A' ' 103' ' ' LEU . 0.0 OUTLIER 16.1 81.25 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.671 0 O-C-N 123.58 0.55 . . . . 0.0 110.044 178.457 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.548 ' HB2' ' O ' ' A' ' 41' ' ' GLY . 0.7 OUTLIER 86.02 -166.43 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 -176.28 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.601 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -132.42 101.74 5.46 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 119.989 -0.684 . . . . 0.0 110.629 179.368 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.55 ' HG2' ' HB3' ' A' ' 39' ' ' PHE . 1.5 mt-30 -169.13 165.51 11.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.441 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.492 ' HE3' HD23 ' A' ' 116' ' ' LEU . 0.7 OUTLIER -159.87 143.09 14.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.488 0.661 . . . . 0.0 112.588 178.505 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.51 HG23 ' HA ' ' A' ' 24' ' ' THR . 0.2 OUTLIER -104.31 164.77 11.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.572 -1.195 . . . . 0.0 109.048 178.31 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.53 ' HB3' ' CG2' ' A' ' 16' ' ' VAL . 2.4 mt -57.32 -51.77 68.03 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.708 0.289 . . . . 0.0 111.044 -179.368 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . 0.434 ' NE2' ' CD ' ' A' ' 114' ' ' LYS . 0.1 OUTLIER -54.7 -61.45 2.3 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.576 179.364 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . 0.498 ' HA ' HG22 ' A' ' 115' ' ' VAL . 11.7 m-20 -44.07 -53.81 6.04 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-O 121.074 0.464 . . . . 0.0 111.295 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . 0.466 ' O ' HD12 ' A' ' 117' ' ' LEU . . . -49.92 -60.27 3.08 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.188 179.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.609 ' CE ' ' HB ' ' A' ' 16' ' ' VAL . 0.2 OUTLIER -54.02 -32.49 54.45 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.414 179.473 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.546 ' CG1' ' HB3' ' A' ' 75' ' ' LYS . 48.1 t -61.99 -65.36 0.51 Allowed 'Isoleucine or valine' 0 C--O 1.241 0.63 0 CA-C-O 121.737 0.78 . . . . 0.0 111.912 -178.518 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.509 ' O ' ' HB2' ' A' ' 120' ' ' ALA . 0.3 OUTLIER -63.32 -34.12 77.0 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.298 -178.941 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.515 ' CD2' ' CD1' ' A' ' 5' ' ' LEU . 0.6 OUTLIER -73.15 -21.92 60.61 Favored 'General case' 0 CA--C 1.512 -0.498 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.549 178.898 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.554 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 6.5 tp10 -70.17 -46.89 63.7 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 106.267 -1.753 . . . . 0.0 106.267 177.134 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . 0.44 ' CB ' ' HG ' ' A' ' 68' ' ' LEU . . . -74.36 -24.25 59.14 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.085 -1.416 . . . . 0.0 110.236 177.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.509 ' HB2' ' O ' ' A' ' 116' ' ' LEU . . . -77.01 -50.72 12.49 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.471 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.48 ' HB3' ' O ' ' A' ' 117' ' ' LEU . 0.0 OUTLIER -62.68 -38.88 92.09 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.715 179.383 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.554 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.1 OUTLIER -73.7 -38.34 64.89 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.313 -179.558 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.406 ' HB2' ' O ' ' A' ' 119' ' ' ALA . 29.6 mm100 -89.89 -24.88 21.24 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -178.033 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -84.72 -66.97 0.83 Allowed 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.415 -179.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 9.5 t . . . . . 0 C--N 1.324 -0.507 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.363 -179.926 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 6.5 p30 . . . . . 0 CA--C 1.529 0.162 0 CA-C-O 120.734 0.302 . . . . 0.0 110.765 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.4 mp -85.49 -99.29 0.06 Allowed 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.735 179.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.418 ' O ' ' CB ' ' A' ' 8' ' ' LEU . 1.4 m -168.33 161.05 11.84 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 179.672 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.528 ' HA ' HD23 ' A' ' 117' ' ' LEU . 21.7 mt -56.82 -65.08 0.68 Allowed 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 121.37 0.605 . . . . 0.0 111.002 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.8 t -46.71 -45.4 19.47 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-N 115.165 -0.925 . . . . 0.0 112.091 -178.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.23 -64.5 1.12 Allowed 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.805 0.336 . . . . 0.0 110.65 -179.682 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.449 ' CD2' HD21 ' A' ' 117' ' ' LEU . 5.6 tp -44.27 -42.35 6.57 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.258 179.351 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.461 ' CD2' ' CD2' ' A' ' 121' ' ' LEU . 85.0 t60 -70.51 -44.19 68.13 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.325 178.364 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.3 mmt180 -55.67 -53.66 53.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.768 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.512 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -63.46 -54.78 31.19 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 120.885 -0.326 . . . . 0.0 111.253 -179.88 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.555 ' HA ' HD13 ' A' ' 15' ' ' LEU . 13.2 p -54.19 -48.58 66.1 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 CA-C-O 121.189 0.519 . . . . 0.0 110.942 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.623 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 60.8 m -62.96 -33.78 76.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.484 -0.78 . . . . 0.0 112.101 -179.519 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.28 -29.0 61.46 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.318 -179.295 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.555 HD13 ' HA ' ' A' ' 12' ' ' VAL . 0.5 OUTLIER -75.84 -50.77 14.16 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.517 179.628 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.851 ' CG2' ' HB3' ' A' ' 110' ' ' LEU . 69.6 t -66.71 -54.42 25.6 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.408 0 CA-C-O 121.202 0.525 . . . . 0.0 111.519 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -63.23 -8.59 8.61 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.767 -178.46 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -141.88 25.12 1.98 Allowed 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 120.996 -0.282 . . . . 0.0 111.594 179.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.453 ' N ' ' O ' ' A' ' 15' ' ' LEU . 3.8 tt0 179.73 -69.93 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.534 ' HB3' ' HB2' ' A' ' 23' ' ' CYS . 0.7 OUTLIER -83.44 68.83 9.89 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.992 0.425 . . . . 0.0 111.917 -178.161 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -36.41 -34.55 0.09 OUTLIER Glycine 0 CA--C 1.521 0.441 0 CA-C-N 115.73 -0.668 . . . . 0.0 114.009 -179.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -166.57 9.04 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -179.508 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.534 ' HB2' ' HB3' ' A' ' 20' ' ' SER . 96.2 m -53.72 -171.26 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.708 0.289 . . . . 0.0 110.819 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.448 ' CG2' ' HB3' ' A' ' 39' ' ' PHE . 8.2 m -103.57 148.04 26.46 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 179.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -104.51 144.23 15.8 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.095 -1.05 . . . . 0.0 113.507 -178.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.493 ' HB2' ' CB ' ' A' ' 51' ' ' SER . 0.0 OUTLIER -112.35 126.45 55.29 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 179.17 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.415 HD11 ' CD1' ' A' ' 55' ' ' PHE . 0.4 OUTLIER -104.67 144.2 32.05 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.308 0.575 . . . . 0.0 111.893 -178.846 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.12 57.28 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.135 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 84.52 -2.25 88.13 Favored Glycine 0 N--CA 1.451 -0.35 0 N-CA-C 111.129 -0.788 . . . . 0.0 111.129 -177.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.433 ' C ' ' ND2' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -166.45 165.5 16.97 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 179.731 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.436 HG23 ' N ' ' A' ' 12' ' ' VAL . 1.3 m -119.78 117.8 54.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 C-N-CA 119.857 -0.737 . . . . 0.0 111.487 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.403 ' CB ' ' CG ' ' A' ' 26' ' ' LYS . . . -108.26 166.87 10.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.111 -179.296 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.414 ' CB ' HD11 ' A' ' 110' ' ' LEU . . . -103.33 132.24 49.75 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.221 0.534 . . . . 0.0 111.485 -179.305 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -115.33 121.24 42.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.67 -179.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.5 tttt -113.69 -10.88 13.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.512 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -79.91 -66.78 0.83 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.781 0.324 . . . . 0.0 111.27 -179.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.6 168.93 17.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.332 -179.531 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 61.6 p -131.48 114.58 15.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.496 179.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.502 ' CG ' ' N ' ' A' ' 40' ' ' GLN . 0.0 OUTLIER -79.59 -179.72 7.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.19 -179.586 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.502 ' N ' ' CG ' ' A' ' 39' ' ' PHE . 0.8 OUTLIER 165.63 36.28 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.512 179.716 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.468 ' C ' ' HB2' ' A' ' 107' ' ' GLN . . . 89.37 -34.83 3.86 Favored Glycine 0 CA--C 1.52 0.375 0 CA-C-N 115.76 -0.655 . . . . 0.0 112.367 -179.33 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.513 ' O ' ' HB2' ' A' ' 107' ' ' GLN . 0.4 OUTLIER -21.0 139.51 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.404 0.681 . . . . 0.0 112.785 179.579 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.9 27.41 1.82 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.599 -179.791 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.45 ' HA ' ' HB1' ' A' ' 48' ' ' ALA . 8.7 mm 65.65 5.6 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -87.24 -29.12 21.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.777 0.322 . . . . 0.0 111.439 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.3 t -87.21 -32.52 19.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.081 -179.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.41 40.16 0.03 OUTLIER Glycine 0 CA--C 1.518 0.281 0 C-N-CA 120.462 -0.875 . . . . 0.0 113.197 179.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.45 ' HB1' ' HA ' ' A' ' 44' ' ' ILE . . . -106.86 169.28 8.64 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.841 0.32 . . . . 0.0 110.846 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 14.9 mtp180 -87.98 132.13 34.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.844 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -52.12 -30.46 26.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.056 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' SER . . . . . 0.493 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 19.5 p -61.31 -55.11 35.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.969 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.502 ' CB ' ' HG2' ' A' ' 107' ' ' GLN . 13.8 mt-10 -51.6 -44.36 62.81 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.082 0.468 . . . . 0.0 110.411 179.733 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.422 ' HG3' ' HB3' ' A' ' 106' ' ' ASP . 0.1 OUTLIER -56.57 -62.52 1.67 Allowed 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.33 178.945 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 33.5 t -49.81 -32.04 7.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 121.167 0.508 . . . . 0.0 110.33 179.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.445 ' HB3' ' HB3' ' A' ' 108' ' ' MET . 0.1 OUTLIER -64.98 -48.02 75.47 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.362 179.306 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.27 -39.12 81.89 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-O 121.028 0.442 . . . . 0.0 110.061 179.118 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.1 mm-40 -69.21 -33.85 73.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.943 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 48.3 m -75.59 -50.97 13.94 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 120.911 0.386 . . . . 0.0 110.505 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.0 m -62.75 -37.33 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.694 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.9 tp -70.14 -44.51 68.71 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.556 179.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 74.8 m -60.85 -62.23 2.01 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.612 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . 0.433 ' CG ' HD22 ' A' ' 5' ' ' LEU . 1.9 m-70 -49.33 -43.27 43.52 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 121.08 0.467 . . . . 0.0 110.703 -179.768 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.529 HG11 HG12 ' A' ' 66' ' ' VAL . 67.7 t -74.2 -80.15 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.242 179.228 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . 75.21 -26.02 0.2 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.358 -0.383 . . . . 0.0 112.005 179.389 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.432 ' H ' ' C ' ' A' ' 63' ' ' VAL . 1.5 p30 -170.03 -51.99 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.065 0.46 . . . . 0.0 110.396 -179.197 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.67 HG13 ' HA ' ' A' ' 120' ' ' ALA . 35.9 m 46.56 -139.72 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.555 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.532 ' O ' ' O ' ' A' ' 98' ' ' SER . 3.4 p -153.47 -24.85 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 N-CA-C 113.367 0.876 . . . . 0.0 113.367 -179.259 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.456 HD11 ' HB2' ' A' ' 100' ' ' LEU . 1.5 mp 34.07 98.42 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 112.659 0.615 . . . . 0.0 112.659 179.432 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.422 ' O ' ' O ' ' A' ' 68' ' ' LEU . 68.8 p -60.66 -122.94 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 179.081 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.35 -39.54 9.98 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.347 0.594 . . . . 0.0 109.869 179.139 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.492 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 2.1 tt0 -59.6 -64.92 0.77 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.215 -179.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.546 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 96.1 m-20 -52.44 -33.14 42.77 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.237 -179.676 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 97.8 m -61.62 -63.9 1.12 Allowed 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.66 -24.25 60.84 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 177.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.567 ' CG ' ' CG2' ' A' ' 115' ' ' VAL . 0.2 OUTLIER -59.23 -65.09 0.72 Allowed 'General case' 0 C--O 1.234 0.261 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.428 179.017 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.522 HD13 HG11 ' A' ' 115' ' ' VAL . 0.4 OUTLIER -58.55 -38.92 78.84 Favored 'General case' 0 CA--C 1.52 -0.206 0 N-CA-C 109.425 -0.584 . . . . 0.0 109.425 178.981 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -50.75 -49.83 57.1 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.726 179.648 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -67.36 -53.04 33.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.878 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.33 -21.54 59.93 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.161 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 45.8 m . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.145 -179.819 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 16.5 p-10 . . . . . 0 C--O 1.234 0.269 0 N-CA-C 111.457 0.169 . . . . 0.0 111.457 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.742 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 1.3 m-85 -103.05 137.28 41.44 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.691 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.676 ' O ' ' O ' ' A' ' 101' ' ' VAL . 0.4 OUTLIER -105.1 140.84 37.67 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 121.958 0.885 . . . . 0.0 110.921 -177.597 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.504 HD22 HD11 ' A' ' 76' ' ' LEU . 11.3 mt -132.2 150.1 52.23 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.137 -0.938 . . . . 0.0 113.134 -178.027 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.453 ' O ' ' CB ' ' A' ' 98' ' ' SER . 0.0 OUTLIER -137.18 148.99 46.94 Favored 'General case' 0 C--O 1.219 -0.534 0 N-CA-C 107.67 -1.234 . . . . 0.0 107.67 177.551 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.477 ' HA ' ' HA ' ' A' ' 98' ' ' SER . 11.4 p -111.26 141.88 44.2 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 -178.384 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.424 ' CG1' ' O ' ' A' ' 92' ' ' SER . 15.9 m . . . . . 0 N--CA 1.448 -0.565 0 CA-C-N 113.848 -1.524 . . . . 0.0 108.283 178.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.225 0 CA-C-O 120.555 0.216 . . . . 0.0 110.616 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.532 ' O ' ' O ' ' A' ' 67' ' ' VAL . 0.2 OUTLIER -133.1 165.57 24.45 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.518 0.675 . . . . 0.0 111.122 -179.981 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -103.93 140.04 23.19 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 179.087 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.53 HD21 ' CD1' ' A' ' 116' ' ' LEU . 8.7 tp -104.29 106.37 16.84 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -178.2 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.676 ' O ' ' O ' ' A' ' 89' ' ' ASP . 0.5 OUTLIER -122.48 123.05 67.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 104.741 -2.318 . . . . 0.0 104.741 176.361 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 0.742 ' HB2' ' HA ' ' A' ' 88' ' ' TYR . 72.2 p -165.31 166.79 18.44 Favored 'General case' 0 C--N 1.312 -1.06 0 C-N-CA 116.876 -1.93 . . . . 0.0 116.161 -173.782 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.498 HD23 ' O ' ' A' ' 102' ' ' SER . 0.1 OUTLIER 161.5 -89.73 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 112.815 -1.993 . . . . 0.0 111.789 175.52 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.573 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 52.75 40.16 29.95 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 -179.729 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.573 ' CB ' ' O ' ' A' ' 104' ' ' ARG . 57.7 m 116.64 156.65 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.392 1.077 . . . . 0.0 108.298 -177.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.422 ' HB3' ' HG3' ' A' ' 53' ' ' LYS . 1.5 m-20 -104.92 102.55 12.07 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -178.27 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.513 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 0.7 OUTLIER -167.65 148.55 5.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.058 177.522 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.588 ' CE ' ' CZ ' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -143.72 159.22 42.88 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -179.98 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.461 HG21 ' CZ ' ' A' ' 39' ' ' PHE . 1.2 t -117.5 160.82 20.59 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.405 -1.27 . . . . 0.0 109.409 179.133 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.851 ' HB3' ' CG2' ' A' ' 16' ' ' VAL . 1.0 OUTLIER -50.24 -55.92 13.29 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 120.732 0.301 . . . . 0.0 111.284 -179.502 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . 0.588 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 0.2 OUTLIER -50.37 -65.36 0.57 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.243 -179.853 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . 0.562 ' HA ' HG23 ' A' ' 115' ' ' VAL . 11.5 m-20 -47.64 -55.46 9.33 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.88 0.371 . . . . 0.0 110.986 -179.58 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -42.39 -59.04 1.98 Allowed 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.104 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.648 ' HE2' ' HB ' ' A' ' 16' ' ' VAL . 0.0 OUTLIER -63.26 -34.62 78.07 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.084 179.894 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.567 ' CG2' ' CG ' ' A' ' 75' ' ' LYS . 93.3 t -52.48 -65.37 0.3 Allowed 'Isoleucine or valine' 0 C--O 1.248 1.009 0 CA-C-O 122.127 0.965 . . . . 0.0 111.342 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.53 ' CD1' HD21 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -61.35 -42.94 99.51 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 114.485 -1.234 . . . . 0.0 110.237 -178.876 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.528 HD23 ' HA ' ' A' ' 5' ' ' LEU . 0.2 OUTLIER -68.09 -16.1 63.87 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.245 179.952 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.56 ' HA ' HD22 ' A' ' 121' ' ' LEU . 2.7 tm-20 -72.15 -56.58 5.33 Favored 'General case' 0 N--CA 1.438 -1.06 0 N-CA-C 105.453 -2.055 . . . . 0.0 105.453 176.53 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . 0.465 ' HA ' ' CD ' ' A' ' 122' ' ' ARG . . . -64.24 -33.98 77.05 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 114.166 -1.379 . . . . 0.0 110.866 177.725 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.67 ' HA ' HG13 ' A' ' 66' ' ' VAL . . . -64.16 -57.88 8.25 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.035 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.611 ' HG ' ' N ' ' A' ' 122' ' ' ARG . 0.1 OUTLIER -56.87 -45.81 82.24 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.997 -179.324 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.611 ' N ' ' HG ' ' A' ' 121' ' ' LEU . 0.0 OUTLIER -63.1 -65.7 0.65 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 119.549 -0.861 . . . . 0.0 111.97 -179.823 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -53.65 -29.79 40.08 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.177 -0.92 . . . . 0.0 113.041 -178.302 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . 0.41 ' CG ' ' O ' ' A' ' 120' ' ' ALA . 4.6 mm-40 -95.11 -66.24 0.93 Allowed 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -178.685 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.327 -0.389 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -178.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . 0.437 ' ND2' ' CE1' ' A' ' 62' ' ' HIS . 8.6 p-10 . . . . . 0 CA--C 1.536 0.441 0 N-CA-C 111.68 0.252 . . . . 0.0 111.68 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.585 ' CD1' ' N ' ' A' ' 3' ' ' LEU . 0.6 OUTLIER -99.9 16.37 24.04 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.457 0.17 . . . . 0.0 111.428 -179.342 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.1 m 72.79 -166.6 0.12 Allowed 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -178.568 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.427 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 7.7 mt -95.51 -64.89 1.01 Allowed 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.234 0.54 . . . . 0.0 111.916 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.9 p -45.19 -47.07 12.51 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.297 -0.865 . . . . 0.0 112.367 -178.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . 0.418 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 0.6 OUTLIER -73.4 -64.56 0.96 Allowed 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 120.857 0.361 . . . . 0.0 110.078 179.73 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.439 ' O ' HG12 ' A' ' 12' ' ' VAL . 14.5 tp -41.39 -47.5 3.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.363 179.134 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.441 ' CG ' HD22 ' A' ' 121' ' ' LEU . 32.6 t-80 -64.97 -43.87 91.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.614 178.538 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.418 ' HB2' ' O ' ' A' ' 7' ' ' ASP . 3.4 mmt-85 -53.68 -54.08 42.98 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.995 -1.002 . . . . 0.0 111.586 -179.634 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.556 HE21 HD22 ' A' ' 3' ' ' LEU . 1.0 OUTLIER -67.72 -51.27 51.28 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.518 -179.505 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.492 HG11 ' CB ' ' A' ' 114' ' ' LYS . 11.0 p -57.69 -44.36 85.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 CA-C-O 121.137 0.494 . . . . 0.0 110.644 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.762 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 95.0 p -62.84 -51.63 66.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.727 179.417 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.471 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 1.0 OUTLIER -66.64 -17.6 64.93 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.934 179.977 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.9 mt -79.6 -59.62 2.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.709 -179.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.496 ' HB ' ' NZ ' ' A' ' 114' ' ' LYS . 1.0 OUTLIER -71.42 -27.66 29.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 C-N-CA 120.904 -0.319 . . . . 0.0 110.92 -179.798 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.414 ' HB2' ' O ' ' A' ' 13' ' ' SER . 5.6 mm-40 -74.98 -13.97 60.57 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.804 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.471 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 10.5 pt20 -170.48 62.53 0.04 OUTLIER 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.78 0.324 . . . . 0.0 111.167 179.498 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 173.12 -60.11 0.01 OUTLIER 'General case' 0 C--O 1.232 0.16 0 CA-C-O 120.835 0.35 . . . . 0.0 111.37 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.484 ' HB2' ' HA ' ' A' ' 16' ' ' VAL . 15.0 m -85.2 -36.85 20.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.603 -179.237 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 55.95 71.83 0.67 Allowed Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.335 -179.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 53.77 97.05 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.967 0.413 . . . . 0.0 110.881 -179.751 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.405 ' O ' HG23 ' A' ' 109' ' ' THR . 0.2 OUTLIER -161.82 -161.25 0.76 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.021 -179.731 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.513 ' HA ' ' HA ' ' A' ' 109' ' ' THR . 35.4 m -104.1 136.73 43.19 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.336 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.453 ' CA ' ' HG ' ' A' ' 110' ' ' LEU . . . -104.8 140.83 15.15 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.407 -0.901 . . . . 0.0 113.554 -178.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.578 ' HB2' ' CB ' ' A' ' 51' ' ' SER . 0.0 OUTLIER -104.95 133.65 49.38 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.194 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.424 ' HB2' ' CG ' ' A' ' 55' ' ' PHE . 1.2 tt -104.72 148.87 26.11 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.327 0.584 . . . . 0.0 111.927 -179.252 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 169.01 58.37 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 114.993 -1.003 . . . . 0.0 108.969 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.3 6.07 64.38 Favored Glycine 0 CA--C 1.52 0.358 0 N-CA-C 110.424 -1.071 . . . . 0.0 110.424 -177.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.554 ' HA ' ' CD2' ' A' ' 3' ' ' LEU . 0.0 OUTLIER -166.36 165.15 17.37 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 -179.74 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.432 HG11 ' CG ' ' A' ' 11' ' ' GLN . 0.8 OUTLIER -119.54 122.85 69.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.399 0.618 . . . . 0.0 111.234 179.021 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.478 ' CB ' ' HG3' ' A' ' 26' ' ' LYS . . . -111.91 166.04 11.56 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.313 179.528 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.415 ' CB ' ' OG ' ' A' ' 20' ' ' SER . . . -103.73 142.68 33.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.318 0.58 . . . . 0.0 112.176 -178.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.477 HD21 ' HB ' ' A' ' 24' ' ' THR . 6.7 t30 -126.96 120.2 28.52 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.1 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.05 21.61 3.49 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.99 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -106.08 -23.98 12.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.192 -179.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 12.3 t -135.7 -176.54 4.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.095 0.474 . . . . 0.0 111.615 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.594 ' O ' ' NE2' ' A' ' 40' ' ' GLN . 41.5 p -120.66 126.53 50.46 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.24 -179.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.695 ' O ' ' HB2' ' A' ' 42' ' ' LEU . 3.2 p90 -81.87 -43.28 18.41 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.132 -179.559 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.594 ' NE2' ' O ' ' A' ' 38' ' ' THR . 0.8 OUTLIER 21.09 69.85 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.17 0.988 . . . . 0.0 113.164 -179.669 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.567 ' O ' ' HB2' ' A' ' 105' ' ' SER . . . 36.72 46.02 1.09 Allowed Glycine 0 C--O 1.226 -0.391 0 C-N-CA 120.907 -0.664 . . . . 0.0 112.313 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.704 ' HB3' ' OE1' ' A' ' 107' ' ' GLN . 1.3 tp -85.06 -156.93 0.27 Allowed 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.491 HG23 ' HB2' ' A' ' 106' ' ' ASP . 0.2 OUTLIER -155.93 31.67 0.35 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.238 0.542 . . . . 0.0 111.197 179.81 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.537 ' CD1' ' HD2' ' A' ' 53' ' ' LYS . 4.7 mp 54.23 5.17 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.656 179.296 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.457 ' H ' ' C ' ' A' ' 43' ' ' THR . . . -87.8 -22.85 24.28 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.931 0.396 . . . . 0.0 110.672 179.556 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -108.34 -28.06 9.62 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.0 179.846 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 160.12 73.3 0.02 OUTLIER Glycine 0 C--N 1.333 0.398 0 C-N-CA 120.295 -0.955 . . . . 0.0 113.512 179.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.463 ' HB2' ' HA ' ' A' ' 44' ' ' ILE . . . -152.53 174.33 14.05 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.836 0.35 . . . . 0.0 111.245 179.136 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -105.52 147.45 28.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.611 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.454 ' HA ' ' CD ' ' A' ' 53' ' ' LYS . 33.1 tt0 -50.34 -39.99 47.81 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.265 0.555 . . . . 0.0 110.861 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' SER . . . . . 0.578 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 2.8 p -48.32 -55.17 11.34 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.189 179.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -40.52 -62.46 0.77 Allowed 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 120.794 0.33 . . . . 0.0 111.04 179.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.638 ' HG2' ' N ' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -54.02 -40.11 66.75 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.713 179.513 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.638 ' N ' ' HG2' ' A' ' 53' ' ' LYS . 40.7 t -63.33 -43.37 98.57 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.197 0 CA-C-O 121.192 0.52 . . . . 0.0 110.017 179.76 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.424 ' CG ' ' HB2' ' A' ' 27' ' ' LEU . 0.1 OUTLIER -63.82 -32.91 74.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.334 179.386 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.56 -59.18 3.33 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.035 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -56.48 -37.46 70.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.813 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 7.5 p -64.71 -60.58 2.94 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.74 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.51 ' CG2' ' HB2' ' A' ' 116' ' ' LEU . 10.1 p -62.29 -45.01 99.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.78 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.3 tp -56.06 -39.23 71.75 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 120.972 0.415 . . . . 0.0 110.282 179.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 44.1 m -65.24 -59.08 4.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.131 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . 0.437 ' CE1' ' ND2' ' A' ' 2' ' ' ASN . 9.8 m170 -54.52 -42.81 71.27 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 121.186 0.517 . . . . 0.0 110.111 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.584 HG12 HG13 ' A' ' 66' ' ' VAL . 2.7 t -88.52 54.14 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.443 179.368 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.453 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . -84.16 36.94 0.59 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.292 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.453 ' CB ' ' O ' ' A' ' 64' ' ' ALA . 0.8 OUTLIER 156.8 -62.99 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 122.744 0.417 . . . . 0.0 110.825 -179.757 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.584 HG13 HG12 ' A' ' 63' ' ' VAL . 33.3 m 40.73 -147.91 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.983 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.527 ' O ' ' O ' ' A' ' 98' ' ' SER . 4.9 p -149.62 -25.88 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -179.393 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.549 ' HB3' ' HB2' ' A' ' 72' ' ' ASP . 0.6 OUTLIER 32.75 88.94 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.616 0.598 . . . . 0.0 112.616 178.933 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.627 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 0.9 OUTLIER -75.13 -169.77 1.01 Allowed 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.694 -0.403 . . . . 0.0 110.729 179.508 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -40.28 -41.32 1.31 Allowed 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.2 -0.454 . . . . 0.0 112.162 -179.284 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.78 -65.11 0.74 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.086 -179.743 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.549 ' HB2' ' HB3' ' A' ' 68' ' ' LEU . 55.0 m-20 -58.47 -44.8 89.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.249 -179.613 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.512 ' HA ' HD23 ' A' ' 76' ' ' LEU . 0.6 OUTLIER -48.93 -57.98 5.6 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.547 0.689 . . . . 0.0 109.659 178.83 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.67 -27.22 68.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.059 -0.973 . . . . 0.0 108.87 177.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.547 ' HB2' ' HA ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -63.76 -46.57 84.71 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.935 -1.029 . . . . 0.0 109.227 178.436 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.642 HD12 HG13 ' A' ' 115' ' ' VAL . 1.4 mm? -61.06 -59.84 4.71 Favored 'General case' 0 C--N 1.343 0.284 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 178.078 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 73' ' ' THR . 5.9 mt -55.19 -30.87 60.8 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.906 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -64.13 -51.99 61.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.303 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' SER . . . . . 0.434 ' CB ' ' HG2' ' A' ' 111' ' ' GLN . 0.3 OUTLIER -68.31 -26.43 65.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.257 179.851 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.426 ' HB ' ' CE2' ' A' ' 88' ' ' TYR . 0.6 OUTLIER . . . . . 0 C--N 1.331 -0.239 0 CA-C-O 120.734 0.302 . . . . 0.0 111.33 -179.519 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . 0.401 ' OD1' ' CE1' ' A' ' 88' ' ' TYR . 12.4 p-10 . . . . . 0 C--O 1.235 0.335 0 N-CA-C 111.634 0.235 . . . . 0.0 111.634 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.535 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 0.1 OUTLIER -106.38 153.87 21.61 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.24 0.543 . . . . 0.0 111.118 -179.877 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.652 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.4 OUTLIER -120.12 150.06 41.22 Favored 'General case' 0 N--CA 1.435 -1.177 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -179.208 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.473 ' CD1' ' HG ' ' A' ' 76' ' ' LEU . 49.3 mt -142.21 161.64 37.49 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -177.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.455 ' O ' ' OG ' ' A' ' 98' ' ' SER . 0.0 OUTLIER -134.4 133.65 40.78 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 114.334 -1.303 . . . . 0.0 107.9 177.716 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.467 ' O ' ' CG1' ' A' ' 93' ' ' VAL . 90.4 p -104.33 150.41 24.5 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -177.666 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.467 ' CG1' ' O ' ' A' ' 92' ' ' SER . 1.1 m . . . . . 0 CA--C 1.539 0.555 0 CA-C-N 113.596 -1.638 . . . . 0.0 108.355 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.627 ' HA ' ' HA ' ' A' ' 69' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.452 -0.371 0 CA-C-O 120.651 0.263 . . . . 0.0 110.469 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.527 ' O ' ' O ' ' A' ' 67' ' ' VAL . 4.1 t -139.97 161.19 38.19 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.294 0.569 . . . . 0.0 110.635 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 1.2 t -103.35 150.0 7.08 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.975 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 178.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.536 HD21 ' HG ' ' A' ' 116' ' ' LEU . 0.3 OUTLIER -103.68 114.13 28.16 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -178.105 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.652 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 1.3 p -126.06 103.8 12.12 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.11 0 N-CA-C 103.198 -2.89 . . . . 0.0 103.198 174.108 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 0.535 ' HB2' ' HA ' ' A' ' 88' ' ' TYR . 8.2 p -143.82 165.24 28.23 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 113.879 1.066 . . . . 0.0 113.879 -174.016 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.507 ' CB ' ' O ' ' A' ' 102' ' ' SER . 0.1 OUTLIER 155.13 -88.13 0.0 OUTLIER 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 113.817 -1.538 . . . . 0.0 112.019 176.589 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.472 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 60.23 21.13 10.52 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 -178.54 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.567 ' HB2' ' O ' ' A' ' 41' ' ' GLY . 4.6 m 144.43 176.32 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 114.471 -1.24 . . . . 0.0 108.104 -179.082 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.608 ' O ' ' NE2' ' A' ' 107' ' ' GLN . 0.3 OUTLIER -104.04 101.17 10.94 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.315 -0.554 . . . . 0.0 111.037 -179.483 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.704 ' OE1' ' HB3' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -168.51 151.35 5.32 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.429 178.665 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.422 ' HB3' ' HB3' ' A' ' 55' ' ' PHE . 0.9 OUTLIER -153.64 147.91 25.87 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.144 0.497 . . . . 0.0 111.613 178.369 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.543 ' HB ' ' CZ ' ' A' ' 39' ' ' PHE . 0.3 OUTLIER -115.28 160.94 19.16 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.229 -179.916 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.474 ' HB3' ' CG2' ' A' ' 16' ' ' VAL . 0.4 OUTLIER -48.91 -60.46 2.74 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.683 0.278 . . . . 0.0 110.444 179.818 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . 0.652 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 3.3 tp60 -45.47 -65.18 0.57 Allowed 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.537 179.586 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . 0.435 ' O ' ' CD2' ' A' ' 116' ' ' LEU . 29.6 m-20 -45.95 -53.13 10.48 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.113 0.482 . . . . 0.0 110.482 179.331 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . 0.419 ' O ' HD13 ' A' ' 117' ' ' LEU . . . -44.81 -63.16 0.97 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.202 179.732 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.762 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -64.41 -27.07 68.75 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.657 -179.756 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.642 HG13 HD12 ' A' ' 76' ' ' LEU . 92.6 t -58.72 -64.96 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.868 0 CA-C-O 122.148 0.975 . . . . 0.0 110.627 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.536 ' HG ' HD21 ' A' ' 100' ' ' LEU . 0.1 OUTLIER -62.95 -40.08 96.57 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 114.512 -1.222 . . . . 0.0 110.04 -179.415 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.468 HD13 ' CG2' ' A' ' 59' ' ' VAL . 0.2 OUTLIER -67.78 -22.26 65.2 Favored 'General case' 0 CA--C 1.511 -0.536 0 O-C-N 123.235 0.335 . . . . 0.0 110.925 179.641 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.55 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 5.5 tp10 -69.03 -51.65 36.91 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 106.345 -1.724 . . . . 0.0 106.345 177.291 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . 0.465 ' HB1' ' HA ' ' A' ' 68' ' ' LEU . . . -73.72 -19.15 60.89 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 114.464 -1.244 . . . . 0.0 110.877 177.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.494 ' HB3' ' O ' ' A' ' 116' ' ' LEU . . . -77.59 -59.93 2.58 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.684 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.516 HD21 ' HA ' ' A' ' 118' ' ' GLU . 0.1 OUTLIER -59.82 -30.14 68.72 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.739 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.55 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.9 OUTLIER -68.45 -54.82 14.52 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.33 -179.7 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.86 -30.07 26.74 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -177.142 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . 0.406 ' OE1' ' CD1' ' A' ' 5' ' ' LEU . 2.7 mt-10 -78.05 -66.57 0.83 Allowed 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.222 -0.591 . . . . 0.0 112.366 -178.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.324 -0.541 0 CA-C-O 121.094 0.474 . . . . 0.0 111.747 -179.086 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 12.8 p-10 . . . . . 0 CA--C 1.532 0.266 0 CA-C-O 120.412 0.148 . . . . 0.0 110.716 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.5 mp -71.39 -79.69 0.07 Allowed 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.941 0.4 . . . . 0.0 110.8 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.467 ' O ' ' HB2' ' A' ' 8' ' ' LEU . 0.4 OUTLIER -165.54 -166.43 0.97 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.963 179.934 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.485 ' O ' ' CD2' ' A' ' 117' ' ' LEU . 0.4 OUTLIER -95.68 -66.36 0.91 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 122.013 0.911 . . . . 0.0 111.6 -179.949 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' SER . . . . . 0.405 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 1.3 p -63.97 -38.36 90.8 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.46 -1.246 . . . . 0.0 112.337 -178.16 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.97 -34.12 64.13 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.517 -0.473 . . . . 0.0 109.919 179.324 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.467 ' HB2' ' O ' ' A' ' 4' ' ' SER . 13.5 tp -66.98 -49.7 64.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.947 179.24 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.485 ' CG ' ' CD2' ' A' ' 121' ' ' LEU . 56.5 t-80 -61.09 -46.11 91.98 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.969 178.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.42 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 5.0 mtp180 -56.73 -42.36 79.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.857 179.367 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.568 ' HG3' HG21 ' A' ' 31' ' ' VAL . 5.4 tp-100 -67.13 -65.65 0.66 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.834 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.469 ' HA ' ' CD1' ' A' ' 15' ' ' LEU . 14.4 p -52.29 -46.93 46.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 121.071 0.462 . . . . 0.0 111.204 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.705 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 41.0 m -64.28 -37.88 89.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.802 -179.467 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.42 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 3.7 mmt180 -69.0 -30.7 69.15 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.513 -179.573 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.501 ' CD1' HG21 ' A' ' 31' ' ' VAL . 2.4 mt -72.67 -62.11 1.56 Allowed 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.671 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.752 ' CG2' ' HB3' ' A' ' 110' ' ' LEU . 56.3 t -57.7 -53.61 42.44 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.471 0 CA-C-O 121.217 0.532 . . . . 0.0 111.425 -179.489 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -62.55 -7.35 4.52 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.539 -178.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -150.12 37.15 0.69 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 120.953 -0.299 . . . . 0.0 111.699 179.266 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.491 ' N ' ' O ' ' A' ' 15' ' ' LEU . 1.4 mt-10 168.33 -66.79 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.607 ' HB3' ' CD1' ' A' ' 110' ' ' LEU . 0.8 OUTLIER -76.29 80.09 3.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.669 -177.669 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -66.64 73.5 0.16 Allowed Glycine 0 C--N 1.311 -0.843 0 CA-C-N 114.937 -1.029 . . . . 0.0 112.759 179.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.8 t70 75.94 22.09 1.49 Allowed 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 179.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.472 ' HB2' ' HB3' ' A' ' 20' ' ' SER . 96.4 m -70.21 -165.79 0.11 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 179.329 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.599 ' O ' HD11 ' A' ' 110' ' ' LEU . 0.2 OUTLIER -104.39 163.42 12.45 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.818 0.342 . . . . 0.0 110.506 179.692 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -104.28 131.2 10.54 Favored Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.131 -1.033 . . . . 0.0 113.344 -179.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.551 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 0.0 OUTLIER -104.42 110.75 23.13 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.927 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.0 tt -104.0 139.47 39.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.474 0.654 . . . . 0.0 112.231 -178.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 165.08 51.71 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.109 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 94.02 -5.53 72.22 Favored Glycine 0 CA--C 1.519 0.287 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.402 -178.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.435 ' C ' ' ND2' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -165.55 151.98 9.86 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.818 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.568 HG21 ' HG3' ' A' ' 11' ' ' GLN . 1.5 m -104.81 123.91 59.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.469 179.19 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -114.02 166.34 11.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.211 -178.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.412 ' HB3' ' HB3' ' A' ' 20' ' ' SER . . . -103.29 105.97 16.38 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.22 0.533 . . . . 0.0 111.25 -179.628 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.446 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 0.8 OUTLIER -85.11 124.57 31.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.559 -179.884 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -125.08 28.19 6.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.923 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -110.39 -39.35 4.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.795 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.474 ' HB ' ' CD2' ' A' ' 39' ' ' PHE . 0.8 OUTLIER -104.96 -53.46 2.66 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.115 -179.963 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.6 p 60.58 96.13 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.351 0.596 . . . . 0.0 109.627 -179.269 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.592 ' CG ' ' OE1' ' A' ' 107' ' ' GLN . 18.7 m-85 -133.13 -177.52 4.55 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 113.745 1.017 . . . . 0.0 113.745 -177.793 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.426 ' N ' ' CD ' ' A' ' 40' ' ' GLN . 0.0 OUTLIER -149.75 -56.31 0.18 Allowed 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 114.838 -1.074 . . . . 0.0 110.703 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.511 ' HA3' ' CB ' ' A' ' 87' ' ' ASN . . . -150.66 101.27 0.21 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.495 -0.86 . . . . 0.0 112.911 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.516 HD22 ' OE1' ' A' ' 107' ' ' GLN . 0.1 OUTLIER -156.74 172.84 17.9 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.787 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.482 ' C ' ' H ' ' A' ' 45' ' ' ALA . 0.2 OUTLIER -108.67 40.9 1.69 Allowed 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -176.946 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.44 ' N ' HD12 ' A' ' 42' ' ' LEU . 3.3 mt 55.1 0.89 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 179.299 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.482 ' H ' ' C ' ' A' ' 43' ' ' THR . . . -68.83 -35.92 77.56 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.204 0.526 . . . . 0.0 109.974 179.541 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 6.6 t -74.96 -59.77 2.59 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.393 179.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 173.5 31.75 0.03 OUTLIER Glycine 0 CA--C 1.52 0.36 0 C-N-CA 120.638 -0.792 . . . . 0.0 113.246 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.504 ' CB ' ' OE1' ' A' ' 107' ' ' GLN . . . -67.67 -167.42 0.07 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.268 0.556 . . . . 0.0 111.535 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 17.0 mmm180 -145.67 143.4 29.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.937 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.402 ' O ' ' CG2' ' A' ' 54' ' ' VAL . 4.6 mp0 -45.06 -31.49 1.37 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.884 0.373 . . . . 0.0 111.381 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' SER . . . . . 0.435 ' CB ' ' HG2' ' A' ' 26' ' ' LYS . 0.4 OUTLIER -60.49 -61.49 2.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.253 -179.936 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.415 ' HG2' ' CG2' ' A' ' 24' ' ' THR . 54.1 mt-10 -48.88 -65.35 0.58 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.122 0.487 . . . . 0.0 110.957 -179.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.5 ' HG2' ' N ' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -45.01 -57.59 3.74 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.345 179.72 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.5 ' N ' ' HG2' ' A' ' 53' ' ' LYS . 78.2 t -52.58 -35.25 20.45 Favored 'Isoleucine or valine' 0 C--O 1.232 0.133 0 CA-C-O 120.945 0.402 . . . . 0.0 110.534 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.557 ' HB3' ' HB3' ' A' ' 108' ' ' MET . 0.2 OUTLIER -65.35 -47.31 76.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.306 179.462 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.6 -49.2 73.43 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-O 120.982 0.42 . . . . 0.0 110.59 179.339 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -59.98 -45.57 92.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.816 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 82.0 p -66.97 -52.83 37.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.804 -179.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.609 ' HA ' ' CE1' ' A' ' 62' ' ' HIS . 13.4 p -56.2 -46.49 81.29 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-O 120.828 0.347 . . . . 0.0 111.267 -179.189 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.1 tp -67.62 -36.85 81.59 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.533 179.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 33.3 m -61.44 -65.23 0.72 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.123 -0.49 . . . . 0.0 112.036 -179.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . 0.609 ' CE1' ' HA ' ' A' ' 59' ' ' VAL . 9.7 p-80 -50.09 -44.99 52.2 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.019 0.438 . . . . 0.0 110.365 -179.726 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.606 HG11 HG12 ' A' ' 66' ' ' VAL . 16.8 t -63.79 -66.63 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.776 178.552 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.503 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 37.82 36.17 0.09 Allowed 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.541 178.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.503 ' CB ' ' O ' ' A' ' 64' ' ' ALA . 11.2 t-20 154.97 -80.44 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 122.479 0.311 . . . . 0.0 110.979 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.616 HG13 ' HA ' ' A' ' 120' ' ' ALA . 17.0 m 45.38 -154.41 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.546 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.603 ' CG1' ' O ' ' A' ' 67' ' ' VAL . 3.2 p -163.98 69.34 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.334 -0.084 0 CA-C-O 121.869 0.842 . . . . 0.0 111.4 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.551 ' HB3' ' HB2' ' A' ' 72' ' ' ASP . 1.0 OUTLIER -53.39 107.0 0.2 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.12 -0.945 . . . . 0.0 112.32 -179.904 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.695 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 74.1 p -71.14 -176.83 1.52 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 0.0 109.778 178.767 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.402 ' HA ' ' OG1' ' A' ' 73' ' ' THR . 0.0 OUTLIER -46.08 -34.59 4.26 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.159 0.504 . . . . 0.0 111.115 -179.786 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.83 -65.05 0.75 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.793 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.579 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 43.9 m-20 -55.21 -29.45 57.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.971 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.406 ' CG2' ' HB3' ' A' ' 98' ' ' SER . 1.5 p -65.65 -60.95 2.38 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 178.443 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.73 -25.97 55.92 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 177.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.579 ' HB2' ' HA ' ' A' ' 72' ' ' ASP . 0.1 OUTLIER -57.71 -65.07 0.7 Allowed 'General case' 0 C--O 1.234 0.262 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.564 178.922 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.406 HD12 HD22 ' A' ' 68' ' ' LEU . 0.4 OUTLIER -59.01 -38.96 80.44 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 121.2 0.524 . . . . 0.0 109.87 179.085 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -52.25 -44.37 64.85 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.617 179.766 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -72.31 -58.24 3.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.887 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -56.53 -23.93 43.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.491 -179.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 51.1 m . . . . . 0 C--N 1.329 -0.287 0 CA-C-O 120.772 0.32 . . . . 0.0 111.63 -179.461 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . 0.529 ' HA ' ' HB2' ' A' ' 104' ' ' ARG . 11.5 p-10 . . . . . 0 C--O 1.244 0.772 0 CA-C-O 121.585 0.707 . . . . 0.0 110.496 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.618 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 3.1 m-85 -108.83 138.35 45.29 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.53 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.649 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.1 OUTLIER -104.64 150.49 24.65 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.444 -178.437 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.441 ' N ' ' OD1' ' A' ' 89' ' ' ASP . 12.5 mt -138.53 144.65 40.03 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -178.013 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -132.88 114.53 14.17 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 178.178 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.53 ' HA ' ' CB ' ' A' ' 98' ' ' SER . 1.6 m -104.24 146.25 29.05 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 113.739 1.015 . . . . 0.0 113.739 -177.043 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.529 ' O ' ' O ' ' A' ' 97' ' ' ASN . 12.7 m . . . . . 0 N--CA 1.447 -0.594 0 CA-C-N 114.107 -1.406 . . . . 0.0 108.753 179.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.695 ' HA ' ' HA ' ' A' ' 69' ' ' THR . 0.0 OUTLIER . . . . . 0 CA--C 1.518 -0.285 0 CA-C-O 121.281 0.563 . . . . 0.0 111.422 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.53 ' CB ' ' HA ' ' A' ' 92' ' ' SER . 39.9 t -146.28 165.12 30.19 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.472 -179.165 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.3 t -116.07 152.9 17.73 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.541 179.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.438 ' CD2' HG12 ' A' ' 63' ' ' VAL . 0.0 OUTLIER -104.69 126.39 51.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.7 0.762 . . . . 0.0 112.447 -179.586 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.649 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -130.71 110.67 18.9 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 N-CA-C 104.976 -2.231 . . . . 0.0 104.976 175.955 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 0.759 ' O ' ' HB2' ' A' ' 103' ' ' LEU . 17.8 p -153.14 165.33 35.97 Favored 'General case' 0 C--N 1.309 -1.169 0 C-N-CA 118.401 -1.32 . . . . 0.0 114.544 -174.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.759 ' HB2' ' O ' ' A' ' 102' ' ' SER . 0.8 OUTLIER 136.21 74.72 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 113.21 -1.814 . . . . 0.0 112.457 176.05 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.529 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -108.51 29.02 7.78 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 177.464 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.508 ' HB3' ' N ' ' A' ' 42' ' ' LEU . 2.8 m 153.35 163.49 0.01 OUTLIER 'General case' 0 C--O 1.231 0.117 0 CA-C-N 114.188 -1.369 . . . . 0.0 107.509 -178.489 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.446 ' O ' ' HG3' ' A' ' 107' ' ' GLN . 0.8 OUTLIER -104.79 100.98 10.61 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.977 -179.159 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.592 ' OE1' ' CG ' ' A' ' 39' ' ' PHE . 4.1 mt-30 -169.17 163.35 10.99 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.708 177.656 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.557 ' HB3' ' HB3' ' A' ' 55' ' ' PHE . 1.0 OUTLIER -165.93 135.23 3.25 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.293 0.568 . . . . 0.0 112.126 178.293 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.504 ' HA ' ' HA ' ' A' ' 24' ' ' THR . 0.4 OUTLIER -103.13 160.93 14.21 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.004 178.608 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.752 ' HB3' ' CG2' ' A' ' 16' ' ' VAL . 4.0 mt -45.77 -54.71 7.53 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -178.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . 0.578 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 0.1 OUTLIER -48.31 -65.45 0.57 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.747 0.308 . . . . 0.0 111.04 -179.928 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . 0.484 ' O ' ' HB ' ' A' ' 115' ' ' VAL . 1.6 m-20 -47.2 -46.02 23.62 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.247 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -52.08 -60.54 3.08 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.648 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.705 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -65.34 -22.53 66.83 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.993 179.745 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.566 ' CG2' ' CG ' ' A' ' 75' ' ' LYS . 53.0 t -61.51 -61.95 1.35 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.876 0 CA-C-O 121.894 0.854 . . . . 0.0 109.973 179.556 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.488 ' HB3' ' CG2' ' A' ' 63' ' ' VAL . 9.1 mp -61.83 -39.48 91.97 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.595 179.653 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.559 ' HG ' ' NE2' ' A' ' 62' ' ' HIS . 0.1 OUTLIER -68.05 -23.17 64.93 Favored 'General case' 0 CA--C 1.507 -0.685 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.677 179.265 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.676 ' HA ' HD22 ' A' ' 121' ' ' LEU . 9.3 tp10 -66.62 -54.95 17.83 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 106.271 -1.751 . . . . 0.0 106.271 177.114 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -67.99 -20.13 64.99 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.497 177.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.616 ' HA ' HG13 ' A' ' 66' ' ' VAL . . . -77.04 -64.49 1.12 Allowed 'General case' 0 CA--C 1.509 -0.627 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.717 179.802 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.676 HD22 ' HA ' ' A' ' 118' ' ' GLU . 0.2 OUTLIER -60.63 -21.76 63.06 Favored 'General case' 0 N--CA 1.444 -0.74 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.63 179.416 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.534 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 14.6 ttm-85 -73.9 -57.35 4.04 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.904 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.454 ' HG3' HG13 ' A' ' 67' ' ' VAL . 0.8 OUTLIER -94.37 -21.18 19.12 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -177.395 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -86.42 -66.58 0.89 Allowed 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -178.091 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.458 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -178.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . 0.403 ' OD1' ' CE1' ' A' ' 62' ' ' HIS . 3.7 p-10 . . . . . 0 CA--C 1.531 0.231 0 CA-C-O 120.64 0.257 . . . . 0.0 110.712 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.4 mp -84.95 -80.47 0.21 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.857 0.361 . . . . 0.0 111.054 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.428 ' O ' ' CB ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER 171.3 154.33 0.07 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.884 -179.89 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.469 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 30.1 mt -49.17 -65.12 0.62 Allowed 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 121.205 0.526 . . . . 0.0 111.936 -179.392 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.2 t -42.4 -56.76 2.87 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.225 -0.898 . . . . 0.0 112.516 -178.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.86 -56.16 5.61 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.663 0.268 . . . . 0.0 111.055 -179.517 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.428 ' CB ' ' O ' ' A' ' 4' ' ' SER . 15.8 tp -45.52 -55.01 6.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.106 0.479 . . . . 0.0 110.218 179.317 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.497 ' CG ' ' CD2' ' A' ' 121' ' ' LEU . 51.5 t-80 -59.62 -47.76 84.33 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.532 178.564 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.2 mmt-85 -49.99 -45.63 51.84 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.512 179.607 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.436 ' CG ' HG22 ' A' ' 31' ' ' VAL . 0.2 OUTLIER -64.68 -65.51 0.66 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.517 179.98 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.444 ' N ' HG23 ' A' ' 31' ' ' VAL . 12.5 p -57.92 -48.17 84.62 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.768 -179.242 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.739 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 39.6 p -58.24 -53.55 57.03 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.098 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.432 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 8.9 ttm-85 -65.1 -23.81 67.25 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.831 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.407 ' CD1' HG22 ' A' ' 31' ' ' VAL . 7.5 mt -69.94 -61.73 1.66 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.806 0.336 . . . . 0.0 111.46 -179.727 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.575 ' HA ' ' H ' ' A' ' 21' ' ' GLY . 1.2 t -71.41 -27.74 29.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.035 -179.609 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.413 ' CG ' ' O ' ' A' ' 13' ' ' SER . 9.5 mm-40 -72.57 -20.2 61.36 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.727 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.432 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 7.1 pt20 -162.42 57.43 0.23 Allowed 'General case' 0 CA--C 1.527 0.087 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.539 179.516 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 178.64 -60.71 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.159 0 N-CA-C 111.86 0.319 . . . . 0.0 111.86 179.614 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.46 ' HB2' ' HA ' ' A' ' 16' ' ' VAL . 70.2 m -85.89 -78.86 0.26 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.878 0.371 . . . . 0.0 111.514 -179.069 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . 0.575 ' H ' ' HA ' ' A' ' 16' ' ' VAL . . . 123.3 -28.47 5.55 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 121.1 -0.571 . . . . 0.0 112.722 -179.752 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.475 ' HB3' ' O ' ' A' ' 21' ' ' GLY . 0.0 OUTLIER 167.43 6.08 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.801 0.301 . . . . 0.0 111.61 179.958 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.452 ' O ' ' O ' ' A' ' 22' ' ' ASP . 62.9 m -51.76 -164.75 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.083 0.468 . . . . 0.0 111.535 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.598 ' HA ' ' HA ' ' A' ' 109' ' ' THR . 12.5 m -103.61 155.53 18.48 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.556 ' CA ' HD22 ' A' ' 110' ' ' LEU . . . -106.02 129.05 9.6 Favored Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.249 -0.976 . . . . 0.0 113.878 -178.183 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.55 ' HB2' ' CB ' ' A' ' 51' ' ' SER . 0.0 OUTLIER -109.87 123.62 49.91 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.504 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 9.9 tt -107.61 154.5 21.34 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.156 0.503 . . . . 0.0 111.739 -178.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 161.5 52.08 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.067 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 96.32 -9.44 67.23 Favored Glycine 0 N--CA 1.452 -0.286 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -178.024 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -165.77 165.04 18.75 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 179.665 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.444 HG23 ' N ' ' A' ' 12' ' ' VAL . 1.5 m -112.69 138.24 42.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 C-N-CA 120.359 -0.536 . . . . 0.0 110.979 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.465 ' CB ' ' HG3' ' A' ' 26' ' ' LYS . . . -130.42 165.85 21.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.544 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.442 ' CB ' ' OG ' ' A' ' 20' ' ' SER . . . -103.49 115.09 29.88 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.137 0.494 . . . . 0.0 111.574 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.518 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 0.8 OUTLIER -90.93 119.56 31.22 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.184 179.786 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.27 -22.42 10.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.019 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.423 ' CG ' ' N ' ' A' ' 37' ' ' THR . 2.2 pt-20 -55.37 -48.52 74.16 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.854 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.423 ' N ' ' CG ' ' A' ' 36' ' ' GLU . 8.9 p -103.33 -161.24 0.82 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.411 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 58.7 p -132.83 -35.99 1.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -179.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.621 ' HB2' ' NE2' ' A' ' 107' ' ' GLN . 0.0 OUTLIER 74.25 172.82 0.28 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.828 0.347 . . . . 0.0 110.236 -179.356 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.56 ' N ' ' CG ' ' A' ' 39' ' ' PHE . 0.2 OUTLIER 169.36 37.52 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.122 179.708 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.639 ' C ' ' HB2' ' A' ' 107' ' ' GLN . . . 82.66 -22.05 6.93 Favored Glycine 0 CA--C 1.519 0.313 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.15 -179.141 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.497 ' HB3' ' OE1' ' A' ' 107' ' ' GLN . 12.6 tp -24.17 138.68 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.257 0.623 . . . . 0.0 112.186 179.195 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 12.8 m -91.58 26.56 2.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.795 -179.42 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.562 HD13 ' HG2' ' A' ' 53' ' ' LYS . 4.4 mm 71.69 3.18 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 179.537 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -74.05 -26.88 60.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.768 0.318 . . . . 0.0 111.113 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -95.33 -40.52 9.49 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.074 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.79 38.45 0.03 OUTLIER Glycine 0 CA--C 1.519 0.318 0 C-N-CA 120.394 -0.908 . . . . 0.0 113.353 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.421 ' CB ' ' CD1' ' A' ' 44' ' ' ILE . . . -81.98 159.19 23.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.936 0.368 . . . . 0.0 110.624 179.483 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.421 ' HB3' ' HG2' ' A' ' 52' ' ' GLU . 0.0 OUTLIER -80.2 130.61 35.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.695 179.902 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.663 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 4.7 mp0 -52.76 -25.66 11.92 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.075 0.464 . . . . 0.0 110.868 179.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' SER . . . . . 0.55 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 92.8 p -69.55 -48.65 59.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.026 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.445 ' H ' ' HG2' ' A' ' 52' ' ' GLU . 0.0 OUTLIER -55.28 -56.99 13.69 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 179.15 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.663 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -52.06 -58.78 5.53 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.667 179.654 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.529 ' H ' ' HG3' ' A' ' 53' ' ' LYS . 16.0 m -52.73 -45.86 49.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 CA-C-O 121.17 0.509 . . . . 0.0 110.401 179.726 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.455 ' CE2' ' HB2' ' A' ' 113' ' ' ALA . 0.9 OUTLIER -51.42 -46.86 63.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.363 179.237 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.05 -46.65 87.71 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.13 179.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 -57.93 -40.58 80.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.417 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 89.2 m -68.4 -58.57 4.15 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.212 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.5 HG21 ' HB2' ' A' ' 116' ' ' LEU . 7.2 p -55.92 -42.45 71.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.021 -179.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.417 ' CD2' ' HG ' ' A' ' 103' ' ' LEU . 4.9 tp -64.41 -45.2 88.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.553 179.725 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 72.3 m -57.08 -61.2 2.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.872 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . 0.403 ' CE1' ' OD1' ' A' ' 2' ' ' ASN . 0.3 OUTLIER -49.85 -40.03 40.96 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.009 0.433 . . . . 0.0 110.211 179.572 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.581 HG11 HG11 ' A' ' 66' ' ' VAL . 56.1 t -71.47 -80.39 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.648 178.742 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.415 ' O ' ' HB2' ' A' ' 65' ' ' ASN . . . 67.12 -6.11 0.62 Allowed 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 178.298 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.415 ' HB2' ' O ' ' A' ' 64' ' ' ALA . 2.6 t-20 175.35 -56.2 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 120.806 0.336 . . . . 0.0 110.172 -179.587 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.689 HG12 ' HA ' ' A' ' 120' ' ' ALA . 27.7 m 42.94 -157.68 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.326 178.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.632 ' CG1' ' O ' ' A' ' 67' ' ' VAL . 0.5 OUTLIER -161.53 89.66 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 CA-C-O 122.088 0.947 . . . . 0.0 108.708 179.531 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.581 ' HB3' ' CB ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -89.99 112.64 24.12 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.812 -1.085 . . . . 0.0 113.007 -177.34 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.489 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 9.2 p -62.63 174.95 0.88 Allowed 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.34 -0.845 . . . . 0.0 109.389 178.248 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -43.8 -30.34 0.65 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.869 0.366 . . . . 0.0 111.445 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.405 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 0.2 OUTLIER -63.04 -65.31 0.71 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.138 -179.909 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.598 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 60.1 m-20 -62.25 -28.95 70.06 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.42 -179.644 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -61.34 -60.32 3.91 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 179.047 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.469 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . . . -58.87 -28.16 65.87 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.487 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.598 ' HB2' ' HA ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -56.08 -52.49 64.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.601 -1.181 . . . . 0.0 110.154 178.513 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.482 ' CD2' HD11 ' A' ' 116' ' ' LEU . 0.5 OUTLIER -67.01 -54.19 24.07 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.308 179.089 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.469 ' CD2' ' HA ' ' A' ' 74' ' ' ALA . 0.4 OUTLIER -54.83 -24.76 24.47 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.4 -179.901 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -75.65 -63.66 1.25 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.399 179.096 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' SER . . . . . 0.422 ' CB ' ' HG2' ' A' ' 111' ' ' GLN . 0.0 OUTLIER -56.54 -23.09 37.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.498 179.985 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 2.0 m . . . . . 0 C--N 1.33 -0.276 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -179.185 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 . . . . . 0 C--O 1.239 0.526 0 CA-C-O 121.073 0.463 . . . . 0.0 110.907 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.559 ' CD2' ' CB ' ' A' ' 102' ' ' SER . 5.2 m-85 -107.37 140.56 40.1 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 120.62 -0.432 . . . . 0.0 111.438 -179.453 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.61 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.7 OUTLIER -108.92 145.36 35.53 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 -179.593 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.437 ' N ' ' OD1' ' A' ' 89' ' ' ASP . 6.2 mt -132.67 148.39 52.35 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 -177.254 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.451 ' O ' ' O ' ' A' ' 99' ' ' VAL . 5.1 ttp180 -146.36 105.04 3.84 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 105.715 -1.957 . . . . 0.0 105.715 177.363 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.693 ' HB2' ' HB3' ' A' ' 98' ' ' SER . 0.1 OUTLIER -103.37 165.4 11.05 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 116.22 1.933 . . . . 0.0 116.22 -174.041 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.525 ' HB ' HD21 ' A' ' 97' ' ' ASN . 0.2 OUTLIER . . . . . 0 C--O 1.242 0.705 0 CA-C-N 111.48 -2.6 . . . . 0.0 106.863 177.67 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.525 HD21 ' HB ' ' A' ' 93' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.506 -0.729 0 CA-C-O 121.368 0.604 . . . . 0.0 111.877 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.693 ' HB3' ' HB2' ' A' ' 92' ' ' SER . 3.7 m -153.96 141.33 19.66 Favored 'General case' 0 N--CA 1.436 -1.173 0 CA-C-N 114.987 -1.006 . . . . 0.0 109.633 178.772 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . 0.451 ' O ' ' O ' ' A' ' 91' ' ' ARG . 76.4 t -104.99 123.04 58.84 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.143 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.499 -179.516 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.513 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -102.91 133.33 48.18 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 122.094 0.949 . . . . 0.0 112.821 -178.028 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.61 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 0.2 OUTLIER -127.26 117.22 46.63 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 N-CA-C 104.943 -2.243 . . . . 0.0 104.943 176.829 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 0.757 ' O ' ' HB2' ' A' ' 103' ' ' LEU . 0.1 OUTLIER -146.36 165.15 30.19 Favored 'General case' 0 C--N 1.307 -1.267 0 C-N-CA 118.589 -1.244 . . . . 0.0 114.205 -174.91 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.757 ' HB2' ' O ' ' A' ' 102' ' ' SER . 0.6 OUTLIER 126.13 72.41 0.0 OUTLIER 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 112.816 -1.993 . . . . 0.0 112.759 176.11 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.3 -5.28 57.69 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.714 -1.13 . . . . 0.0 108.171 176.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' A' ' 41' ' ' GLY . 70.1 m -175.79 172.94 2.42 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 113.891 -1.504 . . . . 0.0 107.405 179.299 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.417 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.4 OUTLIER -104.77 102.4 11.97 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 119.581 -0.848 . . . . 0.0 112.326 -178.982 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.639 ' HB2' ' C ' ' A' ' 41' ' ' GLY . 2.2 mt-30 -168.49 165.22 12.57 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.394 178.393 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.529 ' CE ' ' CD2' ' A' ' 116' ' ' LEU . 4.1 tpt -162.04 149.87 14.54 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 179.333 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.598 ' HA ' ' HA ' ' A' ' 24' ' ' THR . 0.7 OUTLIER -116.88 165.21 13.58 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.98 178.732 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.556 HD22 ' CA ' ' A' ' 25' ' ' GLY . 0.0 OUTLIER -51.73 -59.09 4.69 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 120.837 0.351 . . . . 0.0 110.323 179.513 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . 0.62 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 2.7 tp60 -48.59 -65.54 0.55 Allowed 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.726 179.743 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . 0.473 ' HB3' ' HE3' ' A' ' 108' ' ' MET . 4.0 t0 -41.95 -54.1 3.6 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-O 121.317 0.579 . . . . 0.0 111.212 179.697 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . 0.455 ' HB2' ' CE2' ' A' ' 55' ' ' PHE . . . -47.98 -64.17 0.87 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.219 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.739 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -60.71 -25.31 66.33 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.956 -0.297 . . . . 0.0 111.253 -179.673 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.541 ' CG2' ' CG ' ' A' ' 75' ' ' LYS . 89.7 t -60.57 -65.49 0.47 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.819 0 CA-C-O 121.58 0.705 . . . . 0.0 110.996 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.529 ' CD2' ' CE ' ' A' ' 108' ' ' MET . 0.1 OUTLIER -65.26 -37.41 87.13 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.368 -179.402 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.469 ' CD2' ' HA ' ' A' ' 5' ' ' LEU . 0.1 OUTLIER -67.59 -24.6 65.52 Favored 'General case' 0 CA--C 1.508 -0.669 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.397 179.422 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.475 ' O ' ' CB ' ' A' ' 122' ' ' ARG . 1.1 tp10 -67.65 -50.38 58.21 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 177.097 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . 0.456 ' CB ' HD21 ' A' ' 68' ' ' LEU . . . -69.62 -24.21 63.62 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.507 -1.224 . . . . 0.0 110.376 177.242 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.689 ' HA ' HG12 ' A' ' 66' ' ' VAL . . . -75.69 -65.34 0.91 Allowed 'General case' 0 CA--C 1.51 -0.588 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.711 -179.692 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.497 ' CD2' ' CG ' ' A' ' 9' ' ' HIS . 0.1 OUTLIER -56.16 -31.72 63.63 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.115 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.475 ' CB ' ' O ' ' A' ' 118' ' ' GLU . 2.3 ttt85 -66.95 -48.8 67.45 Favored 'General case' 0 CA--C 1.528 0.102 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.597 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.563 ' HG3' ' CG1' ' A' ' 67' ' ' VAL . 0.0 OUTLIER -89.24 -19.1 25.8 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -177.658 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . 0.423 ' HB2' ' CD1' ' A' ' 5' ' ' LEU . 3.5 mm-40 -95.35 -66.51 0.91 Allowed 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -178.541 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.327 -0.385 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -178.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . 0.439 ' HB3' ' CG2' ' A' ' 58' ' ' THR . 6.6 p30 . . . . . 0 CA--C 1.531 0.244 0 CA-C-O 120.88 0.371 . . . . 0.0 111.714 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.431 HD13 ' CB ' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -88.51 -95.69 0.1 Allowed 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.187 -179.846 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.5 ' O ' ' HB2' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -166.45 146.39 5.98 Favored 'General case' 0 CA--C 1.527 0.082 0 CA-C-O 120.608 0.242 . . . . 0.0 110.349 -179.893 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.44 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 19.5 mt -45.87 -65.06 0.6 Allowed 'General case' 0 CA--C 1.51 -0.57 0 CA-C-O 121.018 0.437 . . . . 0.0 111.913 -179.444 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -41.71 -62.05 0.97 Allowed 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.625 -178.327 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -59.79 -47.06 87.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.842 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.566 ' HB3' ' CD2' ' A' ' 117' ' ' LEU . 0.1 OUTLIER -54.81 -65.82 0.51 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.997 -179.642 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.53 ' CG ' ' CD2' ' A' ' 121' ' ' LEU . 40.5 t-80 -51.73 -34.3 38.46 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-O 121.61 0.719 . . . . 0.0 109.72 179.166 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.38 -61.38 2.64 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.665 -1.152 . . . . 0.0 110.523 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.628 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 7.1 pt20 -64.44 -53.22 51.83 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 120.774 -0.37 . . . . 0.0 111.743 -179.691 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.498 ' CG1' ' HA ' ' A' ' 9' ' ' HIS . 13.1 p -51.42 -48.45 34.27 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 121.078 0.466 . . . . 0.0 111.077 -179.67 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.621 ' HA ' ' NZ ' ' A' ' 114' ' ' LYS . 52.4 p -67.58 -31.41 71.44 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.417 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.71 -27.0 61.8 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -178.384 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.628 ' HG ' ' O ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -93.45 -37.99 11.66 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 119.308 -0.957 . . . . 0.0 110.579 179.565 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.785 ' CG2' ' HB3' ' A' ' 110' ' ' LEU . 59.5 t -68.67 -50.08 58.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 120.864 0.364 . . . . 0.0 111.239 179.688 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -70.08 -5.66 28.38 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.392 -179.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.0 mt-30 -145.14 32.22 1.11 Allowed 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 111.671 0.248 . . . . 0.0 111.671 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.449 ' N ' ' O ' ' A' ' 15' ' ' LEU . 0.4 OUTLIER 175.46 -71.95 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 179.847 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.462 ' HB3' HD13 ' A' ' 110' ' ' LEU . 0.7 OUTLIER -76.65 75.87 3.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.595 -178.629 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -62.83 74.72 0.03 OUTLIER Glycine 0 C--N 1.318 -0.445 0 CA-C-N 115.219 -0.9 . . . . 0.0 112.882 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.42 ' N ' ' O ' ' A' ' 20' ' ' SER . 16.3 t70 78.53 9.84 1.94 Allowed 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 179.226 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.476 ' O ' ' OG1' ' A' ' 109' ' ' THR . 0.9 OUTLIER -61.78 -167.49 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.191 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.132 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.49 ' HB ' ' ND2' ' A' ' 34' ' ' ASN . 94.6 m -103.56 142.34 34.45 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.629 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.599 ' CA ' ' HG ' ' A' ' 110' ' ' LEU . . . -104.76 149.45 16.89 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.049 -1.072 . . . . 0.0 114.157 -178.101 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.507 ' HB2' ' CB ' ' A' ' 51' ' ' SER . 0.0 OUTLIER -114.19 133.35 55.66 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 178.552 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.489 ' HB2' ' CG ' ' A' ' 55' ' ' PHE . 7.8 tt -113.17 149.94 32.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.377 0.608 . . . . 0.0 111.966 -179.285 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 165.42 64.23 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.183 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 78.25 -4.87 57.38 Favored Glycine 0 C--N 1.334 0.417 0 C-N-CA 120.681 -0.771 . . . . 0.0 111.214 -177.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.497 ' C ' ' ND2' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -166.26 166.11 17.01 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 -179.772 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.614 ' CG1' ' HG3' ' A' ' 11' ' ' GLN . 13.5 p -105.71 144.76 14.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.223 0.535 . . . . 0.0 111.765 179.361 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.46 ' CB ' ' HG3' ' A' ' 26' ' ' LYS . . . -129.68 159.76 35.45 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.25 178.385 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.427 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -104.17 120.78 41.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.21 0.529 . . . . 0.0 111.832 -179.246 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.49 ' ND2' ' HB ' ' A' ' 24' ' ' THR . 5.0 t30 -104.41 110.11 22.24 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.133 179.528 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -110.82 -32.29 6.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.518 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -63.67 -49.13 74.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.736 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -95.46 171.85 8.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.613 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.4 p -141.15 110.3 6.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.062 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.511 ' CZ ' ' CG2' ' A' ' 109' ' ' THR . 0.0 OUTLIER -62.64 -175.85 0.1 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.374 179.829 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.506 ' HB3' ' O ' ' A' ' 39' ' ' PHE . 1.1 pm0 160.94 44.56 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.094 179.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 48.8 88.61 0.01 OUTLIER Glycine 0 CA--C 1.52 0.346 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.006 -178.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -125.9 -155.12 0.66 Allowed 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.83 8.46 3.54 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.466 HD11 ' HG2' ' A' ' 53' ' ' LYS . 3.6 mm 75.2 2.32 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 179.685 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -93.85 -24.28 17.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.814 0.34 . . . . 0.0 110.896 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.6 t -93.59 -66.64 0.91 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.003 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -163.13 32.76 0.29 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.556 -0.83 . . . . 0.0 112.904 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.415 ' CB ' ' CD1' ' A' ' 44' ' ' ILE . . . -99.54 165.7 11.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.647 0.26 . . . . 0.0 110.925 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -109.74 149.39 29.85 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.876 0.37 . . . . 0.0 111.188 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.635 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 1.0 OUTLIER -58.66 -26.83 64.19 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.849 179.719 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' SER . . . . . 0.513 ' O ' HG23 ' A' ' 54' ' ' VAL . 20.6 p -70.34 -52.31 23.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.817 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.499 ' HB3' ' HG2' ' A' ' 107' ' ' GLN . 1.0 OUTLIER -53.03 -52.08 59.62 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.991 0.424 . . . . 0.0 110.535 179.434 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.635 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -57.9 -54.9 41.69 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.313 -179.967 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.534 HG23 ' O ' ' A' ' 50' ' ' GLU . 19.4 m -55.9 -46.56 80.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 CA-C-O 121.114 0.483 . . . . 0.0 110.165 179.6 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.489 ' CG ' ' HB2' ' A' ' 27' ' ' LEU . 0.5 OUTLIER -50.78 -45.73 59.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.899 178.767 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.428 ' HA ' HG23 ' A' ' 59' ' ' VAL . . . -60.36 -41.98 94.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.407 179.143 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.8 mm-40 -66.42 -36.91 84.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.371 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.439 ' CG2' ' HB3' ' A' ' 2' ' ' ASN . 59.5 p -73.9 -50.72 18.88 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 121.091 0.472 . . . . 0.0 110.045 179.774 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.553 ' O ' HG22 ' A' ' 63' ' ' VAL . 5.1 m -61.49 -46.81 95.82 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.696 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.988 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.419 ' N ' ' CG2' ' A' ' 59' ' ' VAL . 14.3 tp -66.38 -47.09 74.46 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.636 -0.256 . . . . 0.0 111.547 -179.858 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.5 m -61.06 -63.88 1.15 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.189 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -47.39 -30.36 3.24 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 121.101 0.477 . . . . 0.0 110.607 -179.737 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.633 HG13 HG11 ' A' ' 66' ' ' VAL . 25.1 t -80.32 -69.75 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.753 179.034 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.406 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 40.19 26.1 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 178.678 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.406 ' CB ' ' O ' ' A' ' 64' ' ' ALA . 0.7 OUTLIER 163.78 -74.38 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.775 0.321 . . . . 0.0 110.688 -179.764 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.817 HG12 ' HA ' ' A' ' 120' ' ' ALA . 25.0 m 44.02 -165.9 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.727 179.821 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.536 ' HB ' ' HB3' ' A' ' 97' ' ' ASN . 26.9 m -149.6 60.54 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.435 -1.206 0 CA-C-O 120.906 0.384 . . . . 0.0 111.511 -178.539 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.556 ' HB3' ' HB2' ' A' ' 72' ' ' ASP . 1.1 mp -49.21 101.4 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.619 -179.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 22.6 p -60.99 -166.78 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.92 -33.79 67.32 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.11 0.481 . . . . 0.0 110.862 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.42 ' O ' ' HE3' ' A' ' 75' ' ' LYS . 1.6 tm-20 -70.72 -65.45 0.73 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.205 -179.828 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.585 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 3.1 m-20 -51.03 -26.25 5.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.021 -179.655 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.446 ' CG2' ' OG ' ' A' ' 98' ' ' SER . 1.1 p -72.7 -54.62 8.49 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 177.868 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.48 ' HA ' ' CG ' ' A' ' 77' ' ' LEU . . . -54.45 -29.38 49.46 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 176.6 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.585 ' HB2' ' HA ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -58.75 -60.8 3.26 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 113.742 -1.572 . . . . 0.0 110.489 178.289 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.486 HD22 HD23 ' A' ' 100' ' ' LEU . 1.0 OUTLIER -52.83 -56.91 12.3 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.139 0.495 . . . . 0.0 110.483 179.41 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.48 ' CG ' ' HA ' ' A' ' 74' ' ' ALA . 3.3 pp -59.67 -31.13 69.27 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.119 -179.481 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.418 ' HB2' ' O ' ' A' ' 74' ' ' ALA . 20.0 mm-40 -70.59 -58.62 3.49 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.945 0.402 . . . . 0.0 110.351 179.321 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.2 t -50.46 -35.78 30.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.813 179.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.457 ' OG1' ' CE1' ' A' ' 88' ' ' TYR . 2.7 m . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.986 -179.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . 0.428 ' O ' ' HB2' ' A' ' 104' ' ' ARG . 0.1 OUTLIER . . . . . 0 CA--C 1.533 0.313 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.468 ' CE2' ' HB3' ' A' ' 76' ' ' LEU . 8.8 p90 -87.24 146.3 26.03 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-O 121.109 0.481 . . . . 0.0 111.702 -179.08 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.779 ' O ' ' O ' ' A' ' 101' ' ' VAL . 1.3 t0 -129.01 154.08 46.97 Favored 'General case' 0 N--CA 1.431 -1.404 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 178.62 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.496 ' N ' ' CD1' ' A' ' 90' ' ' LEU . 0.0 OUTLIER -157.9 147.79 20.17 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 114.668 1.358 . . . . 0.0 114.668 -178.578 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.528 ' HB3' ' HB ' ' A' ' 99' ' ' VAL . 0.0 OUTLIER -107.71 165.2 11.61 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 105.127 -2.175 . . . . 0.0 105.127 174.876 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.552 ' HA ' ' HA ' ' A' ' 98' ' ' SER . 75.6 p -139.42 165.18 27.9 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 116.065 1.876 . . . . 0.0 116.065 -177.689 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.594 ' C ' ' O ' ' A' ' 97' ' ' ASN . 0.2 OUTLIER . . . . . 0 C--N 1.323 -0.557 0 CA-C-N 111.448 -2.614 . . . . 0.0 107.502 178.583 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.594 ' O ' ' C ' ' A' ' 93' ' ' VAL . 0.3 OUTLIER . . . . . 0 N--CA 1.442 -0.835 0 CA-C-O 121.535 0.683 . . . . 0.0 111.885 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.552 ' HA ' ' HA ' ' A' ' 92' ' ' SER . 2.1 m -149.94 145.02 26.24 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 179.052 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . 0.528 ' HB ' ' HB3' ' A' ' 91' ' ' ARG . 73.7 t -103.48 152.69 6.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 120.887 0.375 . . . . 0.0 111.669 -177.033 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.56 ' CD2' ' HG ' ' A' ' 116' ' ' LEU . 0.0 OUTLIER -108.95 130.47 55.45 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 114.916 1.45 . . . . 0.0 114.916 -177.211 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.779 ' O ' ' O ' ' A' ' 89' ' ' ASP . 2.1 p -143.95 103.02 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 N-CA-C 104.581 -2.377 . . . . 0.0 104.581 174.315 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 0.536 ' HB2' ' H ' ' A' ' 89' ' ' ASP . 0.1 OUTLIER -146.42 164.49 32.29 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 119.065 -1.054 . . . . 0.0 113.17 -174.843 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.524 HD23 ' O ' ' A' ' 102' ' ' SER . 0.1 OUTLIER 156.17 -90.96 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 113.505 -1.679 . . . . 0.0 111.372 176.722 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.431 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 60.04 18.16 7.4 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 -179.407 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.431 ' CB ' ' O ' ' A' ' 104' ' ' ARG . 1.1 p 153.18 170.95 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -178.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.407 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.4 OUTLIER -110.73 100.02 8.85 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 119.25 -0.98 . . . . 0.0 111.452 179.264 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.499 ' HG2' ' HB3' ' A' ' 52' ' ' GLU . 1.3 mt-30 -169.19 164.96 11.1 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.742 -1.117 . . . . 0.0 109.174 177.685 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.4 ' HG2' HG21 ' A' ' 59' ' ' VAL . 2.3 tpt -160.76 145.49 14.13 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.121 0.486 . . . . 0.0 111.495 178.668 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.511 ' CG2' ' CZ ' ' A' ' 39' ' ' PHE . 0.6 OUTLIER -107.62 156.06 19.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.053 179.513 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.785 ' HB3' ' CG2' ' A' ' 16' ' ' VAL . 0.6 OUTLIER -46.77 -53.48 11.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.746 0.308 . . . . 0.0 111.151 -179.51 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . 0.578 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 0.2 OUTLIER -54.05 -61.95 1.97 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.212 179.324 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . 0.585 ' HA ' HG21 ' A' ' 115' ' ' VAL . 0.8 OUTLIER -46.54 -47.07 19.67 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.935 179.511 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . 0.457 ' CB ' ' CZ ' ' A' ' 55' ' ' PHE . . . -53.01 -56.51 15.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.838 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.621 ' NZ ' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -66.11 -28.77 69.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.827 179.94 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.585 HG21 ' HA ' ' A' ' 112' ' ' ASP . 94.1 t -57.15 -65.27 0.42 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.729 0 CA-C-O 122.029 0.919 . . . . 0.0 110.588 179.235 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.587 ' HB3' HG22 ' A' ' 63' ' ' VAL . 9.5 mp -63.5 -40.63 97.58 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 114.437 -1.256 . . . . 0.0 111.003 -179.131 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.566 ' CD2' ' HB3' ' A' ' 8' ' ' LEU . 0.6 OUTLIER -73.62 -15.92 61.25 Favored 'General case' 0 CA--C 1.512 -0.507 0 C-N-CA 120.325 -0.55 . . . . 0.0 111.341 -179.809 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.465 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 20.5 tt0 -73.57 -47.84 37.48 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 105.928 -1.878 . . . . 0.0 105.928 176.143 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . 0.416 ' CB ' ' HG ' ' A' ' 68' ' ' LEU . . . -71.77 -29.02 64.03 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 114.693 -1.139 . . . . 0.0 109.868 177.073 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.817 ' HA ' HG12 ' A' ' 66' ' ' VAL . . . -68.27 -64.82 0.79 Allowed 'General case' 0 CA--C 1.504 -0.808 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.612 179.614 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.553 ' HG ' ' N ' ' A' ' 122' ' ' ARG . 0.2 OUTLIER -57.52 -39.27 76.17 Favored 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 119.987 -0.685 . . . . 0.0 109.24 179.509 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.553 ' N ' ' HG ' ' A' ' 121' ' ' LEU . 19.8 ttm-85 -54.73 -45.16 74.05 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.94 179.153 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.407 ' HG3' HG22 ' A' ' 67' ' ' VAL . 1.4 tt0 -86.21 -31.63 21.62 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -178.806 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -95.75 -66.52 0.9 Allowed 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 -178.197 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 47.8 t . . . . . 0 C--N 1.33 -0.276 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 -177.595 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 1.6 p30 . . . . . 0 CA--C 1.532 0.284 0 CA-C-O 120.7 0.286 . . . . 0.0 110.831 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.526 ' HG ' HD13 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -106.85 -81.83 0.55 Allowed 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.108 -179.632 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.499 ' O ' ' HB2' ' A' ' 8' ' ' LEU . 34.9 t -178.23 -162.27 0.06 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.719 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.468 ' HB3' ' CB ' ' A' ' 121' ' ' LEU . 4.3 mt -95.38 -65.2 0.99 Allowed 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 121.24 0.543 . . . . 0.0 111.283 179.726 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.7 t -44.56 -39.32 4.83 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.636 -178.76 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.98 -62.8 1.58 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.266 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.526 HD13 ' HG ' ' A' ' 3' ' ' LEU . 2.7 tp -46.57 -41.69 14.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.357 0.598 . . . . 0.0 109.97 179.043 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.448 ' HA ' HG12 ' A' ' 12' ' ' VAL . 33.7 t-80 -69.34 -45.66 68.93 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.521 178.667 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.9 mtt-85 -54.87 -44.28 73.89 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.193 179.236 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.54 ' HB3' HG22 ' A' ' 31' ' ' VAL . 4.4 mp0 -64.63 -65.17 0.71 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.733 179.432 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.489 ' CA ' HG23 ' A' ' 31' ' ' VAL . 9.6 p -54.8 -47.81 74.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.082 -179.382 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.622 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 7.8 t -60.74 -50.22 74.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.404 -179.688 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -68.05 -22.47 64.94 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.374 -179.465 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 12.4 mt -74.31 -60.14 2.41 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.402 -179.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.613 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 0.9 OUTLIER -70.81 -28.57 34.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.204 -179.384 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.419 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 5.7 mm-40 -85.46 -9.07 57.98 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.73 -0.388 . . . . 0.0 111.312 -179.681 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.419 ' HG2' ' O ' ' A' ' 17' ' ' GLN . 7.0 mt-30 -152.92 42.38 0.61 Allowed 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 179.759 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 177.56 -69.54 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 179.667 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.613 ' HB2' ' HA ' ' A' ' 16' ' ' VAL . 20.0 m -70.62 -81.5 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.973 -0.558 . . . . 0.0 112.126 -178.315 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . 0.604 ' H ' ' HA ' ' A' ' 16' ' ' VAL . . . 120.42 -33.43 4.5 Favored Glycine 0 N--CA 1.45 -0.376 0 N-CA-C 111.549 -0.62 . . . . 0.0 111.549 -179.22 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 169.64 28.18 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 120.764 0.316 . . . . 0.0 110.98 179.692 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.418 ' HB2' ' HB3' ' A' ' 20' ' ' SER . 0.8 OUTLIER -80.74 -156.34 0.13 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.467 -179.903 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.524 ' HA ' ' HA ' ' A' ' 109' ' ' THR . 0.1 OUTLIER -104.02 163.05 12.64 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.813 0.339 . . . . 0.0 110.589 -179.944 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . 0.416 ' HA3' ' CE2' ' A' ' 55' ' ' PHE . . . -110.71 150.72 17.72 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.541 -0.837 . . . . 0.0 113.647 -178.922 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.67 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 0.3 OUTLIER -114.33 104.44 12.07 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.229 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.484 HD11 ' CD2' ' A' ' 55' ' ' PHE . 0.5 OUTLIER -107.31 152.66 23.84 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -178.108 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.483 ' CB ' ' O ' ' A' ' 27' ' ' LEU . 5.7 ptp180 143.34 55.84 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 114.281 -1.327 . . . . 0.0 109.574 179.007 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . 0.434 ' HA2' HD21 ' A' ' 3' ' ' LEU . . . 105.83 -12.8 45.98 Favored Glycine 0 C--N 1.333 0.407 0 N-CA-C 111.388 -0.685 . . . . 0.0 111.388 -178.71 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.415 ' O ' ' HA ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -166.38 165.23 17.28 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 179.849 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.67 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 1.4 m -121.8 117.29 51.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.244 0.545 . . . . 0.0 110.975 179.228 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -107.99 166.27 10.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.874 -179.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.416 ' CB ' HD13 ' A' ' 110' ' ' LEU . . . -103.36 119.73 39.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.094 0.473 . . . . 0.0 111.316 -179.503 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.485 ' ND2' ' CE2' ' A' ' 39' ' ' PHE . 7.0 t30 -98.56 122.09 41.32 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.931 -179.741 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.2 mtmm -118.68 -22.51 7.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.131 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -68.86 -16.21 63.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.486 -179.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.428 ' HB ' ' CZ ' ' A' ' 39' ' ' PHE . 0.1 OUTLIER -134.82 -175.14 3.8 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.985 0.421 . . . . 0.0 111.261 -179.786 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 72.3 p -147.86 106.84 3.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.872 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.546 ' CD2' ' HG3' ' A' ' 52' ' ' GLU . 21.8 m-85 -116.21 138.12 51.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.484 0.659 . . . . 0.0 112.57 -178.839 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -126.17 -45.99 1.67 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.065 179.419 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.462 ' HA2' ' HB2' ' A' ' 107' ' ' GLN . . . 177.04 76.43 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.278 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.112 179.231 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.613 ' H ' ' HB2' ' A' ' 107' ' ' GLN . 0.1 OUTLIER -113.2 -159.53 0.69 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 179.636 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.19 26.75 2.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.733 0.301 . . . . 0.0 111.793 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.433 ' HA ' ' CB ' ' A' ' 48' ' ' ALA . 1.1 mp 68.14 3.49 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 112.141 0.422 . . . . 0.0 112.141 179.536 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -93.89 -33.51 13.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.865 0.364 . . . . 0.0 110.874 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 3.2 t -98.83 -29.47 12.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.833 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 159.4 83.47 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.617 -0.801 . . . . 0.0 112.559 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.545 ' CB ' ' OE1' ' A' ' 107' ' ' GLN . . . -141.58 -177.48 5.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.044 0.45 . . . . 0.0 111.381 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.1 tpm_? -140.78 143.64 35.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.154 179.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.507 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 2.5 mp0 -48.57 -35.16 12.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.216 0.532 . . . . 0.0 110.981 -179.846 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' SER . . . . . 0.465 ' CB ' ' HG2' ' A' ' 26' ' ' LYS . 0.7 OUTLIER -63.4 -60.61 3.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.374 -179.817 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.546 ' HG3' ' CD2' ' A' ' 39' ' ' PHE . 0.5 OUTLIER -44.41 -65.74 0.48 Allowed 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.149 0.5 . . . . 0.0 110.568 -179.752 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.507 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -47.16 -50.03 21.32 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.796 179.366 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.43 ' CG2' ' O ' ' A' ' 50' ' ' GLU . 57.0 t -56.53 -39.19 60.56 Favored 'Isoleucine or valine' 0 C--O 1.231 0.112 0 CA-C-O 121.013 0.435 . . . . 0.0 109.906 179.085 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.652 ' HB3' ' HB3' ' A' ' 108' ' ' MET . 0.1 OUTLIER -56.66 -51.05 70.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.01 179.23 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -62.34 -32.79 73.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.509 179.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.2 tp-100 -71.26 -52.29 19.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.012 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.2 m -60.15 -48.22 82.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.076 -179.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.549 HG11 ' N ' ' A' ' 60' ' ' LEU . 9.7 p -66.36 -44.79 90.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 C-N-CA 120.585 -0.446 . . . . 0.0 111.314 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.549 ' N ' HG11 ' A' ' 59' ' ' VAL . 0.6 OUTLIER -54.21 -44.98 72.09 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 121.028 0.442 . . . . 0.0 110.208 179.774 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 42.3 m -63.11 -59.17 5.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.179 179.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . 0.448 ' CD2' ' CG ' ' A' ' 5' ' ' LEU . 0.1 OUTLIER -50.89 -49.45 59.36 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-O 120.861 0.362 . . . . 0.0 110.564 -179.951 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.612 HG11 HG13 ' A' ' 66' ' ' VAL . 73.5 t -58.13 -66.51 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.86 178.82 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.493 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 36.78 32.21 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.859 178.682 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.493 ' CB ' ' O ' ' A' ' 64' ' ' ALA . 9.8 t-20 155.29 -79.47 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 122.466 0.307 . . . . 0.0 110.759 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.69 HG11 ' HA ' ' A' ' 120' ' ' ALA . 15.9 m 46.68 -155.9 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 116.121 -0.491 . . . . 0.0 112.001 179.683 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.504 ' CG1' ' O ' ' A' ' 67' ' ' VAL . 8.1 p -172.93 60.96 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.112 0 CA-C-O 121.643 0.735 . . . . 0.0 111.017 -179.506 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.521 ' HB3' ' CB ' ' A' ' 72' ' ' ASP . 0.5 OUTLIER -42.62 99.05 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.101 -0.954 . . . . 0.0 112.465 -179.551 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.469 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 75.1 p -60.25 178.06 0.22 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.751 178.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.23 -31.96 1.72 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.996 0.427 . . . . 0.0 110.955 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.81 -64.34 0.88 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.502 179.667 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.612 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 69.0 m-20 -60.55 -27.85 67.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.363 179.611 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 20.3 m -62.62 -61.34 2.49 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.0 -26.14 61.99 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 177.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.612 ' HB2' ' HA ' ' A' ' 72' ' ' ASP . 0.4 OUTLIER -57.24 -64.06 1.01 Allowed 'General case' 0 C--O 1.235 0.306 0 CA-C-N 114.777 -1.101 . . . . 0.0 110.134 178.783 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.474 HD12 ' CD2' ' A' ' 68' ' ' LEU . 0.4 OUTLIER -57.96 -39.22 77.58 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.806 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -52.63 -43.73 65.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.798 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.46 -50.54 30.66 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.595 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' SER . . . . . 0.442 ' HB3' ' CG ' ' A' ' 111' ' ' GLN . 35.6 p -62.24 -26.55 68.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.635 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 13.1 t . . . . . 0 C--N 1.33 -0.278 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -179.124 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . 0.493 ' HB2' ' O ' ' A' ' 103' ' ' LEU . 29.4 p-10 . . . . . 0 CA--C 1.533 0.296 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.482 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 3.3 m-85 -102.83 131.87 49.41 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 120.958 0.408 . . . . 0.0 111.208 -179.194 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.664 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 1.0 OUTLIER -109.22 144.28 37.54 Favored 'General case' 0 N--CA 1.435 -1.206 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 -179.445 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.416 HD22 ' O ' ' A' ' 99' ' ' VAL . 39.7 mt -135.28 158.84 43.34 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -177.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.674 ' O ' ' CB ' ' A' ' 98' ' ' SER . 0.1 OUTLIER -134.16 161.32 35.22 Favored 'General case' 0 C--O 1.216 -0.659 0 CA-C-N 114.63 -1.168 . . . . 0.0 108.355 178.101 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.43 ' O ' ' CG1' ' A' ' 93' ' ' VAL . 17.9 p -103.96 157.93 16.76 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.82 0.819 . . . . 0.0 112.74 -178.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.593 ' O ' ' O ' ' A' ' 97' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.435 -1.197 0 CA-C-N 113.87 -1.514 . . . . 0.0 108.089 -179.171 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.593 ' O ' ' O ' ' A' ' 93' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.452 -0.354 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.674 ' CB ' ' O ' ' A' ' 91' ' ' ARG . 0.1 OUTLIER -140.41 165.34 27.68 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.184 0.516 . . . . 0.0 110.908 179.847 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . 0.416 ' O ' HD22 ' A' ' 90' ' ' LEU . 0.5 OUTLIER -104.14 150.68 7.13 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 115.361 -0.836 . . . . 0.0 108.869 179.562 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.608 HD22 ' HG ' ' A' ' 116' ' ' LEU . 3.2 tp -103.79 106.31 16.78 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 113.423 0.897 . . . . 0.0 113.423 -178.476 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.664 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 1.4 p -121.85 104.19 14.56 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.978 0 N-CA-C 104.007 -2.59 . . . . 0.0 104.007 174.623 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 0.536 ' O ' HD21 ' A' ' 103' ' ' LEU . 0.2 OUTLIER -149.87 161.31 42.53 Favored 'General case' 0 C--N 1.309 -1.194 0 C-N-CA 118.829 -1.148 . . . . 0.0 114.036 -173.841 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.536 HD21 ' O ' ' A' ' 102' ' ' SER . 0.1 OUTLIER 166.14 -69.48 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 113.478 -1.692 . . . . 0.0 112.278 175.343 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.552 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 35.14 56.18 0.79 Allowed 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.055 0.455 . . . . 0.0 110.228 179.6 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.552 ' CB ' ' O ' ' A' ' 104' ' ' ARG . 11.4 m 105.27 167.98 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.545 -177.579 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.42 ' HB3' ' CB ' ' A' ' 53' ' ' LYS . 0.5 OUTLIER -104.74 102.33 11.91 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.092 -0.643 . . . . 0.0 112.665 -178.545 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.613 ' HB2' ' H ' ' A' ' 42' ' ' LEU . 0.9 OUTLIER -168.72 165.1 12.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.841 177.989 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.652 ' HB3' ' HB3' ' A' ' 55' ' ' PHE . 18.6 ttm -165.59 143.4 5.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.346 0.593 . . . . 0.0 112.286 178.668 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.524 ' HA ' ' HA ' ' A' ' 24' ' ' THR . 0.1 OUTLIER -104.38 165.11 11.27 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.027 -0.988 . . . . 0.0 109.078 178.287 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.473 HD11 HG22 ' A' ' 16' ' ' VAL . 7.0 mt -56.03 -52.87 62.7 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.665 0.269 . . . . 0.0 111.395 -179.369 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . 0.551 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 1.8 tp60 -50.45 -65.19 0.6 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.786 0.327 . . . . 0.0 110.642 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . 0.473 ' HA ' HG23 ' A' ' 115' ' ' VAL . 0.3 OUTLIER -47.71 -45.53 28.69 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.096 0.474 . . . . 0.0 110.895 179.898 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . 0.468 ' CB ' ' CE1' ' A' ' 55' ' ' PHE . . . -49.42 -61.24 2.21 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.936 179.664 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.622 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -66.36 -25.52 66.84 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.239 -179.982 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.564 ' CG2' ' CG ' ' A' ' 75' ' ' LYS . 76.6 t -58.36 -65.11 0.46 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.808 0 CA-C-O 121.991 0.9 . . . . 0.0 110.305 179.37 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.608 ' HG ' HD22 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -62.95 -40.98 99.3 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.645 -179.476 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.453 ' CD1' ' CD2' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -69.03 -22.41 64.05 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 120.792 0.33 . . . . 0.0 111.433 -179.763 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.587 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 30.8 tt0 -69.75 -49.51 52.4 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 106.008 -1.849 . . . . 0.0 106.008 177.324 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . 0.651 ' O ' ' HB2' ' A' ' 123' ' ' GLN . . . -70.18 -28.27 65.18 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.081 177.384 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.69 ' HA ' HG11 ' A' ' 66' ' ' VAL . . . -72.05 -63.58 1.11 Allowed 'General case' 0 CA--C 1.511 -0.537 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.397 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.486 ' HG ' ' N ' ' A' ' 122' ' ' ARG . 0.0 OUTLIER -55.99 -42.35 76.23 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.314 -179.746 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.587 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.4 OUTLIER -67.37 -39.14 85.65 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.904 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.651 ' HB2' ' O ' ' A' ' 119' ' ' ALA . 1.7 mp0 -77.15 -36.73 54.99 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -178.711 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -96.17 -69.74 0.74 Allowed 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 -177.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 26.0 t . . . . . 0 N--CA 1.464 0.226 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -178.774 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.782 0.325 . . . . 0.0 110.815 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.484 ' CD1' ' HA ' ' A' ' 30' ' ' ASN . 1.2 mt -68.87 -81.56 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.062 0.458 . . . . 0.0 110.368 179.469 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.414 ' CB ' ' OD1' ' A' ' 7' ' ' ASP . 0.6 OUTLIER -170.12 -156.11 0.13 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.616 179.732 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.459 ' CD2' ' HB1' ' A' ' 120' ' ' ALA . 0.3 OUTLIER -95.71 -66.31 0.92 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.712 0.768 . . . . 0.0 112.429 -179.33 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.2 p -65.08 -41.14 95.31 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.549 -1.205 . . . . 0.0 112.87 -177.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . 0.414 ' OD1' ' CB ' ' A' ' 4' ' ' SER . 0.1 OUTLIER -67.53 -48.21 67.67 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.23 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.476 ' O ' ' HG2' ' A' ' 11' ' ' GLN . 18.2 tp -51.74 -46.58 64.09 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.927 178.738 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.571 ' CG ' ' CD2' ' A' ' 121' ' ' LEU . 46.1 t-80 -65.06 -39.92 93.98 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.538 178.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.06 -53.14 45.79 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.258 -179.691 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.502 ' HG3' ' CG1' ' A' ' 31' ' ' VAL . 0.0 OUTLIER -69.64 -55.38 10.2 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 120.885 -0.326 . . . . 0.0 111.566 -179.706 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.476 HG12 ' HA ' ' A' ' 9' ' ' HIS . 2.4 p -55.82 -46.82 80.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 CA-C-O 120.973 0.416 . . . . 0.0 111.244 -179.814 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.774 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 56.0 p -60.96 -53.32 58.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.309 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.457 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 0.6 OUTLIER -60.73 -21.09 62.59 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.823 0.344 . . . . 0.0 110.445 -179.916 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.453 ' CD1' HG11 ' A' ' 31' ' ' VAL . 4.8 mt -78.11 -65.54 0.96 Allowed 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 112.74 0.645 . . . . 0.0 112.74 -179.247 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.543 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 0.9 OUTLIER -72.49 -26.75 24.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.526 -0.47 . . . . 0.0 111.662 -178.863 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.466 ' HB2' ' O ' ' A' ' 13' ' ' SER . 3.5 mm100 -70.54 -21.86 62.67 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.461 -0.495 . . . . 0.0 110.326 179.639 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.457 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 2.1 pt20 -165.99 63.33 0.11 Allowed 'General case' 0 CA--C 1.528 0.113 0 CA-C-O 120.75 0.31 . . . . 0.0 111.318 179.376 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 175.53 -57.72 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.537 179.779 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.543 ' HB2' ' HA ' ' A' ' 16' ' ' VAL . 63.5 m -85.51 -39.63 17.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.647 -179.179 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 59.53 69.23 1.34 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.45 -0.881 . . . . 0.0 111.969 -179.447 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 58.77 88.7 0.06 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.977 0.418 . . . . 0.0 110.7 -179.635 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . 0.446 ' HB2' ' HB3' ' A' ' 20' ' ' SER . 97.1 m -149.79 -162.91 1.66 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.962 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.564 ' HA ' ' HB ' ' A' ' 109' ' ' THR . 0.0 OUTLIER -104.46 147.96 26.99 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.713 -179.923 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -104.99 140.6 15.07 Favored Glycine 0 N--CA 1.443 -0.834 0 C-N-CA 120.282 -0.961 . . . . 0.0 113.386 -178.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.45 ' HB3' ' CB ' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -104.45 121.77 44.13 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 178.967 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.455 HD11 ' CD1' ' A' ' 55' ' ' PHE . 8.7 tt -104.6 149.04 25.86 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.327 0.584 . . . . 0.0 112.243 -178.762 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 162.33 55.76 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.383 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 90.61 -8.1 80.32 Favored Glycine 0 C--N 1.332 0.336 0 N-CA-C 111.355 -0.698 . . . . 0.0 111.355 -178.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.484 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 0.0 OUTLIER -165.92 162.97 18.54 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 179.815 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.502 ' CG1' ' HG3' ' A' ' 11' ' ' GLN . 7.4 p -104.7 133.58 48.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 121.482 0.658 . . . . 0.0 110.784 178.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.45 ' CB ' ' HB3' ' A' ' 26' ' ' LYS . . . -113.22 166.38 11.51 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.657 -179.699 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.411 ' CB ' ' OG ' ' A' ' 20' ' ' SER . . . -102.14 105.95 16.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.617 0.722 . . . . 0.0 110.573 -179.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.434 HD22 ' HE1' ' A' ' 39' ' ' PHE . 62.0 t30 -91.47 114.35 26.85 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.604 -1.18 . . . . 0.0 111.321 -179.015 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -131.08 40.22 3.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.558 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -110.93 -38.89 4.97 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.589 -179.383 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.568 ' HB ' ' CE1' ' A' ' 39' ' ' PHE . 89.5 m -122.51 -106.44 0.36 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.511 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.639 ' O ' ' O ' ' A' ' 39' ' ' PHE . 0.7 OUTLIER -174.44 -49.1 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 113.037 0.754 . . . . 0.0 113.037 179.933 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.639 ' O ' ' O ' ' A' ' 38' ' ' THR . 0.9 OUTLIER 45.1 122.38 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.879 0.847 . . . . 0.0 110.977 -177.72 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.1 pp0? -128.61 40.38 3.66 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.0 -178.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.592 ' C ' ' HB2' ' A' ' 107' ' ' GLN . . . 90.24 8.53 66.37 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 115.396 -0.82 . . . . 0.0 113.112 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.605 ' HB3' ' OE1' ' A' ' 107' ' ' GLN . 0.3 OUTLIER -49.41 -166.58 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 117.04 0.42 . . . . 0.0 111.364 179.311 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.5 m -132.58 24.17 4.38 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -179.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.429 ' HA ' ' HB1' ' A' ' 48' ' ' ALA . 1.3 mp 67.4 2.89 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 179.627 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.74 -32.51 60.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.847 0.356 . . . . 0.0 111.011 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.8 t -82.06 -62.64 1.57 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.095 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -175.07 32.54 0.09 OUTLIER Glycine 0 C--N 1.331 0.281 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.997 -179.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.539 ' CB ' ' OE1' ' A' ' 107' ' ' GLN . . . -83.7 -163.95 0.84 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.073 0.463 . . . . 0.0 111.64 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -130.79 -178.31 4.74 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.134 179.528 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -83.03 -27.88 30.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.91 0.386 . . . . 0.0 110.842 179.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' SER . . . . . 0.437 ' CB ' ' HG2' ' A' ' 26' ' ' LYS . 1.5 m -55.41 -65.14 0.64 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.743 -179.724 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.561 ' HG3' ' CD2' ' A' ' 39' ' ' PHE . 31.2 mm-40 -49.39 -67.38 0.27 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.901 0.381 . . . . 0.0 111.641 -179.08 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.5 ' HG2' ' N ' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -40.54 -54.38 2.52 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.917 179.147 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.5 ' N ' ' HG2' ' A' ' 53' ' ' LYS . 77.3 t -58.09 -44.83 88.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.806 179.178 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.56 ' CG ' ' CE ' ' A' ' 108' ' ' MET . 0.5 OUTLIER -55.31 -33.49 63.34 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.488 178.995 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.455 ' O ' ' HG ' ' A' ' 60' ' ' LEU . . . -64.17 -65.2 0.71 Allowed 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 177.837 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . 0.423 ' HA ' HD11 ' A' ' 60' ' ' LEU . 3.7 mm-40 -37.46 -47.64 0.9 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.652 179.753 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 68.8 p -67.27 -46.56 73.29 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -179.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.542 HG12 ' HG ' ' A' ' 60' ' ' LEU . 11.9 p -72.23 -28.21 28.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -178.183 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.567 ' CD2' ' CD2' ' A' ' 103' ' ' LEU . 0.0 OUTLIER -92.97 -21.38 19.81 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 120.201 -0.599 . . . . 0.0 110.525 179.486 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.407 ' CB ' ' O ' ' A' ' 57' ' ' GLN . 44.7 m -79.82 -42.9 23.42 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 178.259 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -61.96 -49.2 77.06 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.873 179.353 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.517 ' CG2' ' HA ' ' A' ' 60' ' ' LEU . 2.8 m -58.23 -60.64 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.035 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.467 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 40.36 28.66 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.237 -0.438 . . . . 0.0 112.06 179.659 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.475 ' O ' ' CG2' ' A' ' 66' ' ' VAL . 0.9 OUTLIER 159.19 -80.26 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 120.724 0.297 . . . . 0.0 111.697 -179.679 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.548 ' CG1' ' HA ' ' A' ' 120' ' ' ALA . 23.0 m 49.98 -158.85 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.95 -179.142 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.58 ' CG1' ' O ' ' A' ' 67' ' ' VAL . 4.5 p -163.92 87.28 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 121.597 0.713 . . . . 0.0 109.777 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.661 ' HB3' ' HB2' ' A' ' 72' ' ' ASP . 1.1 mp -80.87 112.73 18.52 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.66 -177.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.575 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 2.3 p -89.97 -177.18 5.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.52 179.033 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.434 ' HA ' ' OG1' ' A' ' 73' ' ' THR . 0.0 OUTLIER -34.67 -39.06 0.08 Allowed 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.018 -179.312 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -69.27 -65.35 0.72 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.406 -179.435 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.661 ' HB2' ' HB3' ' A' ' 68' ' ' LEU . 0.7 OUTLIER -60.57 -30.91 70.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.685 -179.902 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.532 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 1.5 p -61.86 -64.32 0.97 Allowed 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 178.247 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -53.23 -25.84 15.69 Favored 'General case' 0 N--CA 1.456 -0.163 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.594 ' HB2' ' HA ' ' A' ' 72' ' ' ASP . 0.1 OUTLIER -58.92 -56.33 23.66 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.187 178.765 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.405 HD11 ' CD1' ' A' ' 90' ' ' LEU . 1.3 mp -63.47 -47.91 79.85 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 178.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' A' ' 73' ' ' THR . 4.9 mt -58.61 -29.68 66.67 Favored 'General case' 0 N--CA 1.461 0.097 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.355 179.406 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -72.72 -47.66 45.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.533 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 22.0 p -59.06 -38.76 80.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.697 179.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.415 HG21 ' HA ' ' A' ' 77' ' ' LEU . 15.3 t . . . . . 0 C--N 1.331 -0.23 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.281 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . 0.538 ' OD1' ' HA3' ' A' ' 41' ' ' GLY . 0.4 OUTLIER . . . . . 0 C--O 1.244 0.804 0 CA-C-O 121.703 0.763 . . . . 0.0 110.387 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.556 ' HA ' ' HB3' ' A' ' 102' ' ' SER . 4.7 m-85 -101.96 152.23 21.19 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.457 -179.85 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.721 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.2 OUTLIER -124.34 143.93 50.3 Favored 'General case' 0 N--CA 1.443 -0.813 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 -179.353 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.405 ' CD1' HD11 ' A' ' 76' ' ' LEU . 11.8 mt -133.02 151.96 52.01 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -177.232 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.636 ' O ' ' CB ' ' A' ' 98' ' ' SER . 0.0 OUTLIER -134.19 159.43 40.94 Favored 'General case' 0 C--O 1.218 -0.575 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.048 178.291 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.444 ' O ' ' CG1' ' A' ' 93' ' ' VAL . 0.7 OUTLIER -103.98 160.95 14.39 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.738 0.78 . . . . 0.0 112.56 -178.882 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.513 ' O ' ' O ' ' A' ' 97' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.441 -0.891 0 CA-C-N 113.992 -1.458 . . . . 0.0 108.5 -179.215 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.575 ' HA ' ' HA ' ' A' ' 69' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.393 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.636 ' CB ' ' O ' ' A' ' 91' ' ' ARG . 0.1 OUTLIER -141.85 163.95 31.52 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.278 0.561 . . . . 0.0 110.941 -179.811 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -104.72 151.65 7.04 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.825 179.782 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.568 ' HG ' ' HG ' ' A' ' 116' ' ' LEU . 0.1 OUTLIER -104.13 105.85 16.16 Favored 'General case' 0 CA--C 1.509 -0.602 0 CA-C-O 121.68 0.752 . . . . 0.0 112.439 -179.684 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.721 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 43.6 t -122.15 105.67 16.65 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.978 0 N-CA-C 105.348 -2.093 . . . . 0.0 105.348 175.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 0.643 ' O ' ' HB2' ' A' ' 103' ' ' LEU . 73.7 m -146.37 153.3 40.34 Favored 'General case' 0 C--N 1.309 -1.157 0 C-N-CA 119.256 -0.978 . . . . 0.0 113.051 -175.427 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.643 ' HB2' ' O ' ' A' ' 102' ' ' SER . 1.2 mm? 144.19 67.21 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 114.612 -1.176 . . . . 0.0 112.643 176.7 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.491 ' CB ' ' HB2' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -101.85 21.31 14.82 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 114.686 -1.143 . . . . 0.0 108.012 177.023 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.581 ' CB ' ' O ' ' A' ' 41' ' ' GLY . 4.3 m 159.02 160.32 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 -179.003 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.436 ' C ' ' O ' ' A' ' 42' ' ' LEU . 0.4 OUTLIER -104.79 102.85 12.39 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 -177.168 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.626 ' NE2' ' HB3' ' A' ' 39' ' ' PHE . 1.0 OUTLIER -168.39 162.66 12.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.289 177.278 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.56 ' CE ' ' CG ' ' A' ' 55' ' ' PHE . 0.0 OUTLIER -165.38 126.06 1.9 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.27 0.557 . . . . 0.0 112.067 179.95 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.564 ' HB ' ' HA ' ' A' ' 24' ' ' THR . 4.7 p -103.0 162.73 12.69 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.558 -179.638 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.535 HD11 HG21 ' A' ' 16' ' ' VAL . 1.0 OUTLIER -39.34 -64.85 0.43 Allowed 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.293 -179.576 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . 0.492 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 1.5 tp60 -43.69 -64.35 0.67 Allowed 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.278 179.653 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -44.19 -41.75 5.98 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 121.232 0.539 . . . . 0.0 110.597 179.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . 0.455 ' CA ' ' SD ' ' A' ' 108' ' ' MET . . . -60.07 -65.09 0.74 Allowed 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.494 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.774 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.2 OUTLIER -55.88 -25.56 43.07 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.967 179.611 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.537 ' CG2' ' CG ' ' A' ' 75' ' ' LYS . 72.7 t -65.36 -64.62 0.68 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.739 0 CA-C-O 121.657 0.741 . . . . 0.0 110.728 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.729 ' O ' ' HB2' ' A' ' 120' ' ' ALA . 9.8 mp -63.86 -30.74 71.8 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.448 -179.591 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.59 ' HA ' ' HB1' ' A' ' 120' ' ' ALA . 2.1 mp -79.07 -26.4 43.04 Favored 'General case' 0 CA--C 1.511 -0.535 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.256 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.53 ' HB2' ' O ' ' A' ' 114' ' ' LYS . 0.8 OUTLIER -66.38 -48.35 70.43 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 177.278 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . 0.409 ' N ' ' OD2' ' A' ' 72' ' ' ASP . . . -74.6 -25.35 59.19 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 114.992 -1.004 . . . . 0.0 109.695 177.1 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.729 ' HB2' ' O ' ' A' ' 116' ' ' LEU . . . -68.73 -60.17 2.59 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.469 179.496 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.571 ' CD2' ' CG ' ' A' ' 9' ' ' HIS . 1.0 OUTLIER -65.51 -33.77 76.71 Favored 'General case' 0 N--CA 1.444 -0.748 0 C-N-CA 120.202 -0.599 . . . . 0.0 109.695 179.638 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.523 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.1 OUTLIER -58.45 -46.47 86.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.828 179.494 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -94.53 -29.82 14.71 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 113.769 1.025 . . . . 0.0 113.769 -177.769 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -96.42 -68.38 0.8 Allowed 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -177.399 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 6.0 p . . . . . 0 C--N 1.329 -0.325 0 N-CA-C 113.005 0.742 . . . . 0.0 113.005 -177.503 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . 0.401 ' HB3' ' CG2' ' A' ' 58' ' ' THR . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.869 0.366 . . . . 0.0 110.899 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . 0.63 ' CD1' ' HB2' ' A' ' 8' ' ' LEU . 4.1 pp -68.89 -172.84 0.42 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.447 179.691 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' SER . . . . . 0.464 ' O ' ' CD1' ' A' ' 3' ' ' LEU . 0.1 OUTLIER -63.97 130.72 45.21 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.135 0.493 . . . . 0.0 112.03 -179.035 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.524 ' CD1' ' CD2' ' A' ' 117' ' ' LEU . 0.1 OUTLIER -51.08 -65.74 0.5 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.025 -179.939 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -48.96 -30.12 5.6 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.59 0.234 . . . . 0.0 111.418 -179.244 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . 0.516 ' O ' ' HB3' ' A' ' 11' ' ' GLN . 0.9 OUTLIER -73.39 -44.83 57.66 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.046 0.45 . . . . 0.0 109.973 179.385 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.63 ' HB2' ' CD1' ' A' ' 3' ' ' LEU . 1.5 tp -73.8 -30.57 62.8 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.964 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' HIS . . . . . 0.487 ' CE1' ' HA ' ' A' ' 118' ' ' GLU . 21.4 t60 -68.25 -54.3 18.59 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 121.677 0.751 . . . . 0.0 109.214 179.656 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.494 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 0.6 OUTLIER -63.57 -36.89 85.29 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 114.584 -1.189 . . . . 0.0 108.988 179.164 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.556 ' HG3' ' CG2' ' A' ' 31' ' ' VAL . 0.0 OUTLIER -60.49 -65.47 0.68 Allowed 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.917 178.477 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' VAL . . . . . 0.576 ' HA ' ' CD1' ' A' ' 15' ' ' LEU . 5.7 p -56.69 -51.99 59.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.809 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.519 ' O ' ' HB2' ' A' ' 17' ' ' GLN . 2.5 p -63.49 -27.3 69.18 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.224 -179.388 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.494 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -76.81 -41.03 45.94 Favored 'General case' 0 CA--C 1.514 -0.405 0 C-N-CA 120.281 -0.568 . . . . 0.0 111.344 -179.02 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.576 ' CD1' ' HA ' ' A' ' 12' ' ' VAL . 0.1 OUTLIER -68.67 -53.2 23.74 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 119.707 -0.797 . . . . 0.0 110.043 179.627 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . 0.727 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 10.4 p -65.47 -47.84 85.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.75 -178.483 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . 0.519 ' HB2' ' O ' ' A' ' 13' ' ' SER . 1.0 OUTLIER -61.76 -18.65 60.64 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.169 -0.612 . . . . 0.0 110.964 -179.783 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.419 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 1.5 pt20 -158.84 61.65 0.42 Allowed 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 120.73 -0.388 . . . . 0.0 111.869 179.557 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.476 ' N ' ' O ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER 169.87 -44.59 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.331 179.339 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.727 ' HB2' ' HA ' ' A' ' 16' ' ' VAL . 14.7 m -105.69 -28.41 10.72 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.387 -179.39 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLY . . . . . 0.403 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . 79.41 -59.7 4.35 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.245 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -173.55 21.77 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 120.617 0.246 . . . . 0.0 111.227 179.712 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -61.09 -156.81 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.736 -179.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.63 ' HB ' ' HB3' ' A' ' 34' ' ' ASN . 0.3 OUTLIER -103.56 149.78 24.56 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 179.854 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -105.0 128.54 9.48 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.448 -0.882 . . . . 0.0 113.224 -179.009 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.625 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 0.0 OUTLIER -104.6 129.19 52.73 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 178.884 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.564 ' O ' ' HB2' ' A' ' 28' ' ' ARG . 0.3 OUTLIER -104.14 165.63 10.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.545 -179.024 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.564 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER 144.97 50.16 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.488 1.115 . . . . 0.0 109.949 179.891 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 93.7 -9.61 73.38 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 120.912 -0.661 . . . . 0.0 111.67 -179.1 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.466 ' C ' ' ND2' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -165.58 156.17 13.44 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 179.713 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.625 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 0.6 OUTLIER -109.5 132.18 58.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 C-N-CA 119.785 -0.766 . . . . 0.0 111.237 179.727 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.428 ' CB ' ' HG3' ' A' ' 26' ' ' LYS . . . -117.41 166.96 11.71 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.869 -1.059 . . . . 0.0 110.859 -179.406 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.418 ' CB ' ' OG ' ' A' ' 20' ' ' SER . . . -103.28 119.49 38.97 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.16 0.505 . . . . 0.0 111.3 -179.393 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.63 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 8.3 t30 -100.0 137.02 39.03 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.73 -179.728 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.7 ttmp? -121.9 9.9 10.1 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.51 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.63 -61.02 2.58 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 120.963 0.411 . . . . 0.0 110.428 179.709 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.517 ' CG2' ' CE1' ' A' ' 39' ' ' PHE . 0.1 OUTLIER -137.04 -78.94 0.39 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.264 179.339 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.455 ' O ' ' CG2' ' A' ' 24' ' ' THR . 9.3 t 176.03 -41.95 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.059 0.457 . . . . 0.0 111.352 179.727 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.517 ' CE1' ' CG2' ' A' ' 37' ' ' THR . 9.0 m-85 59.52 135.68 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.798 0.809 . . . . 0.0 111.498 -178.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLN . . . . . 0.599 ' H ' ' NE2' ' A' ' 107' ' ' GLN . 0.3 OUTLIER -169.41 76.61 0.1 Allowed 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.586 -1.188 . . . . 0.0 108.835 179.645 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.446 ' C ' ' HB2' ' A' ' 105' ' ' SER . . . 69.37 106.04 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.615 0 CA-C-N 115.353 -0.839 . . . . 0.0 112.696 -178.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.663 ' HB2' ' NE2' ' A' ' 107' ' ' GLN . 5.3 tp -159.01 -141.77 0.09 Allowed 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 178.798 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -162.72 25.62 0.1 Allowed 'General case' 0 C--N 1.33 -0.241 0 O-C-N 122.204 -0.31 . . . . 0.0 111.693 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.43 ' CG2' ' O ' ' A' ' 48' ' ' ALA . 29.4 mt 63.36 5.04 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 179.576 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -87.18 -55.55 3.76 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.801 0.334 . . . . 0.0 111.474 -179.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.74 -28.34 61.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.152 -179.627 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.14 80.19 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.196 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.606 ' HB2' ' OE1' ' A' ' 107' ' ' GLN . . . -151.52 132.5 14.26 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.714 0.292 . . . . 0.0 111.21 -179.634 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.2 mtt-85 -68.14 -177.18 0.81 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.745 0.307 . . . . 0.0 110.398 179.232 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.516 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 0.9 OUTLIER -87.8 -35.92 17.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.001 0.429 . . . . 0.0 110.766 179.821 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' SER . . . . . 0.592 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 18.2 p -56.05 -62.78 1.47 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.171 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.467 ' OE2' ' HB2' ' A' ' 48' ' ' ALA . 0.0 OUTLIER -34.72 -67.08 0.15 Allowed 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.882 -179.811 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.536 ' HB3' ' O ' ' A' ' 106' ' ' ASP . 2.7 ptpt -56.87 -46.75 81.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.418 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.471 ' CG2' ' O ' ' A' ' 50' ' ' GLU . 97.8 t -54.7 -41.32 55.39 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-O 121.046 0.45 . . . . 0.0 110.038 179.439 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.469 ' CE1' ' HB2' ' A' ' 113' ' ' ALA . 1.9 t80 -61.63 -49.75 75.34 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.872 178.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.488 ' HA ' ' SD ' ' A' ' 108' ' ' MET . . . -50.44 -48.06 56.49 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.108 179.805 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -62.25 -47.02 86.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.639 179.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' THR . . . . . 0.427 HG21 ' CD2' ' A' ' 27' ' ' LEU . 24.0 p -63.7 -49.5 72.87 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.378 -179.696 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . 0.509 HG22 HG22 ' A' ' 63' ' ' VAL . 14.0 p -65.67 -48.89 80.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.786 179.76 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.429 ' N ' HG11 ' A' ' 59' ' ' VAL . 13.1 tp -50.25 -49.9 51.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.725 0.298 . . . . 0.0 110.774 179.588 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.6 m -63.93 -41.81 97.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.736 179.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.21 -20.86 64.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.961 179.756 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' VAL . . . . . 0.617 HG12 HG11 ' A' ' 66' ' ' VAL . 4.6 t -105.01 37.81 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.061 0.458 . . . . 0.0 111.121 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.494 ' O ' ' HB2' ' A' ' 65' ' ' ASN . . . -65.64 91.23 0.13 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.677 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.494 ' HB2' ' O ' ' A' ' 64' ' ' ALA . 10.0 m120 93.28 -61.11 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.679 -0.691 . . . . 0.0 112.22 179.514 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.617 HG11 HG12 ' A' ' 63' ' ' VAL . 33.7 m 39.03 -140.08 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -179.387 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' VAL . . . . . 0.561 ' CG1' ' O ' ' A' ' 67' ' ' VAL . 4.6 p -175.62 67.42 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 CA-C-O 121.71 0.767 . . . . 0.0 111.215 179.63 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.531 ' N ' ' O ' ' A' ' 98' ' ' SER . 2.4 mp -62.66 103.69 0.45 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.86 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' THR . . . . . 0.828 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 0.6 OUTLIER -78.42 -177.88 5.48 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.642 179.278 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -37.34 -37.42 0.19 Allowed 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.3 -179.257 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.513 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 2.5 tt0 -66.12 -65.43 0.68 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.987 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.55 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 82.3 m-20 -60.3 -28.09 67.83 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.087 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 36.5 m -64.0 -64.06 0.99 Allowed 'General case' 0 C--O 1.239 0.516 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 178.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.488 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . . . -56.68 -25.11 53.13 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 108.787 -0.819 . . . . 0.0 108.787 177.407 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.562 ' CG ' ' CG2' ' A' ' 115' ' ' VAL . 0.3 OUTLIER -59.35 -54.63 44.55 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 114.733 -1.121 . . . . 0.0 110.224 178.743 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.426 ' HG ' ' CG1' ' A' ' 115' ' ' VAL . 1.9 mt -64.49 -48.04 76.71 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.838 0.352 . . . . 0.0 110.181 179.272 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.488 ' CD2' ' HA ' ' A' ' 74' ' ' ALA . 0.4 OUTLIER -63.83 -23.62 67.43 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.034 -179.765 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -78.37 -47.83 16.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.833 0.349 . . . . 0.0 110.883 179.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -64.6 -33.75 76.65 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.184 179.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' THR . . . . . 0.432 ' CG2' ' CD2' ' A' ' 88' ' ' TYR . 11.4 p . . . . . 0 C--N 1.327 -0.39 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.943 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . 0.472 ' HA ' ' HB2' ' A' ' 104' ' ' ARG . 7.0 p30 . . . . . 0 C--O 1.243 0.738 0 CA-C-O 120.871 0.367 . . . . 0.0 111.968 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' TYR . . . . . 0.509 ' HA ' ' CB ' ' A' ' 102' ' ' SER . 1.3 m-85 -99.79 135.62 40.94 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 120.435 -0.506 . . . . 0.0 110.447 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.697 ' HB3' ' O ' ' A' ' 101' ' ' VAL . 0.7 OUTLIER -107.47 142.44 37.33 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 -179.93 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 11.1 mt -132.23 147.24 52.4 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 113.337 0.865 . . . . 0.0 113.337 -176.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.416 ' O ' ' OG ' ' A' ' 98' ' ' SER . 0.0 OUTLIER -133.47 127.81 34.09 Favored 'General case' 0 C--O 1.224 -0.261 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 177.845 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' SER . . . . . 0.424 ' O ' ' CG1' ' A' ' 93' ' ' VAL . 0.7 OUTLIER -104.39 145.95 29.53 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 113.955 1.094 . . . . 0.0 113.955 -177.428 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' VAL . . . . . 0.424 ' CG1' ' O ' ' A' ' 92' ' ' SER . 4.9 m . . . . . 0 CA--C 1.542 0.644 0 CA-C-N 113.691 -1.595 . . . . 0.0 108.558 179.09 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.828 ' HA ' ' HA ' ' A' ' 69' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.448 -0.552 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' SER . . . . . 0.531 ' O ' ' N ' ' A' ' 68' ' ' LEU . 3.1 t -140.19 163.02 33.85 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.482 0.658 . . . . 0.0 111.32 -179.517 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' VAL . . . . . 0.443 HG23 ' HA ' ' A' ' 65' ' ' ASN . 1.2 t -107.45 146.23 13.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-N 115.04 -0.982 . . . . 0.0 108.74 178.912 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.495 ' CD2' HG11 ' A' ' 63' ' ' VAL . 0.1 OUTLIER -103.87 114.36 28.56 Favored 'General case' 0 CA--C 1.513 -0.454 0 C-N-CA 119.766 -0.774 . . . . 0.0 112.136 -179.662 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' VAL . . . . . 0.697 ' O ' ' HB3' ' A' ' 89' ' ' ASP . 0.9 OUTLIER -120.36 104.19 15.1 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.015 0 N-CA-C 104.288 -2.486 . . . . 0.0 104.288 175.453 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' SER . . . . . 0.608 ' O ' ' HB2' ' A' ' 103' ' ' LEU . 0.9 OUTLIER -141.39 152.51 44.39 Favored 'General case' 0 C--N 1.307 -1.263 0 C-N-CA 119.807 -0.757 . . . . 0.0 112.713 -174.907 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' LEU . . . . . 0.608 ' HB2' ' O ' ' A' ' 102' ' ' SER . 0.4 OUTLIER 147.7 59.66 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 114.506 -1.224 . . . . 0.0 112.441 176.529 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' ARG . . . . . 0.472 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -83.86 -6.38 59.41 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.308 -0.86 . . . . 0.0 108.739 177.434 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.608 ' HB3' ' N ' ' A' ' 42' ' ' LEU . 58.7 m -177.92 171.92 1.72 Allowed 'General case' 0 C--O 1.232 0.147 0 CA-C-N 114.553 -1.203 . . . . 0.0 108.105 179.258 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ASP . . . . . 0.536 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -104.74 101.88 11.48 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 119.693 -0.803 . . . . 0.0 112.754 -178.492 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' GLN . . . . . 0.663 ' NE2' ' HB2' ' A' ' 42' ' ' LEU . 0.7 OUTLIER -169.76 162.99 9.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.273 177.534 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' MET . . . . . 0.488 ' SD ' ' HA ' ' A' ' 56' ' ' ALA . 0.3 OUTLIER -165.77 144.15 5.94 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.426 -0.51 . . . . 0.0 112.142 179.005 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' THR . . . . . 0.485 ' HA ' ' HA ' ' A' ' 24' ' ' THR . 30.2 p -110.11 165.29 11.86 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.719 179.362 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' LEU . . . . . 0.45 ' HB3' ' HB ' ' A' ' 16' ' ' VAL . 6.5 mt -52.46 -59.18 4.74 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.584 179.615 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' GLN . . . . . 0.538 ' HA ' ' CD ' ' A' ' 114' ' ' LYS . 13.6 tp60 -47.67 -65.48 0.56 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.817 0.342 . . . . 0.0 110.634 179.577 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' ASP . . . . . 0.491 ' HA ' HG23 ' A' ' 115' ' ' VAL . 16.5 m-20 -46.63 -45.98 19.49 Favored 'General case' 0 C--O 1.236 0.395 0 CA-C-O 121.477 0.656 . . . . 0.0 110.429 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' ALA . . . . . 0.532 ' O ' HD12 ' A' ' 117' ' ' LEU . . . -51.65 -63.32 1.17 Allowed 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.35 179.256 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . 0.575 ' HE3' ' CG1' ' A' ' 16' ' ' VAL . 0.0 OUTLIER -62.04 -20.05 63.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.281 179.902 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.562 ' CG2' ' CG ' ' A' ' 75' ' ' LYS . 74.2 t -65.06 -65.11 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.886 0 CA-C-O 122.013 0.911 . . . . 0.0 109.967 179.399 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' LEU . . . . . 0.592 ' O ' ' HB3' ' A' ' 120' ' ' ALA . 0.1 OUTLIER -61.62 -35.58 78.29 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.399 179.693 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' LEU . . . . . 0.535 HD23 ' HB3' ' A' ' 8' ' ' LEU . 0.3 OUTLIER -70.51 -24.24 62.8 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.9 179.36 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' GLU . . . . . 0.487 ' HA ' ' CE1' ' A' ' 9' ' ' HIS . 1.7 tt0 -69.35 -46.85 66.02 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 106.741 -1.578 . . . . 0.0 106.741 177.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' ALA . . . . . 0.479 ' CB ' ' HG ' ' A' ' 68' ' ' LEU . . . -77.52 -22.18 51.57 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 114.695 -1.139 . . . . 0.0 110.236 177.651 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' ALA . . . . . 0.592 ' HB3' ' O ' ' A' ' 116' ' ' LEU . . . -75.06 -56.71 4.46 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.78 179.471 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' LEU . . . . . 0.465 HD23 ' CG ' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -60.8 -37.43 81.93 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 178.208 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' ARG . . . . . 0.475 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.5 OUTLIER -60.99 -46.37 91.04 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.356 179.97 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -95.29 -19.5 19.93 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -177.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' GLU . . . . . 0.445 ' CG ' ' O ' ' A' ' 120' ' ' ALA . 2.9 mm-40 -95.32 -66.62 0.9 Allowed 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.867 0.691 . . . . 0.0 112.867 -178.393 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 1.2 p . . . . . 0 C--N 1.326 -0.425 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -178.172 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.5 mtm . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.853 0.359 . . . . 0.0 111.182 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.411 ' HB3' ' CG2' ' A' ' 58' ' ' THR . 7.1 p-10 -161.36 -163.71 1.04 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.918 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.44 ' HB2' ' CD2' ' A' ' 8' ' ' LEU . 5.1 mp -73.1 172.89 10.21 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.909 0.385 . . . . 0.0 110.497 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.4 p -88.62 135.68 33.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.077 179.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.5 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 2.9 mt -37.4 -62.02 0.55 Allowed 'General case' 0 CA--C 1.504 -0.792 0 CA-C-O 121.434 0.635 . . . . 0.0 111.712 -179.621 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -40.44 -65.01 0.45 Allowed 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 114.553 -1.203 . . . . 0.0 111.378 -179.192 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . 0.534 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 0.7 OUTLIER -61.63 -44.57 96.74 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.982 0.42 . . . . 0.0 109.95 178.873 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.535 ' HB3' ' CD2' ' A' ' 117' ' ' LEU . 0.0 OUTLIER -45.41 -65.0 0.6 Allowed 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.791 178.87 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.549 ' O ' ' CB ' ' A' ' 13' ' ' SER . 61.1 t60 -52.77 -39.87 62.64 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.603 178.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.534 ' HB2' ' O ' ' A' ' 7' ' ' ASP . 8.3 mmt180 -56.94 -62.48 1.71 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.846 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.492 ' HG3' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -64.75 -53.26 49.93 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 120.299 -0.561 . . . . 0.0 111.168 179.894 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.606 ' HA ' ' CD1' ' A' ' 15' ' ' LEU . 8.1 p -53.96 -51.07 49.12 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 C-N-CA 120.63 -0.428 . . . . 0.0 111.343 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.575 ' HA ' ' CE ' ' A' ' 114' ' ' LYS . 21.6 t -63.68 -31.19 72.28 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -179.552 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 20.0 tpp180 -70.99 -35.3 72.05 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 120.236 -0.585 . . . . 0.0 110.966 -178.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.606 ' CD1' ' HA ' ' A' ' 12' ' ' VAL . 0.1 OUTLIER -75.35 -52.66 10.28 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 119.974 -0.691 . . . . 0.0 110.593 179.841 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.581 HG22 ' O ' ' A' ' 12' ' ' VAL . 1.8 t -60.81 -55.14 26.6 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.96 -179.367 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -61.02 -17.83 54.37 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -178.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 15.9 pt20 -170.39 71.44 0.06 Allowed 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.527 -0.469 . . . . 0.0 111.977 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.46 ' HB2' ' HA ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER 170.3 -38.18 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.117 179.382 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.414 ' N ' ' O ' ' A' ' 15' ' ' LEU . 70.1 m -115.33 -24.03 8.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.54 -179.362 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 56.66 55.34 30.45 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.457 -0.877 . . . . 0.0 111.945 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.418 ' HA ' ' CG1' ' A' ' 16' ' ' VAL . 0.3 OUTLIER 59.97 82.9 0.14 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.136 0.493 . . . . 0.0 110.768 -179.544 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.428 ' O ' ' HB ' ' A' ' 109' ' ' THR . 0.1 OUTLIER -133.97 -151.9 0.46 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.703 179.851 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.635 ' HB ' ' HB3' ' A' ' 34' ' ' ASN . 0.2 OUTLIER -103.9 134.37 47.31 Favored 'General case' 0 CA--C 1.52 -0.184 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.179 179.609 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -104.5 141.01 15.19 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.399 -0.905 . . . . 0.0 112.619 -179.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.53 ' HB2' ' CB ' ' A' ' 51' ' ' SER . 0.0 OUTLIER -104.5 130.27 52.44 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 179.877 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.479 ' CD1' ' CD1' ' A' ' 55' ' ' PHE . 0.7 OUTLIER -111.12 153.17 26.09 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.296 0.57 . . . . 0.0 112.293 -178.468 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.405 ' HD2' ' NZ ' ' A' ' 26' ' ' LYS . 2.7 mtm180 161.2 61.35 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.188 179.559 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 79.74 -0.34 82.31 Favored Glycine 0 N--CA 1.45 -0.379 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 -177.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.509 ' C ' ' ND2' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -165.93 165.84 17.87 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 -179.682 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.492 HG12 ' HG3' ' A' ' 11' ' ' GLN . 9.1 p -111.9 137.91 42.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.24 0.543 . . . . 0.0 111.074 178.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.428 ' CB ' ' CG ' ' A' ' 26' ' ' LYS . . . -125.39 165.72 17.89 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.783 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -103.93 127.89 51.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.295 0.569 . . . . 0.0 111.717 -179.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.635 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 50.3 t30 -116.3 115.93 26.81 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.628 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.68 -28.6 3.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.279 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -48.6 -72.6 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.207 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.418 ' O ' ' CB ' ' A' ' 38' ' ' THR . 57.9 p -86.95 -103.43 0.07 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.423 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.51 ' O ' ' HB3' ' A' ' 39' ' ' PHE . 0.2 OUTLIER 164.66 -111.69 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.581 ' CG ' ' N ' ' A' ' 40' ' ' GLN . 0.1 OUTLIER 172.54 -164.61 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 179.98 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.581 ' N ' ' CG ' ' A' ' 39' ' ' PHE . 0.2 OUTLIER 160.34 37.6 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.078 0.551 . . . . 0.0 110.494 179.501 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.53 ' C ' ' HB2' ' A' ' 107' ' ' GLN . . . 77.72 -26.24 2.03 Favored Glycine 0 CA--C 1.526 0.727 0 CA-C-N 115.755 -0.657 . . . . 0.0 113.091 -179.159 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.453 ' O ' ' HB2' ' A' ' 107' ' ' GLN . 1.8 mp -32.62 135.03 0.09 Allowed 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.4 m -95.39 36.08 1.27 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.422 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.458 ' O ' ' CG2' ' A' ' 44' ' ' ILE . 5.1 mp 66.02 0.0 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.079 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -74.92 -25.56 59.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.927 0.394 . . . . 0.0 110.761 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.5 t -101.33 -66.01 0.94 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.144 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -170.59 52.25 0.19 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.602 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.405 ' CB ' ' OE1' ' A' ' 107' ' ' GLN . . . -113.34 -178.73 3.45 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.015 0.436 . . . . 0.0 111.11 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.72 126.28 51.97 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.786 179.268 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -46.97 -28.36 1.6 Allowed 'General case' 0 C--O 1.233 0.206 0 CA-C-O 120.98 0.419 . . . . 0.0 110.468 179.848 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.53 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 82.7 p -59.22 -62.49 1.84 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.935 179.502 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.485 ' CB ' ' HG2' ' A' ' 107' ' ' GLN . 0.4 OUTLIER -42.65 -57.6 2.65 Favored 'General case' 0 C--O 1.231 0.082 0 CA-C-O 121.188 0.518 . . . . 0.0 110.435 179.639 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.436 ' HB3' HD11 ' A' ' 44' ' ' ILE . 0.1 OUTLIER -46.85 -61.9 1.64 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.88 179.151 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 30.9 t -50.07 -46.86 24.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.812 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.479 ' CD1' ' CD1' ' A' ' 27' ' ' LEU . 0.4 OUTLIER -58.95 -33.42 70.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.329 179.263 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -67.76 -43.91 78.71 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.847 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.1 mm-40 -67.42 -33.87 76.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.057 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.411 ' CG2' ' HB3' ' A' ' 2' ' ' ASN . 11.8 p -77.46 -41.29 40.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.061 -179.507 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.472 ' CG1' ' CD1' ' A' ' 55' ' ' PHE . 21.0 m -73.49 -31.28 32.42 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.844 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.538 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.429 ' N ' HG21 ' A' ' 59' ' ' VAL . 10.1 tp -77.84 -37.89 47.42 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-O 120.906 0.384 . . . . 0.0 110.101 178.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 6.3 t -67.73 -53.06 30.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.793 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . 0.423 ' CE1' ' HG ' ' A' ' 5' ' ' LEU . 2.0 m-70 -47.82 -50.17 26.88 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 120.791 0.329 . . . . 0.0 110.199 179.471 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.467 HG12 HG12 ' A' ' 66' ' ' VAL . 0.9 OUTLIER -68.38 -74.48 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.35 179.48 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.457 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 60.91 13.95 4.88 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.506 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.457 ' CB ' ' O ' ' A' ' 64' ' ' ALA . 0.3 OUTLIER 159.72 -66.47 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 120.849 0.357 . . . . 0.0 111.644 -179.663 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.518 ' CG1' ' HA ' ' A' ' 120' ' ' ALA . 14.8 m 48.11 -127.66 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 115.79 -0.641 . . . . 0.0 112.248 -179.199 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.522 ' O ' ' O ' ' A' ' 98' ' ' SER . 5.9 p -174.54 -18.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 N-CA-C 113.107 0.781 . . . . 0.0 113.107 -179.303 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.485 HD11 ' HB3' ' A' ' 100' ' ' LEU . 3.5 mp 32.81 105.05 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 178.688 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 18.9 p -66.12 -153.42 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 177.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -68.64 -34.54 75.9 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.122 0.487 . . . . 0.0 110.114 179.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.43 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 0.8 OUTLIER -64.04 -65.77 0.63 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.362 -179.631 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.563 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 1.0 OUTLIER -50.92 -32.26 20.14 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.755 0.312 . . . . 0.0 110.936 -179.929 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 85.1 m -62.61 -63.51 1.2 Allowed 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.4 -24.43 59.99 Favored 'General case' 0 C--N 1.333 -0.116 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 177.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.577 ' CG ' ' CG2' ' A' ' 115' ' ' VAL . 0.2 OUTLIER -57.13 -65.42 0.62 Allowed 'General case' 0 C--O 1.236 0.36 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.514 179.074 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.454 ' CD1' ' CD2' ' A' ' 68' ' ' LEU . 0.5 OUTLIER -60.48 -42.22 95.82 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 178.913 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -54.15 -36.45 63.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.801 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -75.66 -60.45 2.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.321 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.58 -32.05 70.02 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.206 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.402 ' OG1' ' CD1' ' A' ' 88' ' ' TYR . 54.5 m -79.51 -59.59 2.69 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.346 -179.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 20.7 t -72.53 -6.92 8.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.772 -179.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.66 -74.49 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.775 0.321 . . . . 0.0 111.376 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 76.1 t60 -93.29 -80.04 0.39 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.022 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -178.36 -161.11 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.908 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 2.7 mm? 61.91 87.4 0.1 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.845 0.355 . . . . 0.0 110.685 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 13.0 p-10 -63.18 113.16 2.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.308 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . 0.404 ' OD1' ' O ' ' A' ' 103' ' ' LEU . 0.0 OUTLIER -122.43 -32.79 3.56 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.774 179.795 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.522 ' CZ ' ' CG ' ' A' ' 112' ' ' ASP . 2.5 m-85 -96.59 141.8 29.42 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 121.038 0.447 . . . . 0.0 110.757 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.732 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.5 OUTLIER -117.06 140.29 49.67 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 179.732 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.427 ' CD2' ' HA ' ' A' ' 100' ' ' LEU . 34.0 mt -143.31 154.55 43.89 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -177.018 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.464 ' O ' ' OG ' ' A' ' 98' ' ' SER . 0.0 OUTLIER -143.77 131.9 21.82 Favored 'General case' 0 C--O 1.223 -0.334 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 177.176 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.424 ' O ' ' CG1' ' A' ' 93' ' ' VAL . 54.2 p -103.96 146.01 29.31 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 -176.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.424 ' CG1' ' O ' ' A' ' 92' ' ' SER . 10.4 m -164.8 -126.01 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 CA-C-N 113.616 -1.629 . . . . 0.0 108.683 179.237 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.479 ' O ' ' N ' ' A' ' 96' ' ' GLY . . . 36.95 30.73 0.04 OUTLIER Glycine 0 C--N 1.336 0.554 0 C-N-CA 121.155 -0.545 . . . . 0.0 114.088 178.447 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . 0.415 ' CG ' ' N ' ' A' ' 96' ' ' GLY . 0.0 OUTLIER 66.22 -56.42 0.38 Allowed 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 -178.658 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.479 ' N ' ' O ' ' A' ' 94' ' ' GLY . . . -136.61 21.82 3.38 Favored Glycine 0 N--CA 1.444 -0.829 0 N-CA-C 110.379 -1.088 . . . . 0.0 110.379 177.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.419 ' O ' ' O ' ' A' ' 93' ' ' VAL . 0.0 OUTLIER -123.27 166.18 15.7 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-O 120.697 0.284 . . . . 0.0 110.385 -179.68 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.522 ' O ' ' O ' ' A' ' 67' ' ' VAL . 4.1 t -140.49 162.88 34.3 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.371 0.605 . . . . 0.0 110.834 -179.581 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.4 ' O ' HD22 ' A' ' 90' ' ' LEU . 1.2 t -103.18 136.8 34.13 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.957 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 178.658 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.501 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 0.1 OUTLIER -104.3 110.37 22.58 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-O 121.911 0.863 . . . . 0.0 113.032 -177.695 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.732 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -118.69 103.61 14.81 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.997 0 N-CA-C 103.878 -2.638 . . . . 0.0 103.878 175.023 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.512 ' O ' HD22 ' A' ' 103' ' ' LEU . 0.3 OUTLIER -139.75 154.59 47.46 Favored 'General case' 0 C--N 1.309 -1.192 0 C-N-CA 119.015 -1.074 . . . . 0.0 113.732 -174.756 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.512 HD22 ' O ' ' A' ' 102' ' ' SER . 0.0 OUTLIER 166.81 -91.38 0.0 OUTLIER 'General case' 0 N--CA 1.438 -1.063 0 CA-C-N 113.662 -1.608 . . . . 0.0 111.515 176.796 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.574 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 48.6 59.18 4.53 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 -179.532 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.574 ' CB ' ' O ' ' A' ' 104' ' ' ARG . 4.9 t 102.53 157.82 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 -176.479 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.95 100.87 10.47 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 119.211 -0.996 . . . . 0.0 112.799 -178.685 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.53 ' HB2' ' C ' ' A' ' 41' ' ' GLY . 1.5 tt0 -168.03 122.92 0.97 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.838 -1.074 . . . . 0.0 109.874 177.325 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -122.8 164.46 18.33 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.172 0.51 . . . . 0.0 111.531 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.449 ' CG2' ' CE1' ' A' ' 39' ' ' PHE . 1.5 p -121.79 165.4 15.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.771 -179.63 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.497 ' HB3' ' CG2' ' A' ' 16' ' ' VAL . 5.5 mt -51.86 -49.87 62.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.778 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 1.5 tp60 -59.82 -64.05 1.09 Allowed 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.119 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.575 ' HA ' HG22 ' A' ' 115' ' ' VAL . 24.8 m-20 -48.02 -44.87 31.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.901 179.434 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.405 ' HB2' ' CZ ' ' A' ' 55' ' ' PHE . . . -56.4 -54.2 48.42 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.08 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.575 ' CE ' ' HA ' ' A' ' 13' ' ' SER . 0.3 OUTLIER -62.5 -34.68 77.34 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.505 179.413 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.577 ' CG2' ' CG ' ' A' ' 75' ' ' LYS . 84.4 t -55.84 -65.48 0.37 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.827 0 CA-C-O 121.931 0.872 . . . . 0.0 111.299 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.577 ' O ' ' HB2' ' A' ' 120' ' ' ALA . 0.0 OUTLIER -59.93 -37.75 80.4 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.311 -179.106 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.535 ' CD2' ' HB3' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -73.66 -21.36 60.3 Favored 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 120.505 -0.478 . . . . 0.0 111.621 -179.994 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.479 ' HB2' ' O ' ' A' ' 114' ' ' LYS . 0.1 OUTLIER -69.17 -47.4 65.04 Favored 'General case' 0 CA--C 1.503 -0.83 0 N-CA-C 106.442 -1.688 . . . . 0.0 106.442 177.479 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . 0.422 ' CB ' ' HG ' ' A' ' 68' ' ' LEU . . . -76.12 -25.31 55.26 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 114.747 -1.115 . . . . 0.0 109.909 177.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.577 ' HB2' ' O ' ' A' ' 116' ' ' LEU . . . -69.8 -60.64 2.18 Favored 'General case' 0 CA--C 1.508 -0.666 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.979 179.395 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.679 ' O ' ' N ' ' A' ' 126' ' ' GLY . 0.2 OUTLIER -62.4 -39.39 93.09 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.193 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.56 ' N ' ' HG ' ' A' ' 121' ' ' LEU . 0.1 OUTLIER -52.37 -58.18 7.49 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.186 179.481 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 92.3 mm-40 -81.74 -26.37 34.59 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 -178.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . 0.42 ' CG ' ' O ' ' A' ' 120' ' ' ALA . 3.6 mm-40 -96.06 -66.65 0.89 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.847 1.054 . . . . 0.0 113.847 -178.164 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -95.72 -65.86 0.95 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -177.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . 0.679 ' N ' ' O ' ' A' ' 121' ' ' LEU . . . 64.72 82.42 0.1 Allowed Glycine 0 N--CA 1.448 -0.526 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 -178.514 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . 68.38 38.9 2.34 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -178.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 72.08 105.82 0.07 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.817 -179.223 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . -145.87 -39.2 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.332 0 CA-C-N 115.733 -0.667 . . . . 0.0 112.453 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 10.8 t . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.892 -179.942 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.071 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 65.6 m-20 -112.83 -176.38 2.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.817 0.341 . . . . 0.0 110.932 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -65.96 -162.62 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.764 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 204' ' ' PTR . . . . . 0.459 ' HD1' ' ND2' ' A' ' 30' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -78.03 -60.39 2.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.852 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 206' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -121.18 145.08 41.16 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.896 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . 0.499 ' HA ' ' HB2' ' A' ' 30' ' ' ASN . 85.7 Cg_endo -78.43 -163.06 0.2 Allowed 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.826 2.351 . . . . 0.0 112.534 -179.842 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 208' ' ' PHE . . . . . 0.454 ' CZ ' ' HB3' ' A' ' 10' ' ' ARG . 0.6 OUTLIER 71.02 118.84 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.873 -179.967 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.466 -0.334 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.663 0.268 . . . . 0.0 111.339 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.525 ' CG ' ' H ' ' A' ' 3' ' ' LEU . 2.5 p30 -101.92 -72.3 0.69 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.915 0.388 . . . . 0.0 111.078 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.536 HD22 ' HA ' ' A' ' 30' ' ' ASN . 2.6 mp -164.05 -75.23 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.278 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.411 ' O ' ' CB ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER 171.07 -170.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.726 -179.842 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.46 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 6.5 mt -95.52 -63.26 1.18 Allowed 'General case' 0 CA--C 1.505 -0.765 0 CA-C-O 121.293 0.568 . . . . 0.0 111.558 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.42 ' HB3' ' CA ' ' A' ' 129' ' ' GLY . 0.0 OUTLIER -59.54 -47.19 86.48 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 115.195 -0.911 . . . . 0.0 112.075 -178.162 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -65.59 -55.1 19.49 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.33 0.586 . . . . 0.0 110.021 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.455 ' HB3' HD22 ' A' ' 117' ' ' LEU . 8.6 tp -55.2 -45.7 75.86 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.102 179.019 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.422 ' CD2' HD22 ' A' ' 121' ' ' LEU . 76.4 t60 -54.4 -45.66 72.96 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.227 179.154 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.527 ' HB3' ' CZ ' ' B' ' 208' ' ' PHE . 36.9 mtt180 -59.31 -52.88 63.74 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.594 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.464 ' HG3' HG13 ' A' ' 31' ' ' VAL . 3.3 tp-100 -57.31 -57.41 12.74 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 121.149 0.5 . . . . 0.0 110.706 179.461 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.47 HG21 ' CD1' ' A' ' 110' ' ' LEU . 7.4 p -58.83 -46.11 91.16 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.717 -179.804 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.707 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 35.9 t -55.34 -64.07 0.96 Allowed 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.954 -0.566 . . . . 0.0 112.002 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.464 ' O ' ' CG ' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -60.16 -32.78 71.37 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.056 -179.115 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 9.7 mt -59.57 -65.37 0.68 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.925 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.658 ' CG2' ' HB3' ' A' ' 110' ' ' LEU . 0.5 OUTLIER -65.53 -24.99 35.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.144 -179.523 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.38 -4.88 47.65 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -178.787 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.464 ' CG ' ' O ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -140.38 23.9 2.31 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 120.392 -0.523 . . . . 0.0 112.382 179.558 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -177.69 -69.85 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.493 ' CB ' ' HA ' ' A' ' 16' ' ' VAL . 0.1 OUTLIER -46.51 -53.06 12.02 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.703 -178.787 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 80.93 37.57 18.66 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.558 -0.83 . . . . 0.0 112.031 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.635 ' H ' HG21 ' A' ' 16' ' ' VAL . 7.7 t70 78.13 21.87 0.84 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.823 0.344 . . . . 0.0 110.715 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.42 ' O ' ' OG1' ' A' ' 109' ' ' THR . 0.0 OUTLIER -76.28 -151.97 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.708 179.978 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.522 ' HB ' ' HB3' ' A' ' 34' ' ' ASN . 0.0 OUTLIER -103.51 165.35 11.09 Favored 'General case' 0 CA--C 1.519 -0.243 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 -179.987 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.467 ' HA2' ' O ' ' A' ' 32' ' ' ALA . . . -127.58 156.18 20.4 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.041 -1.076 . . . . 0.0 113.909 -178.721 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.557 ' HB2' ' CB ' ' A' ' 51' ' ' SER . 0.0 OUTLIER -125.75 123.88 39.8 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.998 -0.601 . . . . 0.0 109.96 179.488 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.463 ' HB2' ' CG ' ' A' ' 55' ' ' PHE . 2.6 tt -113.15 144.34 42.82 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.419 0.628 . . . . 0.0 111.922 -179.376 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 169.77 54.23 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.729 179.672 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.433 ' O ' HD22 ' A' ' 3' ' ' LEU . . . 109.17 -19.31 29.88 Favored Glycine 0 N--CA 1.45 -0.433 0 N-CA-C 110.468 -1.053 . . . . 0.0 110.468 -177.673 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.536 ' HA ' HD22 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -166.14 165.45 17.67 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 179.481 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.464 HG13 ' HG3' ' A' ' 11' ' ' GLN . 2.1 p -106.74 133.38 51.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 121.348 0.594 . . . . 0.0 110.836 178.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.522 ' O ' HD21 ' A' ' 110' ' ' LEU . . . -123.52 166.27 15.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.404 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.405 ' CB ' ' OG ' ' A' ' 20' ' ' SER . . . -102.61 138.42 39.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.543 0.687 . . . . 0.0 112.381 -178.216 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.522 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 31.4 t30 -114.94 123.5 49.28 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 114.698 -1.137 . . . . 0.0 110.531 -179.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.1 mtmp? -135.86 21.96 3.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.068 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -119.02 -24.59 6.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.338 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 4.9 p -118.09 177.55 4.75 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.988 0.423 . . . . 0.0 111.105 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.409 ' O ' ' NE2' ' A' ' 40' ' ' GLN . 12.3 p -128.63 115.04 17.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.312 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.615 ' C ' ' NE2' ' A' ' 107' ' ' GLN . 4.2 p90 -68.45 -84.87 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.591 -179.138 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.553 ' N ' ' CG ' ' A' ' 39' ' ' PHE . 0.0 OUTLIER 63.96 54.45 1.72 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.382 0.673 . . . . 0.0 112.711 179.924 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.566 ' O ' ' O ' ' A' ' 42' ' ' LEU . . . 69.2 -50.55 0.56 Allowed Glycine 0 CA--C 1.526 0.72 0 CA-C-N 116.088 -0.505 . . . . 0.0 113.095 179.618 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.566 ' O ' ' O ' ' A' ' 41' ' ' GLY . 0.8 OUTLIER 3.94 125.75 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.454 1.101 . . . . 0.0 113.92 179.102 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.428 ' C ' ' H ' ' A' ' 45' ' ' ALA . 0.8 OUTLIER -91.2 56.98 3.28 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.976 -179.617 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.444 ' HA ' ' HB3' ' A' ' 48' ' ' ALA . 1.8 mp 49.55 9.26 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 179.052 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.428 ' H ' ' C ' ' A' ' 43' ' ' THR . . . -100.75 -56.78 2.25 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -178.448 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.458 ' CB ' ' CD1' ' A' ' 42' ' ' LEU . 0.3 OUTLIER -54.5 -26.79 33.65 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.741 -178.883 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 140.51 38.99 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.378 -0.915 . . . . 0.0 112.929 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.444 ' HB3' ' HA ' ' A' ' 44' ' ' ILE . . . -93.96 -167.04 1.61 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.799 0.333 . . . . 0.0 110.447 179.504 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.445 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 0.7 OUTLIER -128.94 146.86 50.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.574 179.664 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.515 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 8.5 tt0 -53.14 -24.05 9.62 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.099 0.476 . . . . 0.0 110.706 179.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.672 ' O ' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -61.7 -65.25 0.72 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.454 -179.441 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.544 ' HB2' ' HG2' ' A' ' 107' ' ' GLN . 0.6 OUTLIER -53.23 -50.52 64.58 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.713 0.292 . . . . 0.0 111.783 -179.221 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.515 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -55.22 -57.13 13.03 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 111.716 0.265 . . . . 0.0 111.716 -179.35 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.672 HG23 ' O ' ' A' ' 51' ' ' SER . 15.7 m -54.36 -47.55 69.42 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 120.662 -0.415 . . . . 0.0 110.383 179.503 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.494 ' CZ ' ' CB ' ' A' ' 113' ' ' ALA . 0.6 OUTLIER -48.37 -42.72 32.51 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.812 178.785 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.411 ' CA ' ' HB2' ' A' ' 108' ' ' MET . . . -64.24 -44.95 90.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.316 178.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 50.6 mm-40 -56.73 -47.46 79.96 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.13 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.458 HG21 ' O ' ' A' ' 55' ' ' PHE . 0.1 OUTLIER -64.02 -64.08 0.98 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.309 -179.702 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.477 ' O ' HG23 ' A' ' 63' ' ' VAL . 12.0 p -46.28 -51.73 3.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.971 -179.6 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.411 ' CD1' ' O ' ' A' ' 102' ' ' SER . 0.4 OUTLIER -55.6 -49.17 73.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.815 0.341 . . . . 0.0 110.835 179.235 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.8 m -55.57 -60.6 3.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.239 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . 0.415 ' HB3' ' CD2' ' A' ' 5' ' ' LEU . 1.7 m170 -49.51 -37.36 26.31 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 121.094 0.473 . . . . 0.0 110.123 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.605 ' CG2' ' HB3' ' A' ' 116' ' ' LEU . 40.8 t -75.64 -82.19 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.247 179.194 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.475 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 72.62 -6.72 1.56 Allowed 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 178.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.506 ' H ' HG12 ' A' ' 63' ' ' VAL . 6.5 m-20 153.46 -61.52 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.394 0.677 . . . . 0.0 109.365 -179.378 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.624 HG11 ' HA ' ' A' ' 120' ' ' ALA . 0.1 OUTLIER 44.23 -100.96 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 CA-C-N 115.243 -0.89 . . . . 0.0 112.842 178.903 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.599 ' HB ' ' O ' ' A' ' 66' ' ' VAL . 0.3 OUTLIER 167.38 107.87 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.343 0.289 0 CA-C-O 121.594 0.711 . . . . 0.0 109.833 -179.519 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.599 ' HB3' ' CB ' ' A' ' 72' ' ' ASP . 0.1 OUTLIER -110.29 112.63 24.71 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.752 -178.071 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.538 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 11.0 p -83.37 178.7 7.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.608 -0.723 . . . . 0.0 110.788 179.291 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -41.0 -31.14 0.16 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.558 -179.696 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -68.97 -57.8 4.98 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.943 0.401 . . . . 0.0 110.396 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.619 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 65.4 m-20 -69.3 -39.87 78.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.722 179.742 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 62.1 m -61.3 -41.23 96.63 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-O 121.296 0.569 . . . . 0.0 109.622 178.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.487 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . . . -71.24 -30.74 66.69 Favored 'General case' 0 CA--C 1.512 -0.506 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 177.744 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.619 ' HB2' ' HA ' ' A' ' 72' ' ' ASP . 0.3 OUTLIER -55.01 -50.36 69.22 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 114.322 -1.308 . . . . 0.0 109.426 177.92 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.48 ' HB3' ' CE2' ' A' ' 88' ' ' TYR . 1.4 mt -67.29 -56.75 8.49 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.466 179.205 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.487 ' CD2' ' HA ' ' A' ' 74' ' ' ALA . 0.6 OUTLIER -54.57 -26.85 34.85 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.476 179.808 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -72.53 -54.81 8.18 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.232 179.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' SER . . . . . 0.424 ' HB3' ' CG ' ' A' ' 111' ' ' GLN . 0.0 OUTLIER -52.65 -36.19 56.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.676 179.551 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 86.0 m -78.12 -62.96 1.51 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.788 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.41 ' CG2' ' O ' ' A' ' 77' ' ' LEU . 32.7 m -50.6 -35.39 13.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 N-CA-C 111.841 0.312 . . . . 0.0 111.841 -179.275 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 3.8 mmtm -50.7 -70.02 0.1 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.118 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -172.0 45.6 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.897 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 70.8 m-20 -137.3 169.58 17.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.893 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -88.33 173.68 8.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.74 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.431 ' O ' ' HB3' ' A' ' 87' ' ' ASN . 7.5 m120 -60.07 -89.21 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.587 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . 0.548 ' HA ' ' HB2' ' A' ' 104' ' ' ARG . 9.7 t-20 72.64 -42.65 0.54 Allowed 'General case' 0 C--O 1.238 0.47 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 179.507 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.501 ' HB2' ' HB3' ' A' ' 102' ' ' SER . 6.9 p90 -96.73 160.57 14.3 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 121.232 0.539 . . . . 0.0 112.397 -178.587 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.708 ' HB3' ' O ' ' A' ' 101' ' ' VAL . 0.8 OUTLIER -131.9 140.7 49.14 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 178.593 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.405 ' CD1' ' CD1' ' A' ' 76' ' ' LEU . 8.0 mt -133.94 155.27 50.23 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 -176.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.664 ' O ' ' HB3' ' A' ' 98' ' ' SER . 0.0 OUTLIER -139.96 150.25 44.27 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.293 178.439 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.448 ' O ' ' CG1' ' A' ' 93' ' ' VAL . 33.7 p -104.47 159.33 15.82 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 121.77 0.795 . . . . 0.0 112.648 -179.02 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.57 ' O ' ' O ' ' A' ' 97' ' ' ASN . 0.0 OUTLIER 165.38 150.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.146 0 CA-C-N 113.853 -1.521 . . . . 0.0 108.199 -179.389 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.59 ' HA3' ' OD1' ' A' ' 97' ' ' ASN . . . 97.43 30.39 7.34 Favored Glycine 0 C--N 1.293 -1.846 0 C-N-CA 120.076 -1.059 . . . . 0.0 113.337 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . 0.407 ' O ' ' ND2' ' A' ' 95' ' ' ASN . 1.1 p-10 42.14 29.18 0.13 Allowed 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 121.37 0.605 . . . . 0.0 110.115 -179.04 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.402 ' O ' ' HB ' ' A' ' 69' ' ' THR . . . 141.46 23.1 0.24 Allowed Glycine 0 N--CA 1.442 -0.933 0 CA-C-N 115.261 -0.881 . . . . 0.0 112.729 -179.153 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.59 ' OD1' ' HA3' ' A' ' 94' ' ' GLY . 0.5 OUTLIER -128.01 167.64 16.42 Favored 'General case' 0 N--CA 1.438 -1.049 0 N-CA-C 106.86 -1.533 . . . . 0.0 106.86 177.999 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.664 ' HB3' ' O ' ' A' ' 91' ' ' ARG . 3.5 m -147.48 159.85 43.26 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 119.343 -0.943 . . . . 0.0 111.39 -178.274 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 1.2 t -103.56 140.42 21.78 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 179.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.487 ' CD2' ' CD1' ' A' ' 116' ' ' LEU . 0.1 OUTLIER -103.57 111.07 23.37 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-O 121.764 0.792 . . . . 0.0 112.899 -178.197 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.708 ' O ' ' HB3' ' A' ' 89' ' ' ASP . 0.1 OUTLIER -123.88 103.52 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.194 0 N-CA-C 104.202 -2.518 . . . . 0.0 104.202 175.003 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.6 ' O ' ' HB2' ' A' ' 103' ' ' LEU . 12.2 p -140.37 142.24 35.54 Favored 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 119.669 -0.813 . . . . 0.0 112.068 -175.73 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.6 ' HB2' ' O ' ' A' ' 102' ' ' SER . 0.2 OUTLIER 147.74 79.29 0.0 OUTLIER 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.784 177.531 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.548 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -98.31 28.43 4.1 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 177.487 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.491 ' HB3' ' O ' ' A' ' 41' ' ' GLY . 6.9 m 148.83 179.21 0.0 OUTLIER 'General case' 0 C--N 1.343 0.293 0 CA-C-N 113.749 -1.569 . . . . 0.0 107.047 -178.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -104.14 101.34 11.09 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 119.1 0.864 . . . . 0.0 111.908 -178.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.615 ' NE2' ' C ' ' A' ' 39' ' ' PHE . 0.6 OUTLIER -169.46 165.05 10.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.308 178.434 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.432 ' HG2' HG12 ' A' ' 59' ' ' VAL . 1.8 tpt -165.21 142.46 5.88 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.3 0.572 . . . . 0.0 112.008 178.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.456 ' CG2' ' CZ ' ' A' ' 39' ' ' PHE . 0.5 OUTLIER -104.83 159.55 15.7 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.709 179.112 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.658 ' HB3' ' CG2' ' A' ' 16' ' ' VAL . 0.9 OUTLIER -46.44 -55.75 6.96 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.357 0.599 . . . . 0.0 109.977 179.411 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.862 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 2.2 tp-100 -53.05 -66.7 0.34 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.791 -179.214 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.833 ' O ' HG22 ' A' ' 115' ' ' VAL . 7.5 m-20 -44.61 -37.57 3.7 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.525 0.679 . . . . 0.0 110.746 -179.699 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.494 ' CB ' ' CZ ' ' A' ' 55' ' ' PHE . . . -62.63 -44.24 96.79 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.384 179.205 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.862 ' HD2' ' HA ' ' A' ' 111' ' ' GLN . 0.0 OUTLIER -79.28 -21.9 45.41 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.77 -179.578 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.833 HG22 ' O ' ' A' ' 112' ' ' ASP . 13.2 m -69.55 -48.87 63.64 Favored 'Isoleucine or valine' 0 C--O 1.242 0.688 0 CA-C-O 122.165 0.984 . . . . 0.0 109.209 179.164 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.605 ' HB3' ' CG2' ' A' ' 63' ' ' VAL . 1.2 mp -71.5 -36.82 71.24 Favored 'General case' 0 N--CA 1.433 -1.3 0 CA-C-N 114.148 -1.387 . . . . 0.0 110.068 179.525 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.631 ' HA ' ' HB2' ' A' ' 120' ' ' ALA . 0.2 OUTLIER -75.83 -20.12 58.39 Favored 'General case' 0 CA--C 1.51 -0.578 0 C-N-CA 120.421 -0.512 . . . . 0.0 110.767 178.935 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.431 ' HA ' HD23 ' A' ' 121' ' ' LEU . 28.6 tp10 -71.66 -50.23 32.42 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 177.531 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . 0.522 ' HA ' ' HB3' ' A' ' 122' ' ' ARG . . . -72.28 -33.27 67.31 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.863 177.287 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.631 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . . . -60.82 -64.82 0.82 Allowed 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.824 179.367 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -58.42 -31.5 67.78 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.716 179.077 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.522 ' HB3' ' HA ' ' A' ' 119' ' ' ALA . 0.0 OUTLIER -59.5 -65.15 0.72 Allowed 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.958 -179.798 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.461 ' CB ' HG13 ' A' ' 66' ' ' VAL . 1.4 tm0? -86.71 -4.7 59.21 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 113.376 0.88 . . . . 0.0 113.376 -177.486 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . 0.402 ' HG2' HG11 ' A' ' 66' ' ' VAL . 5.0 mm-40 -93.83 -67.34 0.86 Allowed 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 119.895 -0.722 . . . . 0.0 111.614 -179.675 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.402 ' CB ' ' HB2' ' A' ' 128' ' ' ARG . 9.8 p -96.93 -39.26 9.46 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.492 -179.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 85.43 68.08 1.38 Allowed Glycine 0 CA--C 1.5 -0.846 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 -178.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . 49.65 27.46 2.19 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 -177.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . 0.402 ' HB2' ' CB ' ' A' ' 125' ' ' SER . 0.2 OUTLIER -95.64 -59.1 1.94 Allowed 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.343 -178.39 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . 0.42 ' CA ' ' HB3' ' A' ' 6' ' ' SER . . . 90.52 -79.47 1.43 Allowed Glycine 0 C--N 1.332 0.332 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.55 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.249 -0.882 . . . . 0.0 110.907 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 201' ' ' ACE . . . . . 0.411 ' CH3' ' CE2' ' B' ' 204' ' ' PTR . . . . . . . . 0 C--O 1.232 0.144 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -93.3 -56.23 3.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.754 0.311 . . . . 0.0 110.906 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -117.47 -7.15 11.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.446 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 204' ' ' PTR . . . . . 0.438 ' HD1' ' ND2' ' A' ' 30' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 51.56 -102.68 0.13 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.593 -0.73 . . . . 0.0 112.433 179.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 206' ' ' ASP . . . . . 0.48 ' CB ' ' HD2' ' B' ' 207' ' ' PRO . 0.7 OUTLIER -136.76 173.96 4.97 Favored Pre-proline 0 CA--C 1.532 0.26 0 CA-C-O 120.569 0.224 . . . . 0.0 111.379 -178.649 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . 0.506 ' HB3' ' CD2' ' A' ' 3' ' ' LEU . 37.2 Cg_endo -66.93 58.84 0.56 Allowed 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.673 2.249 . . . . 0.0 113.315 -179.429 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 208' ' ' PHE . . . . . 0.575 ' C ' ' CD1' ' B' ' 208' ' ' PHE . 0.0 OUTLIER 64.9 -3.86 0.54 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.759 0.314 . . . . 0.0 111.373 179.079 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.681 -0.236 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 120.752 0.31 . . . . 0.0 111.266 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.6 p30 44.58 -163.55 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.373 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.404 HD22 ' O ' ' A' ' 29' ' ' GLY . 5.7 mp -73.23 -72.5 0.25 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.341 0.591 . . . . 0.0 110.455 179.374 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 167.73 -159.21 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.109 -0.951 . . . . 0.0 109.087 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.555 HD23 ' CG ' ' A' ' 62' ' ' HIS . 0.0 OUTLIER -95.25 -60.98 1.55 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.887 0.375 . . . . 0.0 111.413 179.567 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.409 ' HB3' ' CA ' ' A' ' 129' ' ' GLY . 27.8 p -53.74 -45.05 70.41 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.888 -0.597 . . . . 0.0 112.242 -179.238 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . 0.421 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -73.18 -62.47 1.46 Allowed 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 120.901 0.381 . . . . 0.0 110.192 -179.679 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.437 ' HB3' ' CD2' ' A' ' 117' ' ' LEU . 6.5 tp -45.05 -45.74 11.04 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.313 179.203 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.45 ' CG ' HD21 ' A' ' 121' ' ' LEU . 63.4 t60 -62.16 -48.78 78.58 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.581 178.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.449 ' HB3' ' CZ ' ' B' ' 208' ' ' PHE . 4.1 mmt180 -48.92 -54.92 13.46 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.755 -179.416 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.527 ' HG3' ' CG1' ' A' ' 31' ' ' VAL . 0.0 OUTLIER -67.5 -54.89 16.24 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -179.353 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.452 ' O ' ' HB2' ' A' ' 15' ' ' LEU . 8.6 p -55.98 -46.87 80.68 Favored 'Isoleucine or valine' 0 C--O 1.242 0.698 0 CA-C-O 121.292 0.568 . . . . 0.0 111.18 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.525 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 9.2 t -58.99 -57.97 10.74 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.965 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.432 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -58.13 -25.73 61.77 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.697 -179.863 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.452 ' HB2' ' O ' ' A' ' 12' ' ' VAL . 12.9 mt -67.97 -65.37 0.7 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.687 -179.519 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.57 ' HB ' ' NZ ' ' A' ' 114' ' ' LYS . 1.4 t -73.43 -25.0 20.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 120.148 -0.621 . . . . 0.0 110.977 -179.538 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.426 ' CG ' ' O ' ' A' ' 13' ' ' SER . 7.2 mm-40 -75.96 -23.42 55.37 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.253 179.384 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -154.3 57.87 0.71 Allowed 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 120.73 0.3 . . . . 0.0 111.274 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 175.89 -61.8 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.52 ' HB2' ' HA ' ' A' ' 16' ' ' VAL . 20.4 m -85.44 -77.85 0.28 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.894 0.378 . . . . 0.0 111.97 -178.867 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.549 ' H ' ' HA ' ' A' ' 16' ' ' VAL . . . 118.57 -36.64 3.52 Favored Glycine 0 N--CA 1.449 -0.473 0 N-CA-C 111.553 -0.619 . . . . 0.0 111.553 -179.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.405 ' O ' ' O ' ' A' ' 23' ' ' CYS . 0.2 OUTLIER -177.08 5.24 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.719 0.295 . . . . 0.0 111.636 179.895 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.49 ' HB3' ' O ' ' A' ' 34' ' ' ASN . 88.5 m -52.65 -165.96 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.495 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.593 ' CB ' ' HB3' ' A' ' 34' ' ' ASN . 0.2 OUTLIER -103.77 164.47 11.66 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.142 179.758 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -109.21 136.26 13.44 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.301 -0.952 . . . . 0.0 113.716 -178.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.529 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 2.1 tmmm? -105.68 116.65 32.31 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 178.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.456 ' O ' ' CB ' ' A' ' 28' ' ' ARG . 8.6 tt -104.11 146.77 28.26 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.033 0.444 . . . . 0.0 111.849 -179.05 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.456 ' CB ' ' O ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER 153.81 64.59 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.271 -179.863 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.404 ' O ' HD22 ' A' ' 3' ' ' LEU . . . 89.94 -12.43 67.55 Favored Glycine 0 CA--C 1.519 0.289 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.764 -178.56 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.485 ' C ' ' ND2' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -165.9 165.16 18.39 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.529 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -110.37 121.35 63.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 C-N-CA 120.439 -0.504 . . . . 0.0 109.939 177.781 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.456 ' CB ' ' HB3' ' A' ' 26' ' ' LYS . . . -104.07 166.5 10.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.771 -179.217 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.429 ' CB ' ' OG ' ' A' ' 20' ' ' SER . . . -103.15 104.76 14.94 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.26 0.553 . . . . 0.0 111.72 -178.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.593 ' HB3' ' CB ' ' A' ' 24' ' ' THR . 49.5 t30 -76.25 86.75 3.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.998 179.303 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.91 74.49 2.64 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.836 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 179.62 -36.66 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.46 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.426 HG22 ' CE1' ' A' ' 39' ' ' PHE . 0.2 OUTLIER -100.72 -166.62 1.33 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.794 179.862 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -168.83 102.22 0.39 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.682 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.646 ' CZ ' ' HA ' ' A' ' 48' ' ' ALA . 20.6 m-30 -114.92 145.03 42.65 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -178.209 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.479 ' O ' ' HG2' ' A' ' 40' ' ' GLN . 2.1 pm0 -153.75 65.23 0.73 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.229 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.446 ' HA3' ' HB2' ' A' ' 87' ' ' ASN . . . 78.31 106.39 0.19 Allowed Glycine 0 CA--C 1.519 0.332 0 CA-C-N 115.352 -0.84 . . . . 0.0 113.084 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.644 ' N ' ' HB3' ' A' ' 105' ' ' SER . 0.0 OUTLIER -154.81 -135.23 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 178.86 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -170.52 35.28 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 O-C-N 121.859 -0.525 . . . . 0.0 111.493 -179.656 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 4.9 mt 63.29 3.49 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -88.63 -56.39 3.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.916 0.389 . . . . 0.0 110.752 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.4 t -60.39 -22.59 63.51 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.727 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 135.5 46.6 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.295 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.646 ' HA ' ' CZ ' ' A' ' 39' ' ' PHE . . . -102.68 -169.02 1.6 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.087 0.47 . . . . 0.0 111.457 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.8 142.08 28.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.977 179.315 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.474 ' HA ' ' HD2' ' A' ' 53' ' ' LYS . 10.1 tt0 -44.52 -29.27 0.69 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.818 0.342 . . . . 0.0 111.654 -179.324 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.413 ' CB ' ' HG2' ' A' ' 26' ' ' LYS . 5.2 m -56.54 -65.18 0.65 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.742 -179.612 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 108' ' ' MET . 0.7 OUTLIER -53.77 -63.77 1.04 Allowed 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 111.911 0.338 . . . . 0.0 111.911 -179.164 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.488 ' HB3' ' O ' ' A' ' 106' ' ' ASP . 0.7 OUTLIER -44.78 -51.89 8.98 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 120.686 0.279 . . . . 0.0 111.426 -179.802 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.476 ' H ' ' HG3' ' A' ' 53' ' ' LYS . 74.9 t -58.81 -34.32 51.87 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 CA-C-O 121.055 0.455 . . . . 0.0 109.788 179.188 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.454 ' HB3' ' HB3' ' A' ' 108' ' ' MET . 0.3 OUTLIER -63.67 -46.37 85.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.737 178.883 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -57.51 -46.61 83.58 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.455 179.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 13.8 mm-40 -62.91 -45.32 93.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.451 179.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 59.5 m -59.86 -57.76 11.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.917 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.544 ' CG2' ' HB2' ' A' ' 116' ' ' LEU . 7.7 p -59.04 -48.7 85.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.811 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 12.9 tp -54.83 -34.28 62.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.906 0.384 . . . . 0.0 110.615 179.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 49.2 m -72.27 -50.8 24.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.156 -179.584 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . 0.555 ' CG ' HD23 ' A' ' 5' ' ' LEU . 0.4 OUTLIER -66.63 -25.09 66.42 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 120.928 0.394 . . . . 0.0 110.733 -179.54 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.592 ' HB ' HD21 ' A' ' 100' ' ' LEU . 7.0 t -98.66 31.2 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.489 179.188 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.572 ' O ' ' HB2' ' A' ' 65' ' ' ASN . . . -68.85 61.73 0.1 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.288 -179.299 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.572 ' HB2' ' O ' ' A' ' 64' ' ' ALA . 0.7 OUTLIER 142.19 -73.13 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.095 0.558 . . . . 0.0 111.407 179.722 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.563 HG12 HG13 ' A' ' 63' ' ' VAL . 29.2 m 39.55 -146.15 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.912 -179.092 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.484 ' O ' ' O ' ' A' ' 98' ' ' SER . 4.1 p -158.51 -24.02 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 N-CA-C 112.284 0.476 . . . . 0.0 112.284 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.571 ' HB3' ' HB2' ' A' ' 72' ' ' ASP . 0.7 OUTLIER 36.89 92.6 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 179.093 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 15.7 p -64.34 177.02 0.92 Allowed 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 178.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.434 ' HA ' ' O ' ' A' ' 96' ' ' GLY . 0.7 OUTLIER -42.21 -33.2 0.57 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.807 0.337 . . . . 0.0 111.329 -179.934 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -65.27 -63.81 1.01 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.468 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.591 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 48.5 m-20 -59.85 -33.51 71.89 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.859 0.362 . . . . 0.0 110.472 179.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 2.1 m -56.48 -62.81 1.47 Allowed 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 178.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -57.78 -27.48 63.11 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.449 0.642 . . . . 0.0 109.28 177.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.591 ' HB2' ' HA ' ' A' ' 72' ' ' ASP . 0.1 OUTLIER -56.99 -65.15 0.67 Allowed 'General case' 0 C--O 1.238 0.469 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.302 178.956 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.552 HD11 HG11 ' A' ' 115' ' ' VAL . 0.5 OUTLIER -56.21 -39.06 71.87 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.434 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.411 ' O ' ' HB ' ' A' ' 81' ' ' VAL . 0.1 OUTLIER -55.96 -49.18 74.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.398 179.522 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -60.69 -58.1 9.89 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.423 -179.626 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.65 -61.6 1.99 Allowed 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.566 -179.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.419 ' CG2' HG21 ' A' ' 81' ' ' VAL . 0.7 OUTLIER -49.39 -44.03 44.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.772 -179.265 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.419 HG21 ' CG2' ' A' ' 80' ' ' THR . 16.7 t -87.36 -12.85 10.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 111.652 0.241 . . . . 0.0 111.652 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? -37.29 154.3 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.932 0.396 . . . . 0.0 111.603 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 6.6 p-80 -58.65 90.39 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.224 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 179.94 -76.79 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.051 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -173.99 172.96 3.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.023 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -91.94 177.96 6.03 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.811 179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . 0.446 ' HB2' ' HA3' ' A' ' 41' ' ' GLY . 25.8 t30 178.52 -38.74 0.01 OUTLIER 'General case' 0 C--O 1.241 0.645 0 CA-C-O 121.311 0.577 . . . . 0.0 110.632 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.524 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 4.1 m-85 -106.94 142.26 36.85 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.914 -179.01 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.666 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.2 OUTLIER -110.4 150.76 28.35 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 115.299 -0.864 . . . . 0.0 108.982 -179.4 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.435 ' CD2' ' CD1' ' A' ' 76' ' ' LEU . 2.0 mt -138.74 156.17 47.61 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -177.569 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.602 ' O ' ' CB ' ' A' ' 98' ' ' SER . 56.2 mmm-85 -128.19 149.8 50.29 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 114.695 -1.138 . . . . 0.0 108.536 177.866 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.43 ' O ' ' CG1' ' A' ' 93' ' ' VAL . 53.4 p -103.76 154.29 19.73 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.985 0.898 . . . . 0.0 113.065 -178.302 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.558 ' O ' ' O ' ' A' ' 97' ' ' ASN . 0.0 OUTLIER 167.29 157.17 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.433 -1.316 0 CA-C-N 113.594 -1.639 . . . . 0.0 107.531 -179.31 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.475 ' O ' ' HB3' ' A' ' 95' ' ' ASN . . . 88.72 35.52 8.39 Favored Glycine 0 C--N 1.291 -1.968 0 C-N-CA 120.068 -1.063 . . . . 0.0 112.667 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . 0.475 ' HB3' ' O ' ' A' ' 94' ' ' GLY . 13.6 t30 70.51 -56.13 0.61 Allowed 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 -178.151 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.434 ' O ' ' HA ' ' A' ' 70' ' ' GLN . . . -145.56 26.1 1.82 Allowed Glycine 0 N--CA 1.439 -1.141 0 CA-C-N 115.168 -0.924 . . . . 0.0 111.378 178.513 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.558 ' O ' ' O ' ' A' ' 93' ' ' VAL . 0.2 OUTLIER -104.9 166.32 10.46 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 117.097 0.448 . . . . 0.0 109.907 179.676 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.602 ' CB ' ' O ' ' A' ' 91' ' ' ARG . 0.6 OUTLIER -146.78 161.86 39.76 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.528 0.68 . . . . 0.0 111.451 179.942 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -103.87 155.04 5.76 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.176 179.604 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.592 HD21 ' HB ' ' A' ' 63' ' ' VAL . 1.4 tp -103.05 108.89 20.24 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-O 121.937 0.875 . . . . 0.0 112.389 -179.319 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.666 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -122.12 105.19 15.89 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.027 0 N-CA-C 104.073 -2.566 . . . . 0.0 104.073 175.49 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.73 ' O ' ' HB2' ' A' ' 103' ' ' LEU . 0.1 OUTLIER -144.34 165.15 28.72 Favored 'General case' 0 C--N 1.307 -1.265 0 C-N-CA 119.01 -1.076 . . . . 0.0 113.734 -173.917 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.73 ' HB2' ' O ' ' A' ' 102' ' ' SER . 0.5 OUTLIER 132.57 70.85 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 113.469 -1.696 . . . . 0.0 112.533 176.465 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.431 ' O ' ' OG ' ' A' ' 105' ' ' SER . 0.0 OUTLIER -98.32 13.21 32.25 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.757 -1.11 . . . . 0.0 108.132 177.001 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.644 ' HB3' ' N ' ' A' ' 42' ' ' LEU . 5.0 m 160.15 172.07 0.01 OUTLIER 'General case' 0 C--O 1.231 0.099 0 CA-C-N 114.108 -1.406 . . . . 0.0 107.335 -179.151 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.488 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.4 OUTLIER -104.75 101.7 11.3 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 119.61 -0.836 . . . . 0.0 112.194 -178.965 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.505 ' NE2' ' HB2' ' A' ' 42' ' ' LEU . 1.6 mt-30 -169.6 165.23 10.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.776 178.024 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.475 ' CE ' ' CE1' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -165.56 138.14 4.24 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.12 0.486 . . . . 0.0 111.799 178.48 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.45 HG23 HG22 ' A' ' 24' ' ' THR . 0.1 OUTLIER -103.91 159.58 15.53 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.38 178.759 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.514 ' HB3' ' CG2' ' A' ' 16' ' ' VAL . 6.8 mt -46.92 -55.55 7.87 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 121.174 -0.211 . . . . 0.0 110.908 -179.481 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.546 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 2.1 tp60 -46.87 -65.52 0.55 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.691 0.281 . . . . 0.0 110.826 179.708 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.504 ' O ' ' HB ' ' A' ' 115' ' ' VAL . 58.9 m-20 -45.52 -54.14 7.94 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 121.158 0.504 . . . . 0.0 110.867 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.462 ' O ' HD13 ' A' ' 117' ' ' LEU . . . -44.31 -64.94 0.58 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.944 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.57 ' NZ ' ' HB ' ' A' ' 16' ' ' VAL . 0.0 OUTLIER -64.97 -22.08 66.94 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.473 -179.847 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.552 ' CG2' ' CG ' ' A' ' 75' ' ' LYS . 53.1 t -60.06 -64.94 0.51 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.815 0 CA-C-O 121.995 0.902 . . . . 0.0 109.786 179.535 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.544 ' HB2' ' CG2' ' A' ' 59' ' ' VAL . 0.2 OUTLIER -64.05 -35.83 82.02 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.85 179.67 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.535 ' CD2' HD12 ' A' ' 5' ' ' LEU . 0.4 OUTLIER -70.86 -19.14 62.66 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-O 121.044 0.449 . . . . 0.0 110.812 179.437 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.553 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 6.9 tp10 -75.34 -47.5 27.43 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 106.598 -1.63 . . . . 0.0 106.598 177.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . 0.403 ' CB ' ' HG ' ' A' ' 68' ' ' LEU . . . -77.93 -18.19 56.37 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 114.606 -1.179 . . . . 0.0 111.08 178.303 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.526 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . . . -82.44 -52.17 7.14 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.186 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.492 ' O ' ' N ' ' A' ' 126' ' ' GLY . 0.0 OUTLIER -63.85 -30.06 71.19 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 178.148 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.553 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 4.3 ttm-85 -71.91 -55.98 6.53 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.422 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -92.7 -29.87 15.84 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 -177.024 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . 0.406 ' CB ' ' O ' ' A' ' 120' ' ' ALA . 4.4 mm-40 -75.73 -65.99 0.84 Allowed 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.514 -0.474 . . . . 0.0 112.038 -178.382 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -95.88 -48.26 5.8 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.97 -178.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . 0.492 ' N ' ' O ' ' A' ' 121' ' ' LEU . . . 87.22 71.51 1.29 Allowed Glycine 0 CA--C 1.502 -0.767 0 N-CA-C 110.8 -0.92 . . . . 0.0 110.8 -178.418 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . 51.14 27.17 3.24 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 -177.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.32 -70.24 0.7 Allowed 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.723 -178.299 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . 0.409 ' CA ' ' HB3' ' A' ' 6' ' ' SER . . . 117.26 -38.3 3.03 Favored Glycine 0 C--N 1.333 0.409 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.379 -179.548 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 8.0 t . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.228 -0.891 . . . . 0.0 110.977 179.919 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.122 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -95.26 -30.36 14.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.803 0.335 . . . . 0.0 110.94 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -127.47 144.41 51.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.008 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 204' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 54.65 -87.36 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.941 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 206' ' ' ASP . . . . . 0.445 ' CB ' ' HD2' ' B' ' 207' ' ' PRO . 0.1 OUTLIER -156.16 166.91 15.42 Favored Pre-proline 0 C--N 1.332 -0.165 0 CA-C-O 120.653 0.263 . . . . 0.0 111.059 -179.24 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . 0.445 ' HD2' ' CB ' ' B' ' 206' ' ' ASP . 5.7 Cg_exo -38.19 -71.27 0.06 OUTLIER 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 123.426 2.751 . . . . 0.0 112.726 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 208' ' ' PHE . . . . . 0.449 ' CZ ' ' HB3' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -175.95 -171.77 0.47 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.029 179.84 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.326 0 CA-C-N 116.484 -0.326 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.1 ptp . . . . . 0 N--CA 1.488 1.444 0 CA-C-O 120.725 0.298 . . . . 0.0 111.398 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -103.91 -164.22 1.04 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.929 0.395 . . . . 0.0 111.278 -179.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.566 ' CD2' ' C ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER -91.38 -66.64 0.91 Allowed 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.405 -179.668 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.598 ' O ' ' HB2' ' A' ' 8' ' ' LEU . 39.9 t 172.81 -169.18 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 179.391 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.561 HD12 ' HB1' ' A' ' 120' ' ' ALA . 0.0 OUTLIER -96.7 -65.42 0.97 Allowed 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.661 -0.416 . . . . 0.0 111.406 179.049 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.4 p -51.18 -49.01 61.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.695 -179.078 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . 0.418 ' HB2' ' CD1' ' A' ' 3' ' ' LEU . 2.9 m-20 -67.9 -44.59 76.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.904 0.383 . . . . 0.0 110.19 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.598 ' HB2' ' O ' ' A' ' 4' ' ' SER . 18.6 tp -61.53 -64.75 0.84 Allowed 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.279 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.48 ' CD2' ' CD2' ' A' ' 121' ' ' LEU . 71.7 t60 -45.19 -50.53 11.43 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.392 0.615 . . . . 0.0 109.865 178.817 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.458 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 17.3 mmt85 -56.39 -51.43 68.37 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.298 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.683 ' HG3' HG12 ' A' ' 31' ' ' VAL . 4.6 pt20 -71.05 -53.31 15.14 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.728 -179.587 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.712 ' HA ' HG11 ' A' ' 31' ' ' VAL . 10.0 p -55.58 -50.04 69.5 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-O 120.705 0.288 . . . . 0.0 111.455 179.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.424 ' O ' ' HB2' ' A' ' 17' ' ' GLN . 4.6 t -64.51 -43.66 93.35 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.354 179.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.458 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -53.79 -43.92 69.69 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -179.441 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.487 ' CD2' ' O ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -75.36 -51.13 13.88 Favored 'General case' 0 CA--C 1.517 -0.29 0 C-N-CA 119.879 -0.728 . . . . 0.0 111.102 -179.692 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.664 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 8.8 p -73.92 -4.83 5.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 113.569 0.951 . . . . 0.0 113.569 -178.293 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.427 ' HG2' ' CE ' ' A' ' 114' ' ' LYS . 5.9 mm-40 -93.38 -4.71 50.98 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.221 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -153.34 -40.53 0.1 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.694 0.283 . . . . 0.0 111.278 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.409 ' N ' ' O ' ' A' ' 15' ' ' LEU . 3.2 tt0 -89.45 -66.7 0.9 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.751 0.31 . . . . 0.0 111.268 -179.838 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.664 ' HB2' ' HA ' ' A' ' 16' ' ' VAL . 0.7 OUTLIER -69.77 -32.74 71.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.853 -179.827 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 76.22 -56.23 3.21 Favored Glycine 0 CA--C 1.52 0.368 0 C-N-CA 120.954 -0.641 . . . . 0.0 113.67 179.118 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.463 ' HA ' ' CG2' ' A' ' 16' ' ' VAL . 0.1 OUTLIER -176.92 8.31 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.701 0.25 . . . . 0.0 111.635 -179.158 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.418 ' O ' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -56.49 -152.88 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.048 -179.599 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.464 ' HA ' ' HB ' ' A' ' 109' ' ' THR . 0.0 OUTLIER -103.62 153.16 20.92 Favored 'General case' 0 CA--C 1.52 -0.187 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.34 -179.871 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.451 ' CA ' ' HG ' ' A' ' 110' ' ' LEU . . . -113.17 124.95 6.79 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.337 -0.935 . . . . 0.0 113.459 -178.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.425 ' O ' ' HG3' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -109.01 127.78 54.38 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 178.483 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.972 ' HB3' ' HA ' ' A' ' 31' ' ' VAL . 0.4 OUTLIER -164.02 165.91 22.01 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 114.864 1.431 . . . . 0.0 114.864 -178.08 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.0 mpt_? -142.65 -48.03 0.33 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 113.226 -1.806 . . . . 0.0 108.526 177.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.402 ' O ' ' HB2' ' A' ' 3' ' ' LEU . . . -130.74 4.53 5.78 Favored Glycine 0 CA--C 1.524 0.621 0 CA-C-N 115.054 -0.976 . . . . 0.0 110.752 177.468 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.799 ' O ' ' CB ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -166.36 157.41 12.94 Favored 'General case' 0 C--O 1.222 -0.372 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 -179.992 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.972 ' HA ' ' HB3' ' A' ' 27' ' ' LEU . 8.8 p -102.36 131.65 50.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 122.179 0.99 . . . . 0.0 113.22 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -113.38 166.0 11.91 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 113.407 -1.724 . . . . 0.0 109.411 178.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -103.3 135.5 44.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.306 0.574 . . . . 0.0 111.785 -178.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.486 ' ND2' ' CE2' ' A' ' 39' ' ' PHE . 28.9 t30 -116.02 117.82 31.19 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.679 -179.575 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -123.05 -31.26 3.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.743 179.707 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -61.01 -54.45 44.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.523 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.453 ' HB ' ' CE1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -83.65 -166.13 1.31 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.355 179.596 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 35.8 p -154.54 101.05 2.31 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.887 0.375 . . . . 0.0 111.441 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.554 ' HB3' ' HG2' ' A' ' 107' ' ' GLN . 1.6 m-85 -113.98 127.96 56.18 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.833 179.191 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -118.04 -35.01 3.97 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.265 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.562 ' HA3' ' HB3' ' A' ' 87' ' ' ASN . . . 171.54 -14.89 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.891 -0.671 . . . . 0.0 113.412 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.674 ' HG ' ' OE1' ' A' ' 107' ' ' GLN . 0.1 OUTLIER -44.75 174.0 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 117.332 0.566 . . . . 0.0 111.834 -179.799 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.474 ' C ' ' H ' ' A' ' 45' ' ' ALA . 20.8 m -109.72 46.61 1.0 Allowed 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -178.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.408 ' HA ' ' CB ' ' A' ' 48' ' ' ALA . 0.7 OUTLIER 59.94 -5.33 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 179.244 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.474 ' H ' ' C ' ' A' ' 43' ' ' THR . . . -63.76 -64.09 0.99 Allowed 'General case' 0 CA--C 1.522 -0.13 0 CA-C-O 120.969 0.414 . . . . 0.0 110.621 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.5 t -46.44 -41.64 14.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.962 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 151.55 37.16 0.03 OUTLIER Glycine 0 CA--C 1.519 0.314 0 C-N-CA 120.46 -0.876 . . . . 0.0 113.432 179.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.469 ' HB2' ' OE1' ' A' ' 52' ' ' GLU . . . -90.82 -171.27 2.97 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 117.151 0.476 . . . . 0.0 111.281 179.75 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.429 ' HG3' ' CZ ' ' A' ' 39' ' ' PHE . 12.4 mtp85 -115.94 -165.97 1.09 Allowed 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.523 -179.545 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.748 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 0.6 OUTLIER -95.27 -52.45 4.17 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.311 -0.404 . . . . 0.0 112.012 -179.259 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.518 ' O ' HG23 ' A' ' 54' ' ' VAL . 1.4 p -39.96 -40.33 1.0 Allowed 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.098 0.475 . . . . 0.0 111.312 -179.592 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.547 ' HB3' ' CD2' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -63.02 -66.21 0.57 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.491 179.66 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.748 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -46.33 -55.62 7.03 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.881 179.936 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.518 HG23 ' O ' ' A' ' 51' ' ' SER . 0.2 OUTLIER -54.07 -39.83 43.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.184 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.591 ' CZ ' ' CB ' ' A' ' 113' ' ' ALA . 1.3 t80 -52.78 -49.03 66.38 Favored 'General case' 0 C--O 1.231 0.132 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.735 178.42 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.422 ' CA ' ' HB2' ' A' ' 108' ' ' MET . . . -58.99 -42.81 90.93 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.305 179.119 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -58.69 -43.09 89.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.807 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 27.2 p -64.54 -60.36 3.23 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.162 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.455 ' CG2' ' CD1' ' A' ' 117' ' ' LEU . 8.9 p -60.72 -47.53 92.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.532 -179.523 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.459 ' CD2' ' HG ' ' A' ' 103' ' ' LEU . 6.0 tp -58.45 -43.0 88.66 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.67 0.271 . . . . 0.0 111.409 -179.569 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 9.9 t -75.3 -34.61 61.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.289 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . 0.444 ' HB3' ' CD2' ' A' ' 5' ' ' LEU . 0.1 OUTLIER -70.01 -25.22 63.48 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 120.727 0.298 . . . . 0.0 110.323 179.521 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.523 ' HB ' HG12 ' A' ' 66' ' ' VAL . 28.0 m -91.93 -55.55 6.06 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.233 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.179 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.478 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 29.88 36.66 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 O-C-N 123.38 0.425 . . . . 0.0 112.009 179.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.48 ' O ' ' CG2' ' A' ' 66' ' ' VAL . 4.5 m-20 160.25 -84.45 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.262 0.468 . . . . 0.0 112.262 -179.031 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.526 HG13 ' HA ' ' A' ' 120' ' ' ALA . 22.9 m 50.97 -160.56 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.59 -178.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.492 ' O ' ' O ' ' A' ' 98' ' ' SER . 7.3 p -147.34 -15.48 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 -178.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.476 ' HB3' ' CB ' ' A' ' 72' ' ' ASP . 0.4 OUTLIER 29.58 95.06 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.426 0.899 . . . . 0.0 113.426 178.81 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.402 ' CG2' ' CZ ' ' A' ' 122' ' ' ARG . 79.4 p -62.53 -161.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 178.619 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.08 -36.52 77.56 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.03 0.443 . . . . 0.0 110.393 179.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.46 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 13.7 tt0 -62.72 -65.34 0.7 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.242 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.577 ' O ' ' HB3' ' A' ' 75' ' ' LYS . 1.3 m-20 -53.26 -36.89 61.62 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.969 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.488 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 85.4 m -57.29 -65.25 0.66 Allowed 'General case' 0 C--O 1.238 0.455 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.644 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.86 -25.97 57.67 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 177.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.577 ' HB3' ' O ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -59.06 -51.43 70.1 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.723 178.715 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.41 ' CD2' HD12 ' A' ' 116' ' ' LEU . 1.2 mp -64.44 -49.68 70.5 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 178.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 73' ' ' THR . 2.8 mt -57.08 -32.92 66.75 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.426 179.639 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.16 -49.21 58.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.686 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' SER . . . . . 0.423 ' O ' ' CG ' ' A' ' 83' ' ' HIS . 0.0 OUTLIER -61.17 -30.94 70.71 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.466 179.706 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.521 HG22 ' CZ ' ' A' ' 88' ' ' TYR . 0.6 OUTLIER -81.3 -61.19 2.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.207 179.953 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 13.8 p -52.06 -33.56 16.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.767 -179.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.19 5.51 46.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.692 -179.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.423 ' CG ' ' O ' ' A' ' 79' ' ' SER . 6.4 m80 -121.92 -177.65 3.63 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.876 0.369 . . . . 0.0 110.991 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -64.77 -72.25 0.16 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.111 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 2.9 pp -125.0 -179.94 4.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.889 0.376 . . . . 0.0 110.961 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 19.7 p30 -114.22 129.51 56.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.78 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . 0.562 ' HB3' ' HA3' ' A' ' 41' ' ' GLY . 9.4 p-10 -107.42 -18.48 13.85 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.428 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.555 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 4.4 p90 -104.52 145.99 29.51 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 119.981 -0.687 . . . . 0.0 110.817 179.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.73 ' HB3' ' O ' ' A' ' 101' ' ' VAL . 0.5 OUTLIER -109.45 141.56 41.69 Favored 'General case' 0 N--CA 1.436 -1.145 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.184 -179.056 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.403 HD21 ' HA ' ' A' ' 100' ' ' LEU . 66.4 mt -126.36 165.07 19.7 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.916 0.865 . . . . 0.0 113.289 -177.438 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.486 ' O ' ' OG ' ' A' ' 98' ' ' SER . 0.4 OUTLIER -153.53 130.15 10.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 113.997 -1.456 . . . . 0.0 107.223 178.447 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.415 ' HA ' ' CB ' ' A' ' 98' ' ' SER . 60.4 p -103.68 145.83 29.48 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 -176.681 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.423 ' O ' ' O ' ' A' ' 97' ' ' ASN . 3.7 m -166.21 -122.83 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-N 113.553 -1.658 . . . . 0.0 108.621 179.203 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.541 ' O ' ' N ' ' A' ' 96' ' ' GLY . . . 34.51 34.77 0.04 OUTLIER Glycine 0 C--N 1.34 0.758 0 C-N-CA 120.885 -0.674 . . . . 0.0 113.643 178.635 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . 0.407 ' HB3' ' O ' ' A' ' 94' ' ' GLY . 3.2 t30 65.26 -68.66 0.11 Allowed 'General case' 0 C--O 1.231 0.081 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 -178.208 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.541 ' N ' ' O ' ' A' ' 94' ' ' GLY . . . -126.41 24.95 5.5 Favored Glycine 0 N--CA 1.443 -0.841 0 N-CA-C 110.677 -0.969 . . . . 0.0 110.677 177.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.423 ' O ' ' O ' ' A' ' 93' ' ' VAL . 0.0 OUTLIER -124.43 166.07 16.64 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.892 0.377 . . . . 0.0 110.551 -179.801 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.492 ' O ' ' O ' ' A' ' 67' ' ' VAL . 11.2 t -142.23 154.18 44.57 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.209 0.528 . . . . 0.0 111.138 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -103.74 159.91 4.79 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 178.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.777 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 0.1 OUTLIER -126.47 113.74 17.23 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -179.152 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.73 ' O ' ' HB3' ' A' ' 89' ' ' ASP . 0.2 OUTLIER -105.08 108.97 26.2 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 N-CA-C 103.213 -2.884 . . . . 0.0 103.213 174.481 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.768 ' O ' ' HB2' ' A' ' 103' ' ' LEU . 13.8 p -138.54 165.11 27.7 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -173.243 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.768 ' HB2' ' O ' ' A' ' 102' ' ' SER . 0.9 OUTLIER 126.74 82.55 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 112.508 -2.133 . . . . 0.0 112.658 176.61 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.406 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -104.65 19.14 20.94 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.619 -1.173 . . . . 0.0 108.284 177.441 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.52 ' CB ' ' O ' ' A' ' 41' ' ' GLY . 3.5 m 157.97 175.25 0.01 OUTLIER 'General case' 0 C--O 1.231 0.116 0 N-CA-C 107.14 -1.43 . . . . 0.0 107.14 -179.046 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.409 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.6 OUTLIER -106.69 101.95 11.36 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 119.596 -0.842 . . . . 0.0 112.097 -178.988 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.674 ' OE1' ' HG ' ' A' ' 42' ' ' LEU . 1.1 mt-30 -169.04 163.47 11.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.612 178.147 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.422 ' HB2' ' CA ' ' A' ' 56' ' ' ALA . 1.0 OUTLIER -165.71 133.71 3.01 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.395 0.617 . . . . 0.0 112.347 178.76 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.464 ' HB ' ' HA ' ' A' ' 24' ' ' THR . 0.8 OUTLIER -103.24 159.8 15.23 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.983 -1.008 . . . . 0.0 109.316 178.823 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.48 ' CD1' ' HB3' ' A' ' 20' ' ' SER . 17.1 mt -46.91 -62.88 1.2 Allowed 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 121.222 -0.191 . . . . 0.0 110.92 -179.639 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.641 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 6.5 tp60 -44.38 -62.07 1.3 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.76 0.314 . . . . 0.0 110.499 179.456 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.445 ' OD1' ' N ' ' A' ' 112' ' ' ASP . 0.8 OUTLIER -45.42 -47.76 13.67 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 121.373 0.606 . . . . 0.0 110.436 179.529 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.591 ' CB ' ' CZ ' ' A' ' 55' ' ' PHE . . . -58.83 -65.74 0.61 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.923 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.641 ' HD2' ' HA ' ' A' ' 111' ' ' GLN . 0.0 OUTLIER -52.21 -25.72 9.88 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 121.06 -0.256 . . . . 0.0 110.898 179.825 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.56 ' CG2' ' CG ' ' A' ' 75' ' ' LYS . 88.2 t -64.39 -65.03 0.58 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.767 0 CA-C-O 122.082 0.944 . . . . 0.0 109.636 178.616 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.649 ' O ' ' HB2' ' A' ' 120' ' ' ALA . 1.7 mp -63.59 -34.06 76.98 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 114.572 -1.194 . . . . 0.0 109.678 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.529 ' CD2' HD13 ' A' ' 5' ' ' LEU . 0.2 OUTLIER -72.67 -23.08 60.84 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.97 179.691 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.436 ' HA ' ' CE1' ' A' ' 9' ' ' HIS . 5.7 tt0 -71.84 -44.17 64.29 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 106.521 -1.659 . . . . 0.0 106.521 177.467 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . 0.517 ' HB3' ' HB ' ' A' ' 66' ' ' VAL . . . -77.9 -19.11 55.32 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 114.151 -1.386 . . . . 0.0 110.11 177.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.649 ' HB2' ' O ' ' A' ' 116' ' ' LEU . . . -81.19 -48.07 12.59 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.928 179.557 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.48 ' CD2' ' CD2' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -68.8 -30.52 69.11 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.697 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.427 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 1.0 OUTLIER -74.08 -50.4 19.78 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.615 -0.72 . . . . 0.0 112.29 -179.404 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.08 -31.98 13.32 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -177.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -92.1 -65.61 0.99 Allowed 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -178.759 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.427 ' CB ' ' HA ' ' A' ' 121' ' ' LEU . 3.9 t -60.61 -59.05 6.02 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.614 -178.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . 0.472 ' C ' ' N ' ' A' ' 128' ' ' ARG . . . 53.84 47.88 63.93 Favored Glycine 0 CA--C 1.495 -1.193 0 C-N-CA 120.301 -0.952 . . . . 0.0 111.645 -179.04 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . 45.92 26.23 0.37 Allowed 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 -177.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . 0.472 ' N ' ' C ' ' A' ' 126' ' ' GLY . 0.0 OUTLIER -114.88 -60.13 1.93 Allowed 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 114.739 -1.119 . . . . 0.0 111.208 -178.205 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . -86.16 52.32 4.51 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.739 -179.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 15.3 p . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.879 179.888 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.134 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 202' ' ' ASP . . . . . 0.432 ' O ' ' N ' ' B' ' 204' ' ' PTR . 15.5 m-20 -109.45 -84.62 0.55 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.542 0.21 . . . . 0.0 110.895 . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 63.93 -73.01 0.05 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.03 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 204' ' ' PTR . . . . . 0.447 ' CD2' ' ND2' ' A' ' 30' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -43.47 -88.39 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.877 -179.207 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 206' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -110.89 156.93 39.96 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-O 120.745 0.307 . . . . 0.0 110.919 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . 0.401 ' CB ' ' NE2' ' A' ' 11' ' ' GLN . 19.3 Cg_endo -57.09 -177.32 0.07 OUTLIER 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.711 2.274 . . . . 0.0 112.273 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 208' ' ' PHE . . . . . 0.444 ' CE2' ' HA ' ' A' ' 11' ' ' GLN . 68.9 m-85 61.02 154.93 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.927 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.362 0 CA-C-N 116.49 -0.323 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.765 0.317 . . . . 0.0 111.198 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -116.08 -162.78 0.86 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.846 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 10.5 mp -90.01 164.88 14.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.679 179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 51.4 p -60.95 -162.77 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.271 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.486 ' CD2' ' HB3' ' A' ' 62' ' ' HIS . 0.0 OUTLIER -93.5 -61.25 1.59 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.619 0.247 . . . . 0.0 111.391 179.811 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.424 ' HB3' ' N ' ' A' ' 129' ' ' GLY . 1.9 p -47.33 -51.06 20.49 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -179.062 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.99 -55.72 15.31 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 121.164 0.507 . . . . 0.0 110.274 -179.346 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 11.6 tp -52.65 -60.06 3.71 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.425 179.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.439 ' HB3' ' O ' ' A' ' 5' ' ' LEU . 1.7 t-80 -45.63 -56.43 5.2 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.111 178.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.5 -43.42 71.78 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.172 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.52 ' HA ' ' CE2' ' B' ' 208' ' ' PHE . 19.9 tp60 -58.86 -65.35 0.68 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.668 179.361 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 9.2 p -56.56 -45.8 82.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.965 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.665 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 8.8 t -60.49 -55.09 37.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.454 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.3 ttp180 -63.99 -22.73 67.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.091 -179.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 7.6 mt -73.16 -63.01 1.27 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.72 -179.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.627 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 0.8 OUTLIER -70.3 -27.0 30.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.3 -179.538 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.413 ' HB2' ' O ' ' A' ' 13' ' ' SER . 8.1 mm-40 -78.14 -16.6 57.79 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.167 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -144.78 42.25 1.33 Allowed 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.84 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 173.56 -69.01 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 179.561 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.627 ' HB2' ' HA ' ' A' ' 16' ' ' VAL . 14.9 m -70.8 -31.75 68.6 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -178.088 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.438 ' O ' HG13 ' A' ' 16' ' ' VAL . . . 78.04 -57.8 3.96 Favored Glycine 0 CA--C 1.521 0.462 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.933 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.493 ' HA ' HG23 ' A' ' 16' ' ' VAL . 0.4 OUTLIER -177.3 30.42 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 120.831 0.348 . . . . 0.0 111.05 -179.879 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -74.81 -157.96 0.07 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.938 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.509 ' HB ' ' HB3' ' A' ' 34' ' ' ASN . 4.2 m -103.53 145.17 30.43 Favored 'General case' 0 C--O 1.231 0.108 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.42 ' HA2' ' O ' ' A' ' 32' ' ' ALA . . . -104.62 134.01 11.8 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.332 -0.937 . . . . 0.0 113.706 -178.46 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.516 ' HB2' ' CB ' ' A' ' 51' ' ' SER . 0.0 OUTLIER -104.96 128.87 53.42 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.932 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.451 ' HB2' ' CD2' ' A' ' 55' ' ' PHE . 0.9 OUTLIER -104.82 146.55 28.83 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.378 0.608 . . . . 0.0 112.139 -178.863 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 169.22 55.47 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 114.924 -1.035 . . . . 0.0 108.965 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 87.52 -5.48 84.95 Favored Glycine 0 CA--C 1.52 0.348 0 N-CA-C 111.231 -0.747 . . . . 0.0 111.231 -177.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.4 ' ND2' ' C ' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -165.46 165.07 19.42 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 179.838 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.42 ' CG1' ' HG2' ' A' ' 11' ' ' GLN . 0.7 OUTLIER -112.76 120.96 64.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 121.432 0.634 . . . . 0.0 111.213 179.411 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.465 ' CB ' ' CG ' ' A' ' 26' ' ' LYS . . . -110.51 166.34 11.07 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.273 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.421 ' CB ' ' OG ' ' A' ' 20' ' ' SER . . . -103.58 137.43 41.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.221 0.534 . . . . 0.0 111.952 -178.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.509 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 5.8 t30 -119.04 121.33 39.61 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.302 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 14.3 ttpp -121.78 -28.72 4.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.146 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -51.17 -77.19 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.961 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 7.9 t -77.45 -176.51 4.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.465 179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 78.2 p -136.42 107.69 6.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.85 0.357 . . . . 0.0 111.235 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.494 ' C ' ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -61.18 -178.77 0.12 Allowed 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.19 179.62 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.472 ' N ' ' CG ' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -171.64 22.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.772 0.32 . . . . 0.0 111.568 179.6 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.52 ' O ' ' CB ' ' A' ' 105' ' ' SER . . . 79.16 -17.0 8.03 Favored Glycine 0 C--O 1.228 -0.255 0 CA-C-O 119.754 -0.47 . . . . 0.0 113.176 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.579 ' HG ' ' OE1' ' A' ' 107' ' ' GLN . 0.1 OUTLIER -48.08 178.15 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 117.235 0.517 . . . . 0.0 111.361 -179.935 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 29.3 m -118.21 57.49 0.84 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.753 0.311 . . . . 0.0 111.67 -179.043 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.489 ' O ' ' C ' ' A' ' 45' ' ' ALA . 3.3 mp 69.93 -58.76 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.714 179.592 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.489 ' C ' ' O ' ' A' ' 44' ' ' ILE . . . -18.54 -77.27 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 58.8 m -43.86 -59.36 2.29 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.429 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 168.8 51.6 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.427 -0.892 . . . . 0.0 113.061 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.415 ' CB ' ' OE1' ' A' ' 107' ' ' GLN . . . -110.99 172.7 6.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.893 0.377 . . . . 0.0 111.053 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.458 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 2.2 tpm_? -91.49 158.5 16.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.713 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.502 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 0.8 OUTLIER -71.92 -22.96 61.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.046 0.451 . . . . 0.0 110.494 179.507 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.516 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 59.9 p -63.3 -62.81 1.44 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.256 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.55 ' HB2' ' HG2' ' A' ' 107' ' ' GLN . 1.5 pm0 -44.86 -60.69 1.92 Allowed 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.592 0.234 . . . . 0.0 111.414 -179.753 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.515 ' HD2' HG22 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -52.35 -50.71 61.79 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.702 -0.226 . . . . 0.0 110.997 179.931 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.515 HG22 ' HD2' ' A' ' 53' ' ' LYS . 73.5 t -57.55 -39.43 69.32 Favored 'Isoleucine or valine' 0 C--O 1.231 0.105 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.645 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.451 ' CD2' ' HB2' ' A' ' 27' ' ' LEU . 0.3 OUTLIER -61.48 -45.15 95.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.581 178.756 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.11 -45.82 75.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.577 179.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -64.3 -41.96 96.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.045 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 9.9 p -61.56 -57.78 10.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.882 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.421 ' O ' ' CG2' ' A' ' 63' ' ' VAL . 8.7 p -65.24 -49.72 77.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.08 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.2 tp -50.79 -40.2 54.63 Favored 'General case' 0 C--O 1.231 0.125 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.394 179.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 70.2 m -67.83 -53.49 26.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.331 179.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . 0.486 ' HB3' ' CD2' ' A' ' 5' ' ' LEU . 0.3 OUTLIER -60.83 -20.63 62.04 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 121.079 0.466 . . . . 0.0 110.299 179.598 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.635 ' CG2' ' HB3' ' A' ' 116' ' ' LEU . 3.4 t -109.61 55.07 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.491 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.493 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . -81.04 39.6 0.51 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.44 -179.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.493 ' CB ' ' O ' ' A' ' 64' ' ' ALA . 3.9 m-20 153.63 -65.38 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 122.652 0.381 . . . . 0.0 111.123 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.563 HG13 HG12 ' A' ' 63' ' ' VAL . 35.5 m 42.36 -171.09 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -179.699 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.559 ' HB ' ' HB3' ' A' ' 97' ' ' ASN . 16.8 m -145.2 67.64 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 CA-C-O 121.133 0.492 . . . . 0.0 110.877 -178.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.713 ' N ' ' O ' ' A' ' 98' ' ' SER . 0.7 OUTLIER -60.24 107.73 0.69 Allowed 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.995 -179.391 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.637 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 7.2 p -80.17 177.62 8.82 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.244 179.197 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -35.42 -37.05 0.08 Allowed 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.952 0.406 . . . . 0.0 111.401 -179.645 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.453 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 4.8 tp10 -68.38 -65.11 0.74 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.023 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.531 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 65.0 m-20 -58.75 -32.26 69.1 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.414 -179.622 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -64.46 -57.82 8.17 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.626 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.525 ' HA ' ' CG ' ' A' ' 77' ' ' LEU . . . -56.24 -27.88 56.54 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 177.019 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.577 ' CG ' ' CG2' ' A' ' 115' ' ' VAL . 0.4 OUTLIER -61.78 -49.08 77.81 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 114.334 -1.303 . . . . 0.0 110.976 179.184 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.422 HD13 ' CD2' ' A' ' 68' ' ' LEU . 0.3 OUTLIER -68.27 -52.63 31.63 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.775 0.322 . . . . 0.0 110.729 179.572 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.525 ' CG ' ' HA ' ' A' ' 74' ' ' ALA . 3.8 pp -60.61 -26.86 67.31 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.095 -179.718 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.438 ' HB2' ' O ' ' A' ' 74' ' ' ALA . 34.0 tt0 -75.87 -47.96 23.33 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.16 0.505 . . . . 0.0 110.4 179.311 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 3.1 t -61.1 -33.24 73.04 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.94 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 14.2 t -84.36 -46.82 11.34 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.614 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 7.4 p -63.32 -30.53 49.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.72 0.295 . . . . 0.0 111.581 -179.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.91 -60.89 2.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.05 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -162.55 87.73 0.61 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.684 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.461 ' ND2' ' CZ ' ' A' ' 39' ' ' PHE . 8.9 t-20 -164.53 178.17 7.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.116 -179.781 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 19.2 tp -111.08 31.32 6.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.764 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 36.4 m120 55.38 88.12 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.594 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -120.56 -10.36 9.25 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.894 -179.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.574 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 25.8 m-85 -100.64 139.94 35.61 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 120.399 -0.52 . . . . 0.0 110.924 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.672 ' O ' ' O ' ' A' ' 101' ' ' VAL . 1.0 OUTLIER -117.3 149.77 39.9 Favored 'General case' 0 N--CA 1.428 -1.529 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 -179.267 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.503 ' N ' ' CD1' ' A' ' 90' ' ' LEU . 0.0 OUTLIER -149.36 161.72 41.5 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 121.693 0.758 . . . . 0.0 112.696 -178.883 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.407 ' O ' ' HB3' ' A' ' 98' ' ' SER . 2.6 ptm180 -140.95 135.29 31.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.501 -1.227 . . . . 0.0 108.062 178.301 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.503 ' HA ' ' CB ' ' A' ' 98' ' ' SER . 26.4 p -104.9 146.49 28.94 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.85 1.055 . . . . 0.0 113.85 -177.604 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.506 ' O ' ' O ' ' A' ' 94' ' ' GLY . 6.7 m -161.91 -131.33 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.643 0 CA-C-N 113.889 -1.505 . . . . 0.0 108.536 178.633 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.506 ' O ' ' O ' ' A' ' 93' ' ' VAL . . . 47.89 176.25 0.01 OUTLIER Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.468 -0.872 . . . . 0.0 112.683 179.135 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -84.81 45.23 1.13 Allowed 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 176.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.451 ' H ' ' C ' ' A' ' 94' ' ' GLY . . . 114.38 43.71 0.75 Allowed Glycine 0 N--CA 1.441 -0.968 0 N-CA-C 109.141 -1.583 . . . . 0.0 109.141 -176.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.637 ' HA ' ' HA ' ' A' ' 69' ' ' THR . 0.1 OUTLIER -142.2 167.15 22.8 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 -178.703 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.713 ' O ' ' N ' ' A' ' 68' ' ' LEU . 3.0 m -148.42 157.16 43.3 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.914 -178.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.427 ' HA ' ' O ' ' A' ' 65' ' ' ASN . 2.5 t -104.08 150.17 7.41 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.043 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.547 HD22 HG11 ' A' ' 63' ' ' VAL . 0.1 OUTLIER -103.91 127.77 51.43 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 122.059 0.933 . . . . 0.0 113.198 -178.505 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.672 ' O ' ' O ' ' A' ' 89' ' ' ASP . 1.5 p -131.7 104.12 8.04 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 N-CA-C 104.295 -2.483 . . . . 0.0 104.295 174.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.574 ' HB2' ' HA ' ' A' ' 88' ' ' TYR . 32.8 p -148.22 165.28 31.42 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 118.785 -1.166 . . . . 0.0 113.653 -174.621 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.497 HD23 ' O ' ' A' ' 102' ' ' SER . 0.2 OUTLIER 157.2 -83.34 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 113.661 -1.609 . . . . 0.0 111.73 176.509 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.501 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 52.4 28.12 5.53 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -179.162 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.52 ' CB ' ' O ' ' A' ' 41' ' ' GLY . 13.3 m 140.04 165.96 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 -178.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.403 ' HB3' ' HB2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -104.85 101.92 11.49 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 119.677 -0.809 . . . . 0.0 112.853 -178.093 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.579 ' OE1' ' HG ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -168.61 164.73 12.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.41 177.694 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.513 ' CE ' ' CE1' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -165.58 141.91 5.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.118 0.485 . . . . 0.0 111.885 179.293 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.473 HG21 ' CD1' ' A' ' 39' ' ' PHE . 0.8 OUTLIER -104.32 165.22 11.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.258 179.47 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.415 ' HB3' ' NZ ' ' A' ' 114' ' ' LYS . 3.4 mt -49.19 -58.04 5.69 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.692 0.282 . . . . 0.0 110.502 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.544 ' O ' ' HG2' ' A' ' 114' ' ' LYS . 2.6 tp60 -50.42 -64.77 0.71 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.849 0.357 . . . . 0.0 110.839 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.524 ' HA ' HG23 ' A' ' 115' ' ' VAL . 0.8 OUTLIER -44.34 -46.67 9.41 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.17 0.51 . . . . 0.0 110.95 179.847 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.419 ' O ' ' HB2' ' A' ' 117' ' ' LEU . . . -55.6 -62.45 1.68 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.424 179.416 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.665 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 3.8 ptpp? -57.83 -27.01 62.8 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.037 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.577 ' CG2' ' CG ' ' A' ' 75' ' ' LYS . 99.4 t -61.05 -62.66 1.01 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.728 0 CA-C-O 122.149 0.976 . . . . 0.0 110.25 179.569 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.635 ' HB3' ' CG2' ' A' ' 63' ' ' VAL . 0.1 OUTLIER -68.64 -32.7 72.75 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.156 -179.199 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.446 ' HG ' HD13 ' A' ' 5' ' ' LEU . 0.1 OUTLIER -73.37 -22.9 60.17 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 120.901 0.382 . . . . 0.0 110.49 179.359 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.553 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 2.2 tp10 -72.49 -43.44 63.66 Favored 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 106.243 -1.762 . . . . 0.0 106.243 177.09 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . 0.458 ' O ' ' CB ' ' A' ' 123' ' ' GLN . . . -75.46 -22.55 57.19 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 114.309 -1.314 . . . . 0.0 109.881 177.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.456 ' N ' ' O ' ' A' ' 116' ' ' LEU . . . -79.45 -49.93 11.57 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.503 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.445 ' HB3' ' O ' ' A' ' 117' ' ' LEU . 0.0 OUTLIER -63.91 -38.32 90.64 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.86 179.806 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.553 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -79.72 -33.93 40.47 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -179.285 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.458 ' CB ' ' O ' ' A' ' 119' ' ' ALA . 12.1 tm0? -95.12 -19.43 20.12 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -177.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -93.6 -68.76 0.78 Allowed 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 119.743 -0.783 . . . . 0.0 111.976 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.449 ' HB2' ' HA2' ' A' ' 129' ' ' GLY . 2.0 t -98.63 -65.43 0.96 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.649 0.737 . . . . 0.0 111.31 179.271 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 102.43 94.16 2.25 Favored Glycine 0 CA--C 1.494 -1.272 0 CA-C-N 114.594 -1.185 . . . . 0.0 111.747 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . 52.27 21.84 1.79 Allowed 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 -177.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -150.33 17.06 0.83 Allowed 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 115.478 -0.783 . . . . 0.0 112.616 -179.285 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . 0.449 ' HA2' ' HB2' ' A' ' 125' ' ' SER . . . -65.33 75.55 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.615 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 35.3 m . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.848 179.814 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.155 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -129.9 31.53 4.69 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.866 0.365 . . . . 0.0 110.925 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 62.62 122.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.891 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 204' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 57.6 38.15 27.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.825 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 206' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -127.05 58.26 28.51 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.986 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -53.53 149.54 30.64 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.541 2.161 . . . . 0.0 111.721 179.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 208' ' ' PHE . . . . . 0.52 ' CE2' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -61.89 -116.51 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.988 -179.907 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 209' ' ' NH2 . . . . . 0.464 ' N ' ' CD1' ' B' ' 208' ' ' PHE . . . . . . . . 0 C--N 1.33 -0.279 0 O-C-N 122.416 -0.177 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.6 mmt . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.824 0.345 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.402 ' ND2' ' CG2' ' A' ' 58' ' ' THR . 6.0 p-10 -148.37 -165.39 2.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.868 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.422 ' CD2' ' OE1' ' A' ' 11' ' ' GLN . 4.7 mp -78.18 -175.29 4.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.623 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.405 ' O ' ' N ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -103.04 153.13 20.57 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.01 179.201 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.444 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 75.4 mt -47.02 -61.83 1.69 Allowed 'General case' 0 CA--C 1.509 -0.607 0 CA-C-O 121.499 0.666 . . . . 0.0 110.993 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.438 ' HB2' ' O ' ' A' ' 127' ' ' ALA . 5.2 t -42.77 -61.6 1.22 Allowed 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.278 -179.282 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -69.57 -56.74 6.48 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.971 0.415 . . . . 0.0 110.867 -179.42 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.478 ' O ' ' HG2' ' A' ' 11' ' ' GLN . 23.5 tp -45.54 -45.84 13.66 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.751 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.548 ' HA ' HG13 ' A' ' 12' ' ' VAL . 56.4 t-80 -66.06 -40.27 90.77 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.424 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.4 -53.74 41.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.776 -1.102 . . . . 0.0 111.198 179.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.478 ' HG2' ' O ' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -69.16 -55.39 10.79 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 120.791 0.329 . . . . 0.0 111.235 -179.795 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.548 HG13 ' HA ' ' A' ' 9' ' ' HIS . 3.8 p -51.9 -49.63 36.59 Favored 'Isoleucine or valine' 0 C--O 1.242 0.694 0 CA-C-O 121.22 0.533 . . . . 0.0 110.659 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.76 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 52.9 m -62.73 -41.89 99.4 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.557 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.45 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -67.25 -17.7 64.91 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.385 179.629 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.49 HD12 HG12 ' A' ' 31' ' ' VAL . 6.1 mt -83.14 -61.43 1.86 Allowed 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -179.795 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.549 ' CG2' ' HB3' ' A' ' 110' ' ' LEU . 0.9 OUTLIER -69.38 -34.27 61.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 C-N-CA 120.015 -0.674 . . . . 0.0 111.34 -179.068 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.457 ' HB2' ' O ' ' A' ' 13' ' ' SER . 3.5 mm-40 -69.62 -16.16 63.33 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.176 -179.507 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.45 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 2.8 pt20 -163.57 56.86 0.17 Allowed 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 120.854 -0.338 . . . . 0.0 111.44 179.301 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 176.52 -63.1 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.454 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.445 ' OG ' ' CB ' ' A' ' 33' ' ' ALA . 0.5 OUTLIER -79.08 -80.47 0.12 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.374 -179.324 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.554 ' O ' ' HB3' ' A' ' 22' ' ' ASP . . . 113.28 -18.7 20.69 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.481 -179.599 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.63 ' O ' ' O ' ' A' ' 23' ' ' CYS . 21.9 p-10 166.46 -14.98 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.355 0.262 . . . . 0.0 111.388 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.63 ' O ' ' O ' ' A' ' 22' ' ' ASP . 58.0 m -42.13 -164.75 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.368 0.667 . . . . 0.0 112.718 -179.386 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.518 ' HA ' ' HA ' ' A' ' 109' ' ' THR . 20.4 m -103.75 162.15 13.33 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.781 -179.387 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.571 ' HA2' ' CD2' ' A' ' 110' ' ' LEU . . . -105.12 135.7 12.71 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.495 -0.86 . . . . 0.0 113.912 -178.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.563 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 1.3 tmmm? -104.92 119.52 39.21 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 178.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.587 ' O ' ' HB2' ' A' ' 28' ' ' ARG . 1.6 tt -104.63 165.25 11.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.665 -178.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.587 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER 140.1 56.2 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.618 1.167 . . . . 0.0 109.492 -179.862 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.402 ' O ' HD21 ' A' ' 3' ' ' LEU . . . 88.53 -4.94 85.15 Favored Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.877 -0.678 . . . . 0.0 111.764 -178.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.515 ' HB2' ' HA ' ' B' ' 207' ' ' PRO . 0.0 OUTLIER -165.7 165.46 18.6 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 -179.95 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.563 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 3.7 p -112.58 136.65 48.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.251 0.548 . . . . 0.0 110.911 178.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.468 ' CB ' ' HB3' ' A' ' 26' ' ' LYS . . . -129.3 167.43 17.72 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.629 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.445 ' CB ' ' OG ' ' A' ' 20' ' ' SER . . . -102.77 121.3 42.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.235 0.541 . . . . 0.0 111.588 -178.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.496 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 2.4 t30 -105.05 115.7 30.72 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.542 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.02 -25.78 15.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.391 -179.848 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.469 ' O ' ' HB ' ' A' ' 37' ' ' THR . 14.0 mm-40 -42.93 -82.21 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.717 -179.314 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.469 ' HB ' ' O ' ' A' ' 36' ' ' GLU . 7.5 t 172.0 -168.79 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.879 0.371 . . . . 0.0 110.945 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.573 ' O ' ' HB3' ' A' ' 39' ' ' PHE . 2.8 p 62.77 121.04 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.96 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.688 ' O ' ' HB3' ' A' ' 107' ' ' GLN . 11.3 p90 169.15 -31.67 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.688 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.472 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -54.78 67.99 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.602 -0.727 . . . . 0.0 112.478 -178.704 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.605 ' N ' ' O ' ' A' ' 39' ' ' PHE . . . 36.01 87.15 0.01 OUTLIER Glycine 0 C--N 1.332 0.31 0 CA-C-N 116.018 -0.537 . . . . 0.0 113.621 179.032 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.511 ' H ' ' HB2' ' A' ' 107' ' ' GLN . 0.1 OUTLIER -141.8 169.99 16.55 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 179.168 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.456 ' C ' ' H ' ' A' ' 45' ' ' ALA . 0.7 OUTLIER -103.28 41.31 1.28 Allowed 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 -177.698 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.409 ' CD1' ' N ' ' A' ' 44' ' ' ILE . 3.4 mp 53.54 5.14 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 179.012 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.456 ' H ' ' C ' ' A' ' 43' ' ' THR . . . -74.41 -41.29 61.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.928 0.394 . . . . 0.0 110.846 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.431 ' HB2' HD13 ' A' ' 42' ' ' LEU . 0.5 OUTLIER -72.31 -32.18 66.34 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.477 179.664 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 142.62 34.33 0.1 OUTLIER Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.618 -0.801 . . . . 0.0 113.381 179.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.409 ' HA ' ' HB ' ' A' ' 38' ' ' THR . . . -85.89 149.78 24.98 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 117.118 0.459 . . . . 0.0 111.049 179.624 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 7.4 mtm180 -81.45 159.89 24.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.738 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.452 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -67.32 -21.38 65.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.952 179.873 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.462 ' OG ' ' N ' ' A' ' 52' ' ' GLU . 1.0 OUTLIER -61.0 -65.1 0.75 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.379 -179.585 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.462 ' N ' ' OG ' ' A' ' 51' ' ' SER . 0.0 OUTLIER -49.08 -65.84 0.5 Allowed 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.977 0.417 . . . . 0.0 110.809 -179.824 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.639 ' HA ' ' HA ' ' A' ' 107' ' ' GLN . 0.0 OUTLIER -43.82 -51.25 7.51 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.094 179.872 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.512 ' H ' ' HG3' ' A' ' 53' ' ' LYS . 53.4 t -61.13 -31.14 49.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.083 0.468 . . . . 0.0 110.244 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.7 ' HB3' ' HB3' ' A' ' 108' ' ' MET . 0.3 OUTLIER -66.61 -48.0 70.9 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.615 179.649 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -60.45 -45.87 92.11 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.966 0.412 . . . . 0.0 110.201 179.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 21.1 mm-40 -55.26 -55.55 30.09 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.604 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.402 ' CG2' ' ND2' ' A' ' 2' ' ' ASN . 0.7 OUTLIER -67.38 -30.54 70.35 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.005 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.421 ' CG1' ' OH ' ' A' ' 88' ' ' TYR . 0.9 OUTLIER -60.56 -57.09 13.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.258 -179.556 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.725 ' HA ' ' CG2' ' A' ' 63' ' ' VAL . 42.3 mt -75.49 -34.71 60.89 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 121.339 0.59 . . . . 0.0 111.335 -179.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 45.5 m -57.83 -42.12 83.71 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.18 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -75.62 -50.27 16.02 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-O 120.751 0.31 . . . . 0.0 110.611 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.725 ' CG2' ' HA ' ' A' ' 60' ' ' LEU . 11.6 m -60.06 -50.37 80.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.943 0.401 . . . . 0.0 110.55 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.452 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 34.92 34.71 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.56 -0.745 . . . . 0.0 112.148 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.476 ' O ' ' CG2' ' A' ' 66' ' ' VAL . 0.5 OUTLIER 163.47 -81.12 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -179.679 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.547 ' CG1' ' HB ' ' A' ' 63' ' ' VAL . 11.3 m 54.63 -160.15 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 122.725 0.41 . . . . 0.0 110.911 -177.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.526 ' O ' ' O ' ' A' ' 98' ' ' SER . 9.9 p -151.72 -28.02 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.663 ' HB3' ' HB2' ' A' ' 72' ' ' ASP . 0.3 OUTLIER 32.27 95.24 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.976 -0.556 . . . . 0.0 112.407 179.193 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.632 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 14.5 p -66.11 -117.67 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.69 179.701 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.455 ' N ' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER -95.06 -38.94 10.4 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.062 0.458 . . . . 0.0 110.963 179.974 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -64.0 -61.12 2.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.089 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.663 ' HB2' ' HB3' ' A' ' 68' ' ' LEU . 0.8 OUTLIER -59.27 -30.26 68.16 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.21 -179.646 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.432 ' OG1' ' HA ' ' A' ' 70' ' ' GLN . 0.9 OUTLIER -63.39 -59.05 5.2 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 178.323 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -57.52 -24.75 57.78 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.292 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.619 ' HB2' ' HA ' ' A' ' 72' ' ' ASP . 0.1 OUTLIER -62.25 -56.88 14.2 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 114.742 -1.117 . . . . 0.0 110.066 178.773 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.412 ' CD2' HD11 ' A' ' 116' ' ' LEU . 0.4 OUTLIER -59.23 -38.58 80.32 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.33 0.586 . . . . 0.0 109.438 178.613 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.9 -48.7 79.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.078 -0.965 . . . . 0.0 111.35 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.8 mm-40 -72.42 -42.42 65.11 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.311 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 4.7 p -68.91 -27.63 65.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.272 -179.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 81.2 m -95.39 -38.66 10.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.573 -179.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 17.6 t -95.06 -4.38 10.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -179.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -34.81 -57.87 0.53 Allowed 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -179.426 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 2.9 p-80 -176.95 44.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.869 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 65.9 m-80 -158.27 171.2 20.63 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.998 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -59.95 130.12 45.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.072 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -60.7 110.0 1.19 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.169 179.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 14.2 p30 -103.91 -19.4 14.25 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 116.078 -0.51 . . . . 0.0 112.062 -178.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.558 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 2.4 m-85 -99.62 148.95 23.78 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 120.329 -0.548 . . . . 0.0 111.485 -179.331 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.686 ' O ' ' O ' ' A' ' 101' ' ' VAL . 0.0 OUTLIER -119.68 148.64 43.14 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.509 -179.116 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.441 ' N ' ' CD1' ' A' ' 90' ' ' LEU . 0.0 OUTLIER -148.9 150.61 33.25 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.307 0.575 . . . . 0.0 112.18 -179.335 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 18.0 tpt180 -121.94 141.65 51.1 Favored 'General case' 0 C--O 1.221 -0.435 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.476 ' O ' ' CG1' ' A' ' 93' ' ' VAL . 55.4 p -104.71 145.85 29.78 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.879 1.066 . . . . 0.0 113.879 -177.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.476 ' CG1' ' O ' ' A' ' 92' ' ' SER . 3.6 m -171.12 -125.76 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.553 0 CA-C-N 113.297 -1.774 . . . . 0.0 107.908 179.204 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.43 ' HA3' ' OD1' ' A' ' 97' ' ' ASN . . . 31.47 39.19 0.04 OUTLIER Glycine 0 CA--C 1.522 0.528 0 N-CA-C 114.583 0.593 . . . . 0.0 114.583 178.079 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 41.44 31.18 0.16 Allowed 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 117.314 0.557 . . . . 0.0 111.203 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 139.69 0.18 2.07 Favored Glycine 0 N--CA 1.447 -0.577 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.919 -179.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.632 ' HA ' ' HA ' ' A' ' 69' ' ' THR . 0.1 OUTLIER -108.87 166.22 10.98 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.847 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.526 ' O ' ' O ' ' A' ' 67' ' ' VAL . 1.5 t -137.39 165.4 26.32 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.431 0.634 . . . . 0.0 111.165 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -103.68 147.63 9.67 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 179.225 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.583 HD13 ' HB3' ' A' ' 102' ' ' SER . 7.6 tp -103.77 105.76 16.06 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 121.909 0.862 . . . . 0.0 113.302 -177.646 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.686 ' O ' ' O ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -123.14 120.57 60.77 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 N-CA-C 103.743 -2.688 . . . . 0.0 103.743 175.467 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.596 ' HB2' ' H ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -157.96 166.17 33.27 Favored 'General case' 0 C--N 1.305 -1.341 0 C-N-CA 117.529 -1.669 . . . . 0.0 114.395 -173.895 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.602 HD21 ' CD1' ' A' ' 60' ' ' LEU . 0.1 OUTLIER 161.9 -90.16 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.105 0 CA-C-N 113.502 -1.681 . . . . 0.0 111.835 175.59 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.555 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 53.75 27.61 7.2 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 -179.416 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.555 ' CB ' ' O ' ' A' ' 104' ' ' ARG . 17.6 m 133.99 160.5 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.552 1.141 . . . . 0.0 108.1 -178.543 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.571 ' O ' ' HG3' ' A' ' 107' ' ' GLN . 1.0 OUTLIER -104.82 101.0 10.62 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 120.038 -0.665 . . . . 0.0 112.243 -178.703 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.688 ' HB3' ' O ' ' A' ' 39' ' ' PHE . 5.5 mt-30 -169.85 159.82 8.16 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.415 177.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.7 ' HB3' ' HB3' ' A' ' 55' ' ' PHE . 2.4 tpt -158.56 153.73 25.47 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.629 0.604 . . . . 0.0 112.629 179.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.518 ' HA ' ' HA ' ' A' ' 24' ' ' THR . 0.1 OUTLIER -115.47 165.29 13.15 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.857 178.662 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.571 ' CD2' ' HA2' ' A' ' 25' ' ' GLY . 0.2 OUTLIER -50.94 -55.78 15.58 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.696 0.284 . . . . 0.0 111.288 -179.933 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.685 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 0.9 OUTLIER -49.17 -65.96 0.48 Allowed 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.355 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.464 ' O ' ' HB ' ' A' ' 115' ' ' VAL . 0.0 OUTLIER -49.57 -56.94 8.14 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.025 0.44 . . . . 0.0 110.83 -179.224 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.458 ' CB ' ' CZ ' ' A' ' 55' ' ' PHE . . . -40.44 -54.57 2.44 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.843 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.76 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -67.31 -33.34 75.07 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.099 179.708 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.53 ' CG2' ' CG ' ' A' ' 75' ' ' LYS . 54.9 t -54.36 -61.69 0.91 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.746 0 CA-C-O 121.756 0.788 . . . . 0.0 110.72 179.697 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.508 ' O ' ' HB3' ' A' ' 120' ' ' ALA . 0.1 OUTLIER -62.26 -43.2 99.37 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.177 -179.534 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.466 ' HA ' ' HB3' ' A' ' 120' ' ' ALA . 0.7 OUTLIER -66.99 -19.08 65.66 Favored 'General case' 0 CA--C 1.51 -0.565 0 C-N-CA 120.764 -0.375 . . . . 0.0 111.156 179.624 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.728 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 10.1 tt0 -70.7 -54.18 12.81 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 106.095 -1.817 . . . . 0.0 106.095 176.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . 0.484 ' O ' ' HB2' ' A' ' 123' ' ' GLN . . . -69.83 -18.86 63.47 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.478 -1.237 . . . . 0.0 110.675 177.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.508 ' HB3' ' O ' ' A' ' 116' ' ' LEU . . . -79.88 -62.72 1.6 Allowed 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 121.151 0.5 . . . . 0.0 110.432 179.543 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.579 ' O ' ' N ' ' A' ' 126' ' ' GLY . 0.1 OUTLIER -60.01 -24.78 64.76 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.525 -179.619 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.728 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -87.01 -41.69 13.68 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -179.903 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.484 ' HB2' ' O ' ' A' ' 119' ' ' ALA . 1.1 tm0? -84.8 -29.76 25.14 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -178.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -95.24 -65.97 0.94 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.543 0.571 . . . . 0.0 112.543 -178.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.35 -4.71 44.93 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.423 -178.17 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . 0.579 ' N ' ' O ' ' A' ' 121' ' ' LEU . . . 42.53 74.49 0.18 Allowed Glycine 0 C--N 1.331 0.289 0 C-N-CA 120.518 -0.848 . . . . 0.0 111.788 -178.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.438 ' O ' ' HB2' ' A' ' 6' ' ' SER . . . 80.18 -48.87 0.34 Allowed 'General case' 0 CA--C 1.52 -0.176 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 -177.729 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . 0.404 ' HG2' ' CB ' ' A' ' 6' ' ' SER . 0.0 OUTLIER 172.38 106.75 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.646 178.229 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 44.03 25.7 0.72 Allowed Glycine 0 CA--C 1.519 0.306 0 CA-C-N 115.62 -0.718 . . . . 0.0 113.042 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.187 -0.911 . . . . 0.0 110.82 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.097 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -149.4 -177.39 5.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.789 0.328 . . . . 0.0 110.862 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -149.37 -172.02 4.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.886 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 204' ' ' PTR . . . . . 0.447 ' HE1' ' CE ' ' A' ' 26' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 53.41 -91.19 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.331 178.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 206' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -45.53 105.88 0.5 Allowed Pre-proline 0 N--CA 1.463 0.186 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -178.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . 0.515 ' HA ' ' HB2' ' A' ' 30' ' ' ASN . 12.3 Cg_endo -55.77 -177.35 0.05 OUTLIER 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 122.438 2.092 . . . . 0.0 112.026 179.566 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 208' ' ' PHE . . . . . 0.432 ' CE1' ' HA ' ' A' ' 11' ' ' GLN . 25.6 m-85 61.9 -82.11 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.956 179.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.657 -0.247 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.9 ptt? . . . . . 0 N--CA 1.488 1.446 0 CA-C-O 120.658 0.266 . . . . 0.0 111.412 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 30.4 t30 -125.8 168.04 14.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.874 0.369 . . . . 0.0 110.679 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.401 HD12 ' CD1' ' A' ' 8' ' ' LEU . 0.3 OUTLIER -66.57 172.28 4.3 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.374 -179.487 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 53.5 p -74.0 -151.34 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.877 179.165 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.679 ' O ' ' CD2' ' A' ' 9' ' ' HIS . 1.1 mt -95.27 -66.56 0.9 Allowed 'General case' 0 CA--C 1.504 -0.826 0 CA-C-O 121.531 0.681 . . . . 0.0 111.757 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.522 ' HB2' ' CG ' ' A' ' 128' ' ' ARG . 0.0 OUTLIER -35.73 -46.78 0.46 Allowed 'General case' 0 N--CA 1.435 -1.223 0 CA-C-N 115.205 -0.907 . . . . 0.0 112.914 -178.422 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -78.97 -42.49 26.68 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -179.584 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.554 ' HB3' ' HD2' ' A' ' 9' ' ' HIS . 11.2 tp -64.23 -35.47 80.93 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.545 0.688 . . . . 0.0 110.868 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.679 ' CD2' ' O ' ' A' ' 5' ' ' LEU . 3.4 m170 -79.62 -43.1 23.52 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.727 -1.124 . . . . 0.0 110.873 -178.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.479 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 5.2 mmt85 -60.2 -37.57 80.66 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 178.375 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.495 ' HG2' HG12 ' A' ' 31' ' ' VAL . 5.9 tt0 -65.59 -65.91 0.61 Allowed 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.455 178.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.51 ' HB ' HG11 ' A' ' 31' ' ' VAL . 7.4 p -55.08 -48.11 76.39 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.517 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.43 ' O ' ' CG ' ' A' ' 17' ' ' GLN . 83.9 p -54.81 -60.05 3.9 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.383 -179.454 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.479 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -53.97 -48.19 70.58 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -178.698 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.485 ' CD1' ' CD2' ' A' ' 110' ' ' LEU . 0.2 OUTLIER -60.28 -57.75 11.43 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 119.61 -0.836 . . . . 0.0 111.084 -179.267 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.827 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 9.9 p -69.28 -11.67 15.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -178.627 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.694 ' HG2' ' HE3' ' A' ' 114' ' ' LYS . 3.8 mm-40 -95.6 -4.36 44.68 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -148.83 -47.17 0.15 Allowed 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -87.81 -61.33 1.74 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -178.888 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.827 ' HB2' ' HA ' ' A' ' 16' ' ' VAL . 4.6 m -73.76 -47.24 40.5 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.037 -0.529 . . . . 0.0 112.318 -178.479 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 85.07 -39.85 2.99 Favored Glycine 0 CA--C 1.519 0.308 0 C-N-CA 120.519 -0.848 . . . . 0.0 111.782 -178.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.569 ' O ' ' O ' ' A' ' 23' ' ' CYS . 7.5 t70 -170.59 -66.44 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.569 ' O ' ' O ' ' A' ' 22' ' ' ASP . 0.1 OUTLIER 28.46 -159.22 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.624 0.769 . . . . 0.0 112.506 178.945 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.582 ' HA ' HG22 ' A' ' 109' ' ' THR . 0.1 OUTLIER -104.03 156.08 18.15 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.063 -0.718 . . . . 0.0 109.063 179.005 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.47 ' H ' ' HA ' ' A' ' 109' ' ' THR . . . -104.68 119.69 6.33 Favored Glycine 0 N--CA 1.443 -0.85 0 C-N-CA 120.172 -1.013 . . . . 0.0 113.184 -178.551 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.638 ' HB2' ' CB ' ' A' ' 51' ' ' SER . 0.0 OUTLIER -104.58 115.5 30.46 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 178.67 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.487 ' HB2' ' CG ' ' A' ' 55' ' ' PHE . 2.8 tt -110.09 151.8 26.77 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.574 0.702 . . . . 0.0 112.605 -177.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.467 ' HG2' ' C ' ' A' ' 27' ' ' LEU . 4.9 ptp180 160.78 52.49 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 114.63 -1.168 . . . . 0.0 108.888 179.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 100.76 -6.81 57.27 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.137 -178.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.463 ' ND2' ' HD2' ' B' ' 204' ' ' PTR . 0.0 OUTLIER -166.36 165.55 17.14 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 179.868 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.51 HG11 ' HB ' ' A' ' 12' ' ' VAL . 0.2 OUTLIER -116.77 122.53 70.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.227 0.537 . . . . 0.0 110.432 178.709 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.457 ' CB ' ' CG ' ' A' ' 26' ' ' LYS . . . -120.22 167.1 12.6 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.008 -179.387 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.471 ' HB3' HD11 ' A' ' 110' ' ' LEU . . . -102.2 127.72 49.02 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.274 0.559 . . . . 0.0 111.542 -179.024 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.435 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 6.3 t30 -111.89 132.53 54.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.643 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.1 -22.04 3.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.228 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -57.72 -23.52 52.29 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.427 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 4.6 t -154.97 155.04 33.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.062 0.458 . . . . 0.0 110.626 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 23.2 p -81.84 -122.63 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.609 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.526 ' CG ' ' N ' ' A' ' 40' ' ' GLN . 0.2 OUTLIER -176.32 -85.48 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 121.351 -0.14 . . . . 0.0 111.131 179.962 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.537 ' O ' ' C ' ' A' ' 41' ' ' GLY . 0.0 OUTLIER 56.06 88.68 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 122.45 0.3 . . . . 0.0 111.141 179.667 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.537 ' C ' ' O ' ' A' ' 40' ' ' GLN . . . 14.4 98.41 0.0 OUTLIER Glycine 0 C--N 1.346 1.108 0 O-C-N 123.498 0.499 . . . . 0.0 112.738 -179.193 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.546 ' N ' ' NE2' ' A' ' 107' ' ' GLN . 6.2 tp -151.08 159.9 44.22 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.481 -0.192 . . . . 0.0 110.481 -178.157 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.472 ' C ' ' H ' ' A' ' 45' ' ' ALA . 0.0 OUTLIER -107.37 33.1 4.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.942 0.401 . . . . 0.0 111.282 -179.457 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.516 ' CD1' ' N ' ' A' ' 44' ' ' ILE . 0.9 OUTLIER 59.13 -0.54 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.13 179.777 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.472 ' H ' ' C ' ' A' ' 43' ' ' THR . . . -77.97 -40.94 37.74 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.914 0.388 . . . . 0.0 110.719 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.413 ' HB2' ' CD1' ' A' ' 42' ' ' LEU . 0.5 OUTLIER -71.25 -31.16 67.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.712 179.81 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 143.92 52.92 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.989 179.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.493 ' HB1' ' OE1' ' A' ' 107' ' ' GLN . . . -121.09 -173.72 2.67 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.739 0.304 . . . . 0.0 111.256 179.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 14.7 ttm180 -109.74 139.4 44.84 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.091 -179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.685 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 12.2 mt-10 -56.66 -18.1 11.08 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.412 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.638 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 0.8 OUTLIER -71.97 -56.98 4.71 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.316 -179.91 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -48.25 -44.23 33.19 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.033 0.444 . . . . 0.0 110.796 179.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.685 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -65.59 -58.69 5.15 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.507 -179.971 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.512 HG21 ' O ' ' A' ' 51' ' ' SER . 14.1 m -49.27 -45.2 18.03 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-O 121.051 0.453 . . . . 0.0 110.352 179.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.487 ' CG ' ' HB2' ' A' ' 27' ' ' LEU . 0.2 OUTLIER -55.38 -53.62 53.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.827 178.649 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -48.28 -45.85 35.16 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.577 179.176 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -64.07 -45.82 87.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.887 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.424 ' OG1' ' HA ' ' A' ' 55' ' ' PHE . 0.6 OUTLIER -64.35 -53.68 44.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.289 -179.528 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.723 ' CG2' ' HB2' ' A' ' 116' ' ' LEU . 4.6 p -60.66 -38.28 78.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.064 179.544 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.2 tp -61.23 -39.14 89.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.845 0.355 . . . . 0.0 110.268 178.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 33.8 m -69.53 -60.42 2.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.905 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 14.2 m-70 -52.94 -27.67 19.97 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.837 0.351 . . . . 0.0 111.226 -179.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.646 ' CG2' ' HB3' ' A' ' 116' ' ' LEU . 3.8 t -102.41 46.78 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.045 -179.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.629 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . -76.56 57.77 1.27 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.412 -179.681 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.629 ' CB ' ' O ' ' A' ' 64' ' ' ALA . 26.0 t-20 132.31 -63.68 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.21 0.604 . . . . 0.0 111.381 179.632 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.544 HG12 HG11 ' A' ' 63' ' ' VAL . 35.4 m 42.47 -137.28 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.602 -179.455 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.51 ' O ' ' O ' ' A' ' 98' ' ' SER . 2.8 p -158.89 -31.95 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 121.027 0.441 . . . . 0.0 111.926 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.53 ' HA ' ' HB1' ' A' ' 119' ' ' ALA . 0.7 OUTLIER 40.85 95.67 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.647 179.226 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 22.0 p -66.78 -165.38 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.91 -34.15 71.36 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.017 0.437 . . . . 0.0 110.697 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -68.19 -51.33 46.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.63 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.532 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 3.3 m-20 -60.46 -42.12 95.54 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.779 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 70.6 m -61.89 -44.64 96.39 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-O 121.103 0.478 . . . . 0.0 110.122 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.497 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . . . -68.81 -28.98 67.24 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 178.055 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.706 ' HB3' ' HB ' ' A' ' 115' ' ' VAL . 0.0 OUTLIER -56.4 -57.52 11.95 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 114.061 -1.427 . . . . 0.0 109.834 178.354 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.453 ' HG ' HG22 ' A' ' 115' ' ' VAL . 5.9 mp -62.64 -53.43 54.66 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.164 179.244 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.497 ' CD2' ' HA ' ' A' ' 74' ' ' ALA . 0.3 OUTLIER -54.52 -32.12 57.54 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.72 -179.763 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -67.87 -65.03 0.74 Allowed 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.917 0.389 . . . . 0.0 109.994 179.115 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.03 -22.46 60.73 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.743 179.282 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.47 ' HA ' ' HB3' ' A' ' 85' ' ' LEU . 31.4 m -72.56 -64.98 0.85 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.967 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 27.4 m -68.76 -14.78 18.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.728 -179.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.21 -68.55 0.18 Allowed 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.668 0.271 . . . . 0.0 111.556 -179.804 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 10.6 t-80 -136.04 68.64 1.44 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.852 0.358 . . . . 0.0 111.251 -179.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 47.27 70.26 0.43 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.431 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.47 ' HB3' ' HA ' ' A' ' 80' ' ' THR . 2.1 tm? -130.76 75.37 1.65 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.708 179.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 19.2 p30 -103.35 25.22 9.84 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.611 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 37.3 p-10 -74.61 -14.56 60.79 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.176 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.603 ' CG ' ' HB2' ' A' ' 102' ' ' SER . 2.8 m-85 -103.13 139.69 38.32 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.835 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.654 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.7 OUTLIER -109.63 146.24 35.11 Favored 'General case' 0 N--CA 1.436 -1.134 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -178.985 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.43 ' N ' ' OD1' ' A' ' 89' ' ' ASP . 36.7 mt -136.01 153.58 51.33 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 113.364 0.875 . . . . 0.0 113.364 -177.449 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.447 ' O ' ' OG ' ' A' ' 98' ' ' SER . 25.2 ttp180 -130.71 142.65 50.43 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 114.69 -1.141 . . . . 0.0 108.193 178.031 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 3.8 p -104.66 140.64 37.74 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 113.796 1.036 . . . . 0.0 113.796 -178.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.428 HG23 ' N ' ' A' ' 94' ' ' GLY . 27.8 m -159.78 -137.49 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.82 0 CA-C-N 113.833 -1.53 . . . . 0.0 107.769 178.376 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.531 ' O ' ' N ' ' A' ' 96' ' ' GLY . . . 31.49 36.97 0.03 OUTLIER Glycine 0 N--CA 1.46 0.265 0 C-N-CA 121.563 -0.351 . . . . 0.0 113.631 178.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . 0.425 ' N ' ' O ' ' A' ' 93' ' ' VAL . 44.6 t30 64.32 -69.83 0.08 Allowed 'General case' 0 C--O 1.231 0.111 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 -178.457 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.531 ' N ' ' O ' ' A' ' 94' ' ' GLY . . . -121.1 22.89 7.86 Favored Glycine 0 N--CA 1.445 -0.749 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 177.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.4 ' ND2' ' HA3' ' A' ' 94' ' ' GLY . 0.3 OUTLIER -114.95 166.12 12.13 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 110.221 -0.289 . . . . 0.0 110.221 -179.817 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.51 ' O ' ' O ' ' A' ' 67' ' ' VAL . 0.9 OUTLIER -140.73 164.01 31.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.485 0.659 . . . . 0.0 111.308 -179.927 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -104.19 151.21 6.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 178.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.508 HD23 HG13 ' A' ' 63' ' ' VAL . 1.0 OUTLIER -103.94 111.54 24.13 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -178.995 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.654 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 1.4 p -124.27 104.68 14.26 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 104.352 -2.462 . . . . 0.0 104.352 175.143 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.603 ' HB2' ' CG ' ' A' ' 88' ' ' TYR . 9.0 p -148.92 165.35 31.84 Favored 'General case' 0 C--N 1.311 -1.106 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -173.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.463 ' CB ' ' O ' ' A' ' 102' ' ' SER . 0.0 OUTLIER 158.62 -91.08 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.077 0 CA-C-N 113.07 -1.877 . . . . 0.0 111.864 176.03 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.512 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 56.87 23.07 7.72 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 -178.641 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.512 ' CB ' ' O ' ' A' ' 104' ' ' ARG . 5.1 m 138.9 168.22 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.859 1.264 . . . . 0.0 108.154 -178.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.428 ' O ' ' O ' ' A' ' 42' ' ' LEU . 1.3 m-20 -104.89 102.59 12.11 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.082 -0.647 . . . . 0.0 112.348 -179.076 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.546 ' NE2' ' N ' ' A' ' 42' ' ' LEU . 0.6 OUTLIER -168.1 157.47 9.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.699 177.991 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.462 ' CE ' ' CE1' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -165.64 145.03 6.4 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.21 0.529 . . . . 0.0 112.293 179.268 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.582 HG22 ' HA ' ' A' ' 24' ' ' THR . 0.7 OUTLIER -104.26 163.47 12.39 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 178.256 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.554 ' HB2' ' O ' ' A' ' 22' ' ' ASP . 5.2 mt -52.8 -61.39 2.32 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 120.165 -0.614 . . . . 0.0 109.838 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.419 ' O ' ' HG2' ' A' ' 114' ' ' LYS . 2.5 tp60 -40.15 -63.38 0.62 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 120.713 0.292 . . . . 0.0 110.603 179.145 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 1.043 ' O ' HG21 ' A' ' 115' ' ' VAL . 8.0 m-20 -51.5 -58.51 6.1 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 121.265 0.555 . . . . 0.0 110.154 179.384 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.577 ' O ' ' HB2' ' A' ' 117' ' ' LEU . . . -48.4 -39.87 23.93 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.12 0.486 . . . . 0.0 110.108 178.798 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.694 ' HE3' ' HG2' ' A' ' 17' ' ' GLN . 0.0 OUTLIER -72.22 -26.97 62.24 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.877 179.729 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 1.043 HG21 ' O ' ' A' ' 112' ' ' ASP . 10.8 m -70.48 -51.82 34.44 Favored 'Isoleucine or valine' 0 C--O 1.249 1.038 0 CA-C-O 121.406 0.622 . . . . 0.0 111.892 -179.079 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.723 ' HB2' ' CG2' ' A' ' 59' ' ' VAL . 0.5 OUTLIER -70.0 -37.84 75.82 Favored 'General case' 0 N--CA 1.439 -1.017 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 179.433 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.77 ' HA ' ' HB2' ' A' ' 120' ' ' ALA . 5.1 mp -65.6 -32.28 73.77 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.905 178.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.474 ' HA ' HD23 ' A' ' 121' ' ' LEU . 26.4 tp10 -62.17 -53.24 58.14 Favored 'General case' 0 C--N 1.31 -1.112 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 178.51 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . 0.53 ' HB1' ' HA ' ' A' ' 68' ' ' LEU . . . -74.47 -16.56 60.85 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 119.382 -0.927 . . . . 0.0 110.741 177.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.77 ' HB2' ' HA ' ' A' ' 117' ' ' LEU . . . -77.99 -61.51 1.98 Allowed 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.409 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.67 ' HB3' ' ND1' ' A' ' 9' ' ' HIS . 0.4 OUTLIER -56.55 -34.71 67.36 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 118.736 -1.186 . . . . 0.0 108.785 178.111 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.499 ' HA ' ' HA3' ' A' ' 129' ' ' GLY . 0.1 OUTLIER -55.03 -65.28 0.61 Allowed 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 114.918 -1.037 . . . . 0.0 112.223 179.797 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.77 -13.25 24.27 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -177.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . 0.629 ' HB2' ' O ' ' A' ' 120' ' ' ALA . 5.0 mm-40 -97.68 -67.06 0.86 Allowed 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 -177.449 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.601 ' HB2' ' HA ' ' A' ' 121' ' ' LEU . 10.1 t -47.78 -59.93 2.95 Favored 'General case' 0 CA--C 1.5 -0.981 0 CA-C-N 114.293 -1.321 . . . . 0.0 112.496 -176.458 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 65.32 3.7 13.92 Favored Glycine 0 N--CA 1.433 -1.566 0 N-CA-C 108.792 -1.723 . . . . 0.0 108.792 -175.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.506 ' H ' ' C ' ' A' ' 125' ' ' SER . . . -94.04 -33.43 13.4 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 178.551 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . 0.522 ' CG ' ' HB2' ' A' ' 6' ' ' SER . 24.9 mmt180 -142.53 -33.39 0.47 Allowed 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 114.708 -1.133 . . . . 0.0 111.06 178.969 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . 0.499 ' HA3' ' HA ' ' A' ' 122' ' ' ARG . . . -86.58 5.88 83.68 Favored Glycine 0 C--N 1.349 1.252 0 C-N-CA 118.798 -1.668 . . . . 0.0 112.64 179.436 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.221 -0.895 . . . . 0.0 111.022 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.095 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 59.99 147.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.813 0.34 . . . . 0.0 110.834 . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 62.22 -80.65 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.938 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 204' ' ' PTR . . . . . 0.463 ' HD2' ' ND2' ' A' ' 30' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -108.21 -87.79 0.49 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.323 -179.631 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 206' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -58.44 108.05 1.17 Allowed Pre-proline 0 C--N 1.332 -0.194 0 CA-C-O 120.502 0.192 . . . . 0.0 110.9 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . 0.413 ' CB ' ' NE2' ' A' ' 11' ' ' GLN . 33.6 Cg_endo -64.09 90.14 0.16 Allowed 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.284 1.989 . . . . 0.0 112.532 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 208' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 178.65 85.01 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.903 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 116.533 -0.303 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.893 0.378 . . . . 0.0 111.177 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.452 ' ND2' ' H ' ' A' ' 3' ' ' LEU . 11.2 t-20 -57.89 164.26 2.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.885 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.469 ' HG ' ' HA2' ' A' ' 29' ' ' GLY . 0.0 OUTLIER -79.88 -76.02 0.23 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.098 179.579 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.503 ' O ' ' CB ' ' A' ' 8' ' ' LEU . 36.1 t -178.48 -151.72 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.766 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.548 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 23.1 mt -96.04 -64.7 1.03 Allowed 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 121.365 0.602 . . . . 0.0 111.453 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.425 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 0.9 OUTLIER -36.19 -59.16 0.64 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.766 -1.106 . . . . 0.0 112.958 -178.288 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -73.32 -54.32 8.66 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 120.757 0.313 . . . . 0.0 110.733 -179.387 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.503 ' CB ' ' O ' ' A' ' 4' ' ' SER . 46.0 tp -42.5 -51.19 5.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.254 0.549 . . . . 0.0 110.166 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.507 ' CG ' ' CD2' ' A' ' 121' ' ' LEU . 9.6 t60 -64.34 -46.53 83.07 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 177.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.425 ' HB2' ' O ' ' A' ' 6' ' ' SER . 0.0 OUTLIER -50.84 -57.15 9.15 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.21 -1.359 . . . . 0.0 111.741 -179.545 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.55 ' HG3' ' CG2' ' A' ' 31' ' ' VAL . 2.3 pt20 -65.41 -51.37 60.78 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -179.145 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.444 ' HA ' HD12 ' A' ' 15' ' ' LEU . 8.9 p -58.75 -46.22 90.82 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-O 121.206 0.527 . . . . 0.0 110.614 179.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.818 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 24.5 t -56.56 -49.2 75.53 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.329 179.649 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.8 ttt85 -63.82 -30.5 71.59 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.952 0.405 . . . . 0.0 110.533 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.5 ' CD1' ' CG2' ' A' ' 31' ' ' VAL . 6.4 mt -67.56 -65.47 0.68 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.353 -179.422 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.476 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 0.9 OUTLIER -68.04 -27.7 38.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -178.566 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.412 ' HB2' ' O ' ' A' ' 13' ' ' SER . 1.8 mm-40 -87.09 -9.95 54.12 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.672 -179.523 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -151.94 38.44 0.59 Allowed 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 120.821 -0.351 . . . . 0.0 111.925 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 179.35 -67.69 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 179.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.476 ' HB2' ' HA ' ' A' ' 16' ' ' VAL . 15.3 m -72.33 -40.34 67.5 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -178.219 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.438 ' H ' ' HA ' ' A' ' 16' ' ' VAL . . . 82.3 -50.42 4.32 Favored Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.374 -0.917 . . . . 0.0 112.192 -179.06 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -175.93 30.69 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.74 0.305 . . . . 0.0 111.412 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.455 ' HB2' ' HB3' ' A' ' 20' ' ' SER . 1.0 OUTLIER -79.22 -163.14 0.46 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.503 179.734 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.431 ' HA ' ' HA ' ' A' ' 109' ' ' THR . 40.5 m -104.13 149.44 25.23 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.401 ' CA ' ' HG ' ' A' ' 110' ' ' LEU . . . -107.21 145.29 16.0 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.2 -1.0 . . . . 0.0 113.639 -178.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.648 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 0.0 OUTLIER -108.86 123.6 49.31 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 178.939 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.606 ' O ' ' HD3' ' A' ' 28' ' ' ARG . 6.6 tt -104.27 163.52 12.36 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -178.304 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.606 ' HD3' ' O ' ' A' ' 27' ' ' LEU . 0.1 OUTLIER 145.86 58.67 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.425 1.09 . . . . 0.0 109.368 179.966 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.469 ' HA2' ' HG ' ' A' ' 3' ' ' LEU . . . 75.91 6.7 82.84 Favored Glycine 0 C--N 1.335 0.524 0 C-N-CA 120.109 -1.043 . . . . 0.0 110.727 -177.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.471 ' C ' ' ND2' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -166.12 165.9 17.43 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 -179.52 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.648 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 0.7 OUTLIER -131.89 118.09 36.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.522 0.677 . . . . 0.0 111.215 178.763 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -104.92 166.07 10.63 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.901 -179.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -103.9 116.36 32.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.239 0.542 . . . . 0.0 111.344 -179.528 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.424 ' ND2' ' HB ' ' A' ' 24' ' ' THR . 5.9 t30 -97.74 120.59 38.4 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.718 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.0 ttpp -114.15 -25.47 8.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.986 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -60.01 -55.0 39.45 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.818 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.57 -169.44 2.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.548 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.489 ' O ' ' HB3' ' A' ' 39' ' ' PHE . 29.7 p -132.67 -43.17 0.91 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.465 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.574 ' O ' ' HB3' ' A' ' 40' ' ' GLN . 0.0 OUTLIER 91.2 175.02 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.269 0.628 . . . . 0.0 110.746 -179.545 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.574 ' HB3' ' O ' ' A' ' 39' ' ' PHE . 0.1 OUTLIER 150.08 62.82 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.878 0.871 . . . . 0.0 109.803 -179.667 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.772 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . 67.27 -88.78 0.16 Allowed Glycine 0 CA--C 1.522 0.511 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.072 -178.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.625 ' O ' ' O ' ' A' ' 41' ' ' GLY . 13.6 tp 42.86 172.07 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 117.41 0.605 . . . . 0.0 111.915 179.257 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -127.85 34.79 4.57 Favored 'General case' 0 C--N 1.329 -0.285 0 O-C-N 121.81 -0.556 . . . . 0.0 111.655 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.451 ' HA ' ' HB2' ' A' ' 48' ' ' ALA . 30.2 mm 56.61 7.34 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 179.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -91.6 -31.23 15.97 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.723 0.297 . . . . 0.0 111.456 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -91.78 -53.26 4.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.22 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 177.52 71.36 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.585 -0.816 . . . . 0.0 112.799 -179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.451 ' HB2' ' HA ' ' A' ' 44' ' ' ILE . . . -135.31 161.67 34.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.674 0.273 . . . . 0.0 110.775 179.731 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 29.4 mtt180 -93.83 134.22 36.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.115 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.6 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 7.0 mt-10 -51.29 -27.0 8.27 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.164 0.507 . . . . 0.0 110.732 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.5 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 31.1 p -69.82 -57.87 4.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.346 179.542 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -44.28 -50.69 8.85 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.183 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.6 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -65.04 -51.73 59.92 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.425 -179.815 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.504 ' H ' ' HG3' ' A' ' 53' ' ' LYS . 53.7 t -56.6 -37.48 52.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.516 ' CG ' ' HB2' ' A' ' 27' ' ' LEU . 0.2 OUTLIER -59.96 -47.61 85.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.179 -0.918 . . . . 0.0 109.429 178.746 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.511 ' O ' ' CD1' ' A' ' 60' ' ' LEU . . . -54.79 -64.55 0.8 Allowed 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.83 178.75 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.4 ' O ' ' CB ' ' A' ' 61' ' ' SER . 2.6 mm-40 -39.87 -48.73 2.35 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.814 179.25 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.457 ' O ' ' CE1' ' A' ' 62' ' ' HIS . 0.9 OUTLIER -65.19 -54.05 35.53 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.557 179.787 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.535 ' CG2' ' HA ' ' A' ' 113' ' ' ALA . 0.6 OUTLIER -48.42 -41.15 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 N-CA-C 112.562 0.579 . . . . 0.0 112.562 -178.74 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.567 ' CD2' HD22 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -93.36 -17.06 23.98 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.414 -0.515 . . . . 0.0 110.674 179.875 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.455 ' HB2' ' HA ' ' A' ' 58' ' ' THR . 1.8 m -66.57 -63.21 1.12 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.702 178.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . 0.519 ' CE1' HD11 ' A' ' 117' ' ' LEU . 4.7 p-80 -64.19 -43.34 95.38 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 121.159 0.504 . . . . 0.0 109.674 179.572 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.666 HG21 ' HB3' ' A' ' 116' ' ' LEU . 4.8 t -54.77 -60.03 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.555 178.35 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.532 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 40.45 26.06 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 115.374 -0.83 . . . . 0.0 113.152 178.673 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.532 ' CB ' ' O ' ' A' ' 64' ' ' ALA . 7.3 t30 149.92 -68.89 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 122.788 0.435 . . . . 0.0 110.848 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.656 HG12 HG13 ' A' ' 63' ' ' VAL . 23.4 m 45.24 -162.5 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.664 ' HB ' ' HB3' ' A' ' 97' ' ' ASN . 10.7 m -142.16 77.05 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.099 0 CA-C-O 121.012 0.434 . . . . 0.0 110.432 -178.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.684 ' HB2' ' HB2' ' A' ' 98' ' ' SER . 0.2 OUTLIER -70.93 80.73 0.65 Allowed 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.971 -179.026 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 69.0 p -48.11 166.61 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 178.363 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -39.81 -35.02 0.3 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.043 0.449 . . . . 0.0 111.753 -179.491 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.431 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 3.2 tp10 -64.19 -48.2 76.85 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.189 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.546 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 81.0 m-20 -70.96 -52.13 21.64 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.447 179.612 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.654 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 89.9 m -45.68 -39.41 7.91 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.136 0.493 . . . . 0.0 110.207 178.69 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.468 ' HA ' ' HG ' ' A' ' 77' ' ' LEU . . . -73.65 -41.85 62.17 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 178.203 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.923 ' HB3' ' CG2' ' A' ' 115' ' ' VAL . 0.1 OUTLIER -50.29 -44.97 54.14 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 113.684 -1.598 . . . . 0.0 108.636 176.971 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.467 HD11 ' HA ' ' A' ' 73' ' ' THR . 2.1 mp -64.24 -54.14 38.13 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.561 178.282 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.654 ' HG ' ' O ' ' A' ' 73' ' ' THR . 5.1 mt -49.18 -39.87 31.05 Favored 'General case' 0 C--N 1.34 0.192 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 179.273 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 16.1 mt-30 -59.96 -53.33 59.1 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.75 178.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' SER . . . . . 0.518 ' CB ' ' HG3' ' A' ' 111' ' ' GLN . 0.0 OUTLIER -49.26 -49.25 44.24 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.297 179.337 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.454 ' OG1' ' CE1' ' A' ' 88' ' ' TYR . 0.2 OUTLIER -73.85 -59.54 2.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.808 -179.144 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 9.0 p -51.28 -23.06 2.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.794 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -43.25 -42.29 4.27 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.469 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.42 ' CE1' ' OD1' ' A' ' 84' ' ' ASN . 1.9 t60 -117.9 -91.48 0.55 Allowed 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.031 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.42 ' OD1' ' CE1' ' A' ' 83' ' ' HIS . 43.0 p-10 178.05 93.2 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 120.801 0.334 . . . . 0.0 110.947 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -179.05 -170.35 0.18 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.874 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -147.98 69.3 1.12 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.017 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . 0.457 ' O ' ' HB2' ' A' ' 104' ' ' ARG . 5.6 p-10 -79.24 -45.08 20.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.565 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.594 ' HA ' ' CB ' ' A' ' 102' ' ' SER . 0.3 OUTLIER -80.64 132.57 35.62 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-O 121.216 0.531 . . . . 0.0 112.053 -179.474 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.792 ' O ' ' O ' ' A' ' 101' ' ' VAL . 0.5 OUTLIER -105.96 125.83 51.46 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 104.891 -2.263 . . . . 0.0 104.891 176.611 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.501 HD21 HD21 ' A' ' 100' ' ' LEU . 3.1 mt -122.17 134.49 54.72 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 115.45 1.648 . . . . 0.0 115.45 -174.276 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.8 ttt-85 -129.04 104.49 7.6 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 104.628 -2.36 . . . . 0.0 104.628 175.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.451 ' CB ' ' HB3' ' A' ' 98' ' ' SER . 2.7 m -104.21 165.35 11.11 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 115.842 1.793 . . . . 0.0 115.842 -174.119 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.702 ' C ' ' O ' ' A' ' 97' ' ' ASN . 0.2 OUTLIER -126.68 27.29 2.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 111.733 -2.485 . . . . 0.0 107.023 178.23 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.539 ' O ' ' N ' ' A' ' 96' ' ' GLY . . . -2.48 -59.02 0.0 OUTLIER Glycine 0 CA--C 1.509 -0.29 0 CA-C-N 112.027 -2.352 . . . . 0.0 115.615 -177.68 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . 0.475 ' N ' ' O ' ' A' ' 93' ' ' VAL . 1.9 m120 -62.99 61.88 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.781 0.324 . . . . 0.0 111.271 -179.005 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.539 ' N ' ' O ' ' A' ' 94' ' ' GLY . . . 119.46 -23.9 8.3 Favored Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.585 -0.817 . . . . 0.0 114.625 178.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.702 ' O ' ' C ' ' A' ' 93' ' ' VAL . 0.2 OUTLIER -165.36 168.75 16.5 Favored 'General case' 0 C--O 1.216 -0.704 0 CA-C-N 118.876 1.338 . . . . 0.0 112.34 -178.329 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.684 ' HB2' ' HB2' ' A' ' 68' ' ' LEU . 3.9 m -155.25 142.34 19.25 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.239 178.714 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 84.1 t -104.12 133.45 48.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.835 -177.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.708 ' CD1' ' HB3' ' A' ' 102' ' ' SER . 3.3 tm? -104.42 120.9 42.29 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 113.848 1.055 . . . . 0.0 113.848 -178.205 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.792 ' O ' ' O ' ' A' ' 89' ' ' ASP . 1.5 p -124.07 103.91 13.29 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 N-CA-C 103.686 -2.709 . . . . 0.0 103.686 174.299 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.708 ' HB3' ' CD1' ' A' ' 100' ' ' LEU . 1.2 t -144.2 165.58 27.44 Favored 'General case' 0 CA--C 1.492 -1.255 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -173.934 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.567 HD22 ' CD2' ' A' ' 60' ' ' LEU . 0.0 OUTLIER 161.86 -81.71 0.0 OUTLIER 'General case' 0 N--CA 1.428 -1.549 0 CA-C-N 112.669 -2.059 . . . . 0.0 110.744 175.78 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.574 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 46.66 31.46 1.4 Allowed 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.341 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.574 ' CB ' ' O ' ' A' ' 104' ' ' ARG . 58.3 m 129.68 164.82 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.597 1.159 . . . . 0.0 108.453 -178.219 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.538 ' HB3' ' HB2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -104.96 102.19 11.72 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -177.737 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.772 ' HB2' ' O ' ' A' ' 41' ' ' GLY . 2.1 mt-30 -169.43 162.59 10.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.84 177.26 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.423 ' HB2' ' CA ' ' A' ' 56' ' ' ALA . 1.2 tpt -164.76 147.34 8.47 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.363 -0.535 . . . . 0.0 112.002 178.495 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.436 HG21 ' CD1' ' A' ' 39' ' ' PHE . 0.3 OUTLIER -109.25 164.84 12.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.348 179.474 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.42 ' HB3' ' CG2' ' A' ' 16' ' ' VAL . 1.0 OUTLIER -50.44 -53.9 26.1 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.199 0.523 . . . . 0.0 110.17 179.316 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.799 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 1.9 tp-100 -51.22 -65.94 0.47 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.281 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.626 ' O ' HG12 ' A' ' 115' ' ' VAL . 1.2 t0 -50.14 -47.48 54.19 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-O 121.542 0.687 . . . . 0.0 110.782 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.535 ' HA ' ' CG2' ' A' ' 59' ' ' VAL . . . -53.47 -50.16 65.93 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.86 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.818 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -70.67 -33.58 71.09 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.797 -178.648 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.923 ' CG2' ' HB3' ' A' ' 75' ' ' LYS . 4.0 p -62.45 -52.18 63.08 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.104 0 C-N-CA 119.082 -1.047 . . . . 0.0 110.229 179.524 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.666 ' HB3' HG21 ' A' ' 63' ' ' VAL . 3.1 mp -64.2 -39.77 94.69 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-N 114.44 -1.255 . . . . 0.0 110.182 -178.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.548 ' CD2' ' HA ' ' A' ' 5' ' ' LEU . 0.1 OUTLIER -74.26 -16.67 60.94 Favored 'General case' 0 CA--C 1.511 -0.52 0 C-N-CA 120.369 -0.532 . . . . 0.0 111.161 178.99 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.703 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 0.0 OUTLIER -72.17 -47.96 46.94 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 106.152 -1.795 . . . . 0.0 106.152 176.77 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -72.46 -28.19 62.77 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.846 177.102 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.561 ' HA ' ' CG1' ' A' ' 66' ' ' VAL . . . -68.89 -62.35 1.42 Allowed 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.948 179.571 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.642 ' O ' ' N ' ' A' ' 126' ' ' GLY . 0.1 OUTLIER -60.47 -37.57 81.44 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.718 -179.502 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.703 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.1 OUTLIER -70.17 -34.46 73.02 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -179.836 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.4 ' N ' ' HG2' ' A' ' 122' ' ' ARG . 0.0 OUTLIER -90.95 -26.63 19.17 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.554 0.575 . . . . 0.0 112.554 -178.542 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -95.68 -66.26 0.92 Allowed 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 -178.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -95.85 -65.5 0.97 Allowed 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -178.081 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . 0.642 ' N ' ' O ' ' A' ' 121' ' ' LEU . . . 86.62 75.84 1.26 Allowed Glycine 0 N--CA 1.448 -0.534 0 N-CA-C 111.076 -0.81 . . . . 0.0 111.076 -178.702 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.432 ' CB ' ' O ' ' A' ' 126' ' ' GLY . . . 84.42 -33.57 0.06 Allowed 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 -177.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 166.34 108.98 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.625 178.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . -153.49 23.4 0.75 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.623 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 26.0 p . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.926 179.969 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.132 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -152.69 121.02 6.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.791 0.329 . . . . 0.0 110.93 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -151.97 131.38 12.93 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.906 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 204' ' ' PTR . . . . . 0.595 ' HD2' ' N ' ' B' ' 204' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -86.76 53.47 2.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.952 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 206' ' ' ASP . . . . . . . . . . . . . 11.3 p30 175.65 97.72 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.93 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -45.04 168.78 0.03 OUTLIER 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 122.832 2.355 . . . . 0.0 112.431 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 208' ' ' PHE . . . . . 0.459 ' CZ ' ' HA ' ' A' ' 11' ' ' GLN . 88.6 m-85 62.0 159.59 0.06 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.839 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.465 -0.334 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.431 0 CA-C-O 120.791 0.329 . . . . 0.0 111.112 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 5.4 p30 47.29 -166.81 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.137 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.613 HD11 ' HB2' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -95.48 -94.98 0.18 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.383 179.048 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.422 ' OG ' ' N ' ' A' ' 5' ' ' LEU . 40.6 t -141.96 -168.74 2.76 Favored 'General case' 0 C--N 1.335 -0.062 0 CA-C-O 120.742 0.306 . . . . 0.0 110.592 179.459 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.511 ' O ' HD23 ' A' ' 117' ' ' LEU . 0.8 OUTLIER -95.51 -66.18 0.93 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.457 0.646 . . . . 0.0 111.397 -179.914 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.401 ' OG ' ' HA3' ' A' ' 129' ' ' GLY . 0.9 OUTLIER -64.58 -37.55 87.95 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.492 -178.698 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . 0.508 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 0.5 OUTLIER -66.12 -52.25 50.3 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 178.469 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.613 ' HB2' HD11 ' A' ' 3' ' ' LEU . 42.5 tp -49.24 -54.22 17.82 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.113 178.328 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.438 ' O ' ' CB ' ' A' ' 13' ' ' SER . 42.7 t-80 -53.45 -41.44 66.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.883 178.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.508 ' HB2' ' O ' ' A' ' 7' ' ' ASP . 3.1 mmt85 -56.47 -57.76 10.93 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.691 -179.506 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.49 ' HA ' ' CE1' ' B' ' 208' ' ' PHE . 0.6 OUTLIER -64.81 -49.95 68.65 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 120.444 -0.502 . . . . 0.0 111.624 -179.313 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.524 HG11 ' CB ' ' A' ' 114' ' ' LYS . 9.8 p -60.08 -47.9 90.06 Favored 'Isoleucine or valine' 0 C--O 1.24 0.578 0 CA-C-O 121.119 0.485 . . . . 0.0 110.803 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.644 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 53.0 m -63.59 -49.35 73.7 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.28 179.305 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.42 ' O ' ' CG ' ' A' ' 18' ' ' GLN . 13.3 mtp180 -61.76 -23.5 66.21 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.414 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.411 ' HB2' ' O ' ' A' ' 12' ' ' VAL . 8.7 mt -72.61 -61.89 1.64 Allowed 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 121.009 0.433 . . . . 0.0 110.656 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.577 ' CG2' ' HB3' ' A' ' 110' ' ' LEU . 23.1 t -70.24 -30.92 45.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.242 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.437 ' CG ' ' O ' ' A' ' 13' ' ' SER . 0.4 OUTLIER -71.71 -19.09 62.1 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.132 -179.51 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.42 ' CG ' ' O ' ' A' ' 14' ' ' ARG . 1.8 pt20 -155.63 50.4 0.55 Allowed 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.697 178.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -178.75 -66.5 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.814 0.34 . . . . 0.0 111.885 179.511 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.429 ' HB2' ' HA ' ' A' ' 16' ' ' VAL . 1.8 m -77.27 -81.37 0.09 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.536 -178.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.529 ' H ' ' HA ' ' A' ' 16' ' ' VAL . . . 124.55 -45.25 1.19 Allowed Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 121.081 -0.581 . . . . 0.0 111.802 -179.591 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 179.94 32.08 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.101 0.477 . . . . 0.0 110.141 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.401 ' HB3' ' O ' ' A' ' 34' ' ' ASN . 21.4 m -80.36 -163.3 0.54 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.202 -179.586 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.596 HG22 ' CD2' ' A' ' 39' ' ' PHE . 20.5 m -104.56 142.34 34.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.946 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -105.3 139.91 14.86 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.437 -0.887 . . . . 0.0 113.49 -178.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.579 ' HB2' ' CB ' ' A' ' 51' ' ' SER . 0.0 OUTLIER -110.59 135.38 51.32 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 179.193 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.483 ' O ' ' HD3' ' A' ' 28' ' ' ARG . 4.4 tt -104.89 160.58 14.9 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -178.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.483 ' HD3' ' O ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER 158.75 55.31 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.202 -179.947 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.445 ' O ' HD23 ' A' ' 3' ' ' LEU . . . 76.7 2.74 77.18 Favored Glycine 0 C--N 1.334 0.426 0 N-CA-C 110.632 -0.987 . . . . 0.0 110.632 -177.561 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.448 ' C ' ' ND2' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -166.18 165.47 17.58 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 -179.845 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.447 HG11 ' CG ' ' A' ' 11' ' ' GLN . 1.7 p -116.35 128.92 73.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 121.4 0.619 . . . . 0.0 111.205 178.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.423 ' CB ' ' HG3' ' A' ' 26' ' ' LYS . . . -115.56 165.68 12.75 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.076 -0.965 . . . . 0.0 110.416 179.759 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.463 ' HA ' ' CD1' ' A' ' 110' ' ' LEU . . . -104.0 137.99 41.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.199 0.524 . . . . 0.0 111.855 -179.327 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.495 ' ND2' ' HB ' ' A' ' 24' ' ' THR . 2.9 t30 -122.27 113.81 19.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.319 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.86 -23.53 10.52 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.258 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -50.92 -45.02 60.29 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.891 0.377 . . . . 0.0 110.742 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.441 HG23 ' CE1' ' A' ' 39' ' ' PHE . 10.2 t -128.2 -158.12 0.86 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.259 179.404 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 26.0 p -155.11 100.93 2.21 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.953 0.406 . . . . 0.0 111.036 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.596 ' CD2' HG22 ' A' ' 24' ' ' THR . 10.9 m-85 -86.26 131.85 34.13 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.682 0.754 . . . . 0.0 111.911 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.619 ' H ' ' NE2' ' A' ' 107' ' ' GLN . 0.1 OUTLIER -160.03 81.88 0.71 Allowed 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.519 -1.218 . . . . 0.0 109.811 179.728 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 69.32 101.34 0.04 OUTLIER Glycine 0 CA--C 1.525 0.662 0 CA-C-N 115.954 -0.566 . . . . 0.0 113.179 -179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.717 ' HB2' ' NE2' ' A' ' 107' ' ' GLN . 0.0 OUTLIER -159.71 -144.34 0.11 Allowed 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 110.256 -0.275 . . . . 0.0 110.256 179.096 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -162.19 21.95 0.1 Allowed 'General case' 0 CA--C 1.529 0.145 0 O-C-N 121.832 -0.543 . . . . 0.0 112.088 -179.515 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.472 ' HA ' ' HB1' ' A' ' 48' ' ' ALA . 1.8 mp 66.44 4.45 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 179.512 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.62 -57.15 3.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.902 0.382 . . . . 0.0 111.184 -179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.0 p -61.63 -59.6 4.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.989 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -179.78 76.81 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.327 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.497 ' HA ' ' CE1' ' A' ' 39' ' ' PHE . . . -138.4 -158.61 0.87 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.552 0.215 . . . . 0.0 111.151 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.415 ' O ' ' OE2' ' A' ' 52' ' ' GLU . 9.6 mtm180 -140.5 -174.54 3.99 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 120.874 0.369 . . . . 0.0 111.253 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.496 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 21.7 tt0 -85.29 -30.83 23.44 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.979 0.418 . . . . 0.0 111.212 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.579 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 0.3 OUTLIER -59.14 -65.31 0.69 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.842 -179.999 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.479 ' HB3' ' CD2' ' A' ' 39' ' ' PHE . 0.1 OUTLIER -35.59 -65.38 0.25 Allowed 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.662 179.947 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.496 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -51.08 -52.31 44.75 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.522 179.822 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 94.6 t -55.91 -35.35 40.18 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 CA-C-O 121.007 0.432 . . . . 0.0 109.941 179.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.415 ' CE1' ' HB3' ' A' ' 113' ' ' ALA . 0.2 OUTLIER -70.86 -45.23 64.81 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.409 179.299 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.77 -46.93 87.44 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.39 179.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 -62.82 -44.04 97.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.648 179.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 16.7 p -64.53 -56.54 13.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.933 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.418 ' CG2' ' HB2' ' A' ' 116' ' ' LEU . 12.3 p -60.4 -44.18 95.55 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.59 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.7 tp -55.96 -42.77 76.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.903 0.383 . . . . 0.0 110.226 179.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 62.7 m -61.83 -58.77 6.68 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.832 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 10.8 m-70 -55.16 -32.74 62.38 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.136 0.493 . . . . 0.0 110.312 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.553 HG13 HG13 ' A' ' 66' ' ' VAL . 3.6 t -100.26 59.2 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.282 179.393 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.492 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . -83.4 34.67 0.48 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.61 -179.509 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.492 ' CB ' ' O ' ' A' ' 64' ' ' ALA . 7.4 t-20 153.82 -61.78 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 122.855 0.462 . . . . 0.0 110.379 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.553 HG13 HG13 ' A' ' 63' ' ' VAL . 18.8 m 40.77 -163.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.525 ' CG2' ' HB2' ' A' ' 123' ' ' GLN . 29.3 m -148.44 75.23 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.437 -1.112 0 CA-C-O 120.939 0.399 . . . . 0.0 111.131 -178.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.556 ' CA ' ' HB2' ' A' ' 72' ' ' ASP . 0.3 OUTLIER -65.0 98.73 0.31 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.874 -179.849 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.795 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 1.4 p -66.92 -172.3 0.18 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.61 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.72 -34.62 12.41 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 120.97 0.414 . . . . 0.0 110.702 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.571 ' O ' ' HE2' ' A' ' 75' ' ' LYS . 0.1 OUTLIER -72.28 -65.72 0.74 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.41 179.776 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.652 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 0.6 OUTLIER -52.84 -33.98 51.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.45 179.583 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 11.7 p -62.55 -55.87 23.25 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 178.02 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.67 -24.39 61.15 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 108.609 -0.885 . . . . 0.0 108.609 177.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.652 ' HB2' ' HA ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -62.52 -65.2 0.72 Allowed 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.733 -1.122 . . . . 0.0 109.981 178.716 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.416 ' CB ' HD21 ' A' ' 90' ' ' LEU . 4.3 mp -50.73 -39.94 53.09 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 178.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.86 -64.17 0.92 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.706 178.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -58.52 -52.39 65.84 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.832 -179.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' SER . . . . . 0.458 ' CB ' ' HG2' ' A' ' 111' ' ' GLN . 1.3 t -53.83 -27.65 30.96 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.485 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.458 ' CG2' ' HA ' ' A' ' 85' ' ' LEU . 89.0 m -93.45 -61.82 1.49 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.321 -179.326 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 34.0 m -51.62 -23.83 3.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.829 -179.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -44.57 -60.86 1.78 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.723 0.297 . . . . 0.0 111.313 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -119.37 -78.41 0.59 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.879 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -98.42 134.9 40.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.689 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.458 ' HA ' ' CG2' ' A' ' 80' ' ' THR . 0.6 OUTLIER -121.4 78.48 1.43 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.182 -179.786 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.2 p30 176.97 39.61 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.426 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . 0.495 ' C ' ' OD1' ' A' ' 87' ' ' ASN . 0.1 OUTLIER -129.48 -44.41 1.24 Allowed 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 120.986 -0.286 . . . . 0.0 111.187 179.636 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.496 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 5.0 m-85 -92.4 138.43 31.52 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 120.257 -0.577 . . . . 0.0 111.026 -179.623 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.701 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 1.2 t0 -120.23 148.01 44.22 Favored 'General case' 0 N--CA 1.436 -1.129 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -179.129 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.5 ' N ' ' CD1' ' A' ' 90' ' ' LEU . 0.0 OUTLIER -147.72 165.44 30.49 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -177.966 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.594 ' O ' ' CB ' ' A' ' 98' ' ' SER . 10.9 ttm105 -137.4 158.72 43.8 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 114.414 -1.266 . . . . 0.0 108.869 178.705 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.467 ' O ' ' CG1' ' A' ' 93' ' ' VAL . 56.8 p -104.42 159.35 15.8 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.714 0.769 . . . . 0.0 112.567 -179.013 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.566 ' O ' ' O ' ' A' ' 97' ' ' ASN . 0.0 OUTLIER 162.3 149.36 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 CA-C-N 113.931 -1.486 . . . . 0.0 108.17 -179.057 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.404 ' HA3' ' OD1' ' A' ' 97' ' ' ASN . . . 100.38 27.25 7.76 Favored Glycine 0 C--N 1.296 -1.687 0 C-N-CA 120.01 -1.09 . . . . 0.0 113.311 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 15.1 t30 51.47 22.41 1.49 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.161 0.505 . . . . 0.0 109.646 -178.65 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.459 ' O ' ' HA ' ' A' ' 69' ' ' THR . . . 149.6 2.95 0.29 Allowed Glycine 0 N--CA 1.443 -0.861 0 CA-C-N 115.698 -0.683 . . . . 0.0 113.111 -179.357 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.795 ' HA ' ' HA ' ' A' ' 69' ' ' THR . 0.6 OUTLIER -104.61 166.94 10.06 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 118.16 0.98 . . . . 0.0 109.959 179.364 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.594 ' CB ' ' O ' ' A' ' 91' ' ' ARG . 0.2 OUTLIER -140.79 164.53 29.97 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.493 0.663 . . . . 0.0 110.878 179.663 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.464 ' HA ' ' O ' ' A' ' 65' ' ' ASN . 0.5 OUTLIER -104.2 145.61 12.73 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.328 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.539 HD21 ' HG ' ' A' ' 116' ' ' LEU . 0.3 OUTLIER -103.55 104.88 15.0 Favored 'General case' 0 CA--C 1.507 -0.695 0 C-N-CA 119.431 -0.908 . . . . 0.0 112.557 -179.131 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.701 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 1.3 p -116.35 103.24 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.186 0 N-CA-C 103.256 -2.868 . . . . 0.0 103.256 173.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.506 ' O ' HD22 ' A' ' 103' ' ' LEU . 0.1 OUTLIER -144.85 163.6 33.59 Favored 'General case' 0 C--N 1.303 -1.452 0 C-N-CA 119.131 -1.028 . . . . 0.0 112.597 -174.613 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.506 HD22 ' O ' ' A' ' 102' ' ' SER . 0.1 OUTLIER 159.45 -82.3 0.0 OUTLIER 'General case' 0 N--CA 1.435 -1.197 0 CA-C-N 113.801 -1.545 . . . . 0.0 111.39 176.967 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.569 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 46.28 32.98 1.65 Allowed 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.999 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.624 ' HB3' ' N ' ' A' ' 42' ' ' LEU . 52.7 m 129.55 162.96 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.674 1.19 . . . . 0.0 108.104 -178.021 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -104.84 102.11 11.67 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 119.838 -0.745 . . . . 0.0 112.394 -178.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.717 ' NE2' ' HB2' ' A' ' 42' ' ' LEU . 1.3 mt-30 -168.29 127.98 1.24 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.397 177.698 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -130.85 143.29 50.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.353 0.597 . . . . 0.0 112.324 -179.575 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.519 ' HA ' HG23 ' A' ' 24' ' ' THR . 0.3 OUTLIER -104.55 165.12 11.27 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.432 179.378 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.577 ' HB3' ' CG2' ' A' ' 16' ' ' VAL . 0.3 OUTLIER -53.75 -59.53 4.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.779 0.323 . . . . 0.0 110.673 179.983 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.57 ' O ' ' HD2' ' A' ' 114' ' ' LYS . 1.2 tp60 -49.26 -59.57 3.57 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 121.1 0.476 . . . . 0.0 110.986 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.482 ' O ' ' HB ' ' A' ' 115' ' ' VAL . 1.3 m-20 -50.68 -47.47 58.86 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.139 0.495 . . . . 0.0 110.59 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.419 ' O ' HD12 ' A' ' 117' ' ' LEU . . . -49.94 -60.04 3.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.692 179.426 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.644 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -66.13 -21.5 66.34 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.153 179.87 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.561 ' CG2' ' CG ' ' A' ' 75' ' ' LYS . 46.0 t -62.62 -61.64 1.55 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.82 0 CA-C-O 121.876 0.846 . . . . 0.0 109.839 179.521 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.539 ' HG ' HD21 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -63.99 -39.8 94.94 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 114.8 -1.091 . . . . 0.0 109.879 179.837 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.661 ' HA ' ' HB1' ' A' ' 120' ' ' ALA . 0.2 OUTLIER -71.06 -18.63 62.55 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.946 179.86 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.543 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 2.7 tt0 -71.99 -54.09 10.98 Favored 'General case' 0 N--CA 1.441 -0.923 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 176.815 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -71.33 -22.56 61.91 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 114.679 -1.146 . . . . 0.0 111.028 177.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.661 ' HB1' ' HA ' ' A' ' 117' ' ' LEU . . . -76.01 -54.42 6.89 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.214 179.754 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.513 HD22 ' HA ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -63.71 -27.94 69.56 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.83 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.543 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -73.18 -43.7 61.01 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.917 -0.583 . . . . 0.0 112.064 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.525 ' HB2' ' CG2' ' A' ' 67' ' ' VAL . 1.5 tt0 -95.11 -25.79 16.29 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 113.496 0.924 . . . . 0.0 113.496 -178.169 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . 0.402 ' CG ' ' O ' ' A' ' 120' ' ' ALA . 2.5 mm-40 -85.24 -66.41 0.9 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 -177.551 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.4 ' HB2' ' CB ' ' A' ' 128' ' ' ARG . 4.7 p -96.08 -48.3 5.73 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.989 0.423 . . . . 0.0 112.079 -178.652 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . 0.456 ' N ' ' O ' ' A' ' 121' ' ' LEU . . . 92.73 70.6 1.15 Allowed Glycine 0 CA--C 1.501 -0.825 0 N-CA-C 110.796 -0.922 . . . . 0.0 110.796 -178.221 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . 51.05 27.3 3.22 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 -177.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . 0.4 ' CB ' ' HB2' ' A' ' 125' ' ' SER . 0.0 OUTLIER -92.46 -73.88 0.54 Allowed 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.909 -1.042 . . . . 0.0 111.415 -178.347 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . 0.401 ' HA3' ' OG ' ' A' ' 6' ' ' SER . . . 77.33 19.03 77.33 Favored Glycine 0 C--N 1.332 0.31 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.648 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 18.5 t . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.867 -179.996 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.134 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -99.97 118.33 36.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.822 0.344 . . . . 0.0 110.985 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -176.72 151.28 0.89 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.874 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 204' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -45.82 -79.84 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.685 -179.45 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 206' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -112.68 148.77 40.0 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 120.796 0.331 . . . . 0.0 111.281 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . 0.459 ' CB ' ' NE2' ' A' ' 11' ' ' GLN . 1.9 Cg_endo -40.72 -74.6 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 123.573 2.848 . . . . 0.0 113.123 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 208' ' ' PHE . . . . . 0.49 ' CE1' ' HA ' ' A' ' 11' ' ' GLN . 7.8 m-85 -49.8 97.29 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.803 0.335 . . . . 0.0 111.112 -179.67 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.362 0 CA-C-N 116.529 -0.305 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 ptp . . . . . 0 N--CA 1.488 1.446 0 CA-C-O 120.869 0.366 . . . . 0.0 111.153 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 5.4 p-10 -145.46 -163.5 1.73 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.776 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.662 ' CD2' ' O ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER -138.57 103.11 4.78 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 121.221 0.534 . . . . 0.0 111.225 179.816 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.612 ' O ' ' O ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER 40.15 175.1 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.707 0.765 . . . . 0.0 112.853 179.679 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.441 HD23 ' CB ' ' A' ' 121' ' ' LEU . 0.3 OUTLIER -95.93 -65.84 0.95 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.718 179.308 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.41 ' HB3' ' HA ' ' A' ' 128' ' ' ARG . 1.0 OUTLIER -60.18 -33.05 71.67 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.677 -1.147 . . . . 0.0 111.706 -179.113 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -65.48 -50.49 65.13 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 178.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.509 ' O ' ' HG2' ' A' ' 11' ' ' GLN . 22.3 tp -55.32 -44.58 75.95 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.887 179.252 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.49 ' HB2' ' HB3' ' A' ' 117' ' ' LEU . 79.9 t60 -64.82 -41.32 95.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.557 0.694 . . . . 0.0 110.0 179.238 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.465 ' HB3' ' CE1' ' B' ' 208' ' ' PHE . 1.5 mtt180 -57.91 -50.13 74.38 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.996 -179.34 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.671 ' HG3' ' CG1' ' A' ' 31' ' ' VAL . 1.4 pt20 -66.63 -56.67 9.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.487 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.482 ' HA ' ' CD1' ' A' ' 15' ' ' LEU . 10.8 p -53.74 -48.32 61.17 Favored 'Isoleucine or valine' 0 C--O 1.242 0.704 0 CA-C-O 121.322 0.582 . . . . 0.0 111.142 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.665 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 62.7 m -62.52 -40.46 96.84 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.256 -179.798 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.442 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 1.2 tpm_? -64.69 -30.89 71.92 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.979 0.418 . . . . 0.0 110.095 -179.797 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.534 ' O ' ' N ' ' A' ' 19' ' ' GLU . 4.6 mt -71.33 -65.08 0.8 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.844 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.686 ' CG2' ' HB3' ' A' ' 110' ' ' LEU . 50.2 t -58.77 -45.95 91.02 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.403 0 C-N-CA 120.556 -0.458 . . . . 0.0 111.434 -179.003 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.45 ' CG ' ' O ' ' A' ' 13' ' ' SER . 6.1 mm-40 -62.7 -12.69 25.29 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.604 -178.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.457 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 3.6 pt20 -170.59 60.18 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.163 0 CA-C-O 120.786 0.326 . . . . 0.0 111.56 178.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.534 ' N ' ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER 177.79 -58.72 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 179.817 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.1 m -87.93 -79.63 0.29 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.853 0.359 . . . . 0.0 111.748 -178.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.414 ' O ' ' CB ' ' A' ' 22' ' ' ASP . . . 107.64 54.11 0.65 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.726 -179.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.414 ' CB ' ' O ' ' A' ' 21' ' ' GLY . 0.0 OUTLIER 83.2 0.43 1.13 Allowed 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 179.338 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -60.73 -167.03 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 110.37 -0.233 . . . . 0.0 110.37 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 12.7 m -104.47 138.31 41.05 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.52 ' CA ' ' HG ' ' A' ' 110' ' ' LEU . . . -114.57 156.24 15.79 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.209 -0.996 . . . . 0.0 113.236 -179.067 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.579 ' HD2' ' HG2' ' A' ' 28' ' ' ARG . 0.0 OUTLIER -114.73 151.04 34.35 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.35 -0.241 . . . . 0.0 110.35 179.407 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.46 ' HB2' ' CG ' ' A' ' 55' ' ' PHE . 5.9 tt -130.18 106.93 8.93 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.141 0.496 . . . . 0.0 112.037 -179.588 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.579 ' HG2' ' HD2' ' A' ' 26' ' ' LYS . 0.2 OUTLIER -134.33 52.28 2.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.584 -0.734 . . . . 0.0 109.253 178.457 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 83.79 4.22 88.94 Favored Glycine 0 C--N 1.332 0.358 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 -176.774 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.463 ' C ' ' ND2' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -166.07 166.7 17.0 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 106.701 -1.592 . . . . 0.0 106.701 -179.512 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.671 ' CG1' ' HG3' ' A' ' 11' ' ' GLN . 11.3 p -113.54 137.96 44.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 C-N-CA 120.003 -0.679 . . . . 0.0 112.281 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.473 ' HB1' ' HE3' ' A' ' 26' ' ' LYS . . . -126.74 164.88 20.35 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.654 178.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -104.51 148.19 26.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.139 0.495 . . . . 0.0 111.623 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 42.2 t30 -135.97 117.52 14.85 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.301 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.14 3.33 9.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.4 -179.774 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -61.46 -53.08 61.14 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.951 0.405 . . . . 0.0 110.537 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.424 ' O ' ' CB ' ' A' ' 38' ' ' THR . 0.0 OUTLIER -128.04 -89.37 0.53 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.193 179.626 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.586 ' O ' ' HB3' ' A' ' 39' ' ' PHE . 0.1 OUTLIER 166.01 -105.45 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 110.259 -0.275 . . . . 0.0 110.259 179.457 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.586 ' HB3' ' O ' ' A' ' 38' ' ' THR . 0.1 OUTLIER 169.25 -164.46 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 179.63 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.563 ' HB3' ' O ' ' A' ' 39' ' ' PHE . 0.1 OUTLIER 150.86 55.44 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.371 0.669 . . . . 0.0 110.441 179.833 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.549 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . 67.1 -65.39 0.21 Allowed Glycine 0 CA--C 1.523 0.578 0 C-N-CA 120.995 -0.621 . . . . 0.0 112.616 -179.379 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.808 ' O ' ' HB3' ' A' ' 105' ' ' SER . 0.4 OUTLIER 24.28 -138.83 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.203 0.601 . . . . 0.0 112.58 179.444 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -172.64 22.43 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 O-C-N 121.849 -0.532 . . . . 0.0 112.065 -179.934 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.521 ' CD1' ' N ' ' A' ' 44' ' ' ILE . 1.3 mp 63.37 2.42 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 120.822 0.344 . . . . 0.0 111.687 179.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.93 -22.15 25.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.839 0.352 . . . . 0.0 111.003 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -101.8 -30.91 11.01 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.397 -179.705 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 177.94 -30.03 0.07 OUTLIER Glycine 0 CA--C 1.519 0.342 0 C-N-CA 120.169 -1.015 . . . . 0.0 113.556 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.462 ' HB1' HD22 ' A' ' 42' ' ' LEU . . . -48.32 173.46 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 117.1 0.45 . . . . 0.0 111.488 -179.584 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.417 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 23.0 mtp85 -121.89 173.24 7.63 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.527 -179.592 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.569 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 0.8 OUTLIER -66.81 -29.97 70.05 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.115 0.483 . . . . 0.0 110.54 179.762 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.654 ' O ' HG21 ' A' ' 54' ' ' VAL . 0.3 OUTLIER -49.75 -65.18 0.61 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.461 179.548 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.468 ' HB2' ' HG2' ' A' ' 107' ' ' GLN . 0.2 OUTLIER -52.56 -62.21 1.79 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.264 -179.15 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.569 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -46.68 -59.14 3.22 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 -178.563 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.654 HG21 ' O ' ' A' ' 51' ' ' SER . 15.9 m -51.91 -47.36 41.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.46 0 CA-C-O 120.887 0.375 . . . . 0.0 110.732 -179.783 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.46 ' CG ' ' HB2' ' A' ' 27' ' ' LEU . 0.1 OUTLIER -57.29 -46.68 82.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.553 179.156 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.407 ' CB ' ' HB2' ' A' ' 108' ' ' MET . . . -54.69 -50.99 66.94 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-O 120.85 0.357 . . . . 0.0 110.681 179.52 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -57.92 -40.24 79.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.4 179.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.45 HG22 ' CD2' ' A' ' 62' ' ' HIS . 0.9 OUTLIER -67.28 -63.98 0.95 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.978 179.791 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.531 ' CG2' ' HB2' ' A' ' 116' ' ' LEU . 14.4 p -53.36 -40.88 42.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.793 0.33 . . . . 0.0 110.342 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.602 ' O ' HG21 ' A' ' 63' ' ' VAL . 0.5 OUTLIER -64.09 -38.8 92.37 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.758 179.464 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 61.3 m -72.69 -44.86 61.23 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.167 179.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . 0.45 ' CD2' HG22 ' A' ' 58' ' ' THR . 53.3 m-70 -51.72 -54.4 28.74 Favored 'General case' 0 CA--C 1.521 -0.163 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.126 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.602 HG21 ' O ' ' A' ' 60' ' ' LEU . 0.0 OUTLIER -54.11 -78.8 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.806 179.266 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.485 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 60.96 17.0 7.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.354 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.485 ' CB ' ' O ' ' A' ' 64' ' ' ALA . 0.6 OUTLIER 153.1 -68.22 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 122.765 0.426 . . . . 0.0 110.943 -179.831 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.498 ' CG1' ' HA ' ' A' ' 63' ' ' VAL . 23.1 m 49.01 -164.95 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.054 -179.473 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.732 ' HB ' ' HB3' ' A' ' 97' ' ' ASN . 15.8 m -152.26 50.26 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.169 0 CA-C-O 121.129 0.49 . . . . 0.0 110.842 -178.52 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.609 HD13 ' HB2' ' A' ' 100' ' ' LEU . 1.0 OUTLIER -43.33 103.93 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.343 -179.485 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 15.7 p -71.67 -164.82 0.13 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.773 178.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.1 -34.91 68.8 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.912 0.386 . . . . 0.0 110.808 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -70.69 -50.07 40.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.076 0.465 . . . . 0.0 110.434 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.606 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 66.7 m-20 -66.71 -36.25 82.05 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.641 179.774 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 38.8 m -65.87 -40.78 91.94 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.05 0.452 . . . . 0.0 109.812 178.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.13 -27.11 62.41 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 177.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.675 ' HB3' ' HB ' ' A' ' 115' ' ' VAL . 0.0 OUTLIER -57.1 -59.72 4.67 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 114.044 -1.434 . . . . 0.0 109.642 178.228 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.535 ' HG ' HG23 ' A' ' 115' ' ' VAL . 3.2 mp -61.65 -49.89 74.71 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 178.707 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -44.07 -58.45 2.82 Favored 'General case' 0 CA--C 1.523 -0.086 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.263 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -61.07 -44.42 97.4 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.401 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -62.1 -22.44 65.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.96 179.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -94.54 -40.07 10.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.278 -179.66 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 14.5 p -85.3 -6.02 10.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.936 -179.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.37 -72.82 0.08 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.808 0.337 . . . . 0.0 111.235 -179.756 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 10.1 t-80 -118.98 39.96 3.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.179 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 57.65 106.07 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.026 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 1.3 pp -177.08 97.07 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.787 179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -97.45 30.89 2.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.894 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 22.1 p-10 -66.04 -17.11 64.48 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.302 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.459 ' CD2' ' OG ' ' A' ' 102' ' ' SER . 24.8 m-85 -98.43 139.45 34.15 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 120.841 0.353 . . . . 0.0 110.376 179.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.686 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.4 OUTLIER -112.87 144.74 41.91 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 179.301 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.415 HD22 HD11 ' A' ' 68' ' ' LEU . 14.7 mt -137.62 132.46 33.05 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 114.618 1.34 . . . . 0.0 114.618 -176.399 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.526 ' HB3' ' HB ' ' A' ' 99' ' ' VAL . 4.1 ttp180 -104.78 165.48 11.04 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 105.291 -2.114 . . . . 0.0 105.291 175.137 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.524 ' HA ' ' HA ' ' A' ' 98' ' ' SER . 9.7 p -134.33 164.15 28.05 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 116.235 1.939 . . . . 0.0 116.235 -177.258 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.676 ' C ' ' O ' ' A' ' 97' ' ' ASN . 1.5 t -140.04 22.4 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.429 0 CA-C-N 111.5 -2.591 . . . . 0.0 107.142 178.148 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.473 ' N ' ' O ' ' A' ' 97' ' ' ASN . . . 69.14 -170.58 41.09 Favored Glycine 0 N--CA 1.439 -1.149 0 CA-C-N 113.265 -1.789 . . . . 0.0 116.26 -178.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -48.6 -36.68 16.22 Favored 'General case' 0 CA--C 1.506 -0.739 0 CA-C-N 113.896 -1.152 . . . . 0.0 108.846 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -62.62 -43.64 98.71 Favored Glycine 0 N--CA 1.431 -1.687 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 177.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.732 ' HB3' ' HB ' ' A' ' 67' ' ' VAL . 0.0 OUTLIER -165.27 168.64 16.77 Favored 'General case' 0 N--CA 1.433 -1.325 0 CA-C-O 121.842 0.83 . . . . 0.0 113.019 179.675 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.524 ' HA ' ' HA ' ' A' ' 92' ' ' SER . 1.6 m -152.92 149.91 28.72 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 114.434 -1.257 . . . . 0.0 107.758 178.699 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.526 ' HB ' ' HB3' ' A' ' 91' ' ' ARG . 38.9 t -104.07 156.1 5.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 C-N-CA 120.634 -0.427 . . . . 0.0 111.787 -177.259 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.609 ' HB2' HD13 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -109.2 128.14 54.8 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -177.899 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.686 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 17.7 t -141.3 104.31 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.929 0 N-CA-C 104.712 -2.329 . . . . 0.0 104.712 174.935 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.512 ' O ' ' CB ' ' A' ' 103' ' ' LEU . 0.1 OUTLIER -145.78 165.23 29.45 Favored 'General case' 0 C--N 1.311 -1.082 0 C-N-CA 118.495 -1.282 . . . . 0.0 113.788 -174.909 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.512 ' CB ' ' O ' ' A' ' 102' ' ' SER . 0.0 OUTLIER 154.51 -89.36 0.0 OUTLIER 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 113.456 -1.702 . . . . 0.0 111.358 176.896 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.533 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 59.07 21.33 9.26 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 -179.52 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.808 ' HB3' ' O ' ' A' ' 42' ' ' LEU . 5.4 m 140.92 173.26 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.432 1.093 . . . . 0.0 108.612 -178.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.81 102.22 11.78 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 119.986 -0.685 . . . . 0.0 112.545 -178.834 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.549 ' HB2' ' O ' ' A' ' 41' ' ' GLY . 0.0 OUTLIER -168.15 165.06 13.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.4 177.621 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.438 ' CE ' ' CG ' ' A' ' 55' ' ' PHE . 2.1 ttp -165.75 147.45 7.2 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.062 0.458 . . . . 0.0 111.916 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.465 HG21 ' CE1' ' A' ' 39' ' ' PHE . 0.6 OUTLIER -114.7 161.38 18.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.794 178.867 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.686 ' HB3' ' CG2' ' A' ' 16' ' ' VAL . 18.2 mt -50.35 -59.22 4.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.89 0.376 . . . . 0.0 110.61 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.469 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 14.6 tp60 -45.13 -64.63 0.67 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.935 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.865 ' O ' HG22 ' A' ' 115' ' ' VAL . 0.4 OUTLIER -51.31 -38.14 51.4 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-O 121.526 0.679 . . . . 0.0 110.405 179.516 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.421 ' HB3' ' HE1' ' A' ' 108' ' ' MET . . . -55.05 -52.36 63.44 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.116 179.672 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.665 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -79.63 -20.57 46.47 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.824 -178.866 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.865 HG22 ' O ' ' A' ' 112' ' ' ASP . 9.0 m -65.17 -50.63 72.94 Favored 'Isoleucine or valine' 0 C--O 1.244 0.767 0 CA-C-O 122.129 0.966 . . . . 0.0 109.243 179.173 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.531 ' HB2' ' CG2' ' A' ' 59' ' ' VAL . 7.5 mp -69.31 -45.67 68.98 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 114.298 -1.319 . . . . 0.0 109.548 178.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.49 ' HB3' ' HB2' ' A' ' 9' ' ' HIS . 0.1 OUTLIER -68.89 -15.2 63.43 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.805 179.328 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.635 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 8.6 tp10 -74.03 -51.74 14.91 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 106.295 -1.742 . . . . 0.0 106.295 177.101 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . 0.451 ' CB ' ' HG ' ' A' ' 68' ' ' LEU . . . -72.34 -28.8 63.27 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.572 177.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.468 ' HB1' ' O ' ' A' ' 116' ' ' LEU . . . -69.27 -55.16 11.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.98 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.602 ' O ' ' N ' ' A' ' 126' ' ' GLY . 0.0 OUTLIER -64.24 -48.93 73.92 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.262 -179.73 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.635 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -59.28 -39.88 84.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.906 -179.833 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.453 ' N ' ' HG2' ' A' ' 122' ' ' ARG . 12.0 tm0? -84.84 -34.04 22.74 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -178.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -96.48 -68.4 0.8 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -177.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.24 -66.4 0.9 Allowed 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -178.219 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . 0.602 ' N ' ' O ' ' A' ' 121' ' ' LEU . . . 96.7 -61.35 1.18 Allowed Glycine 0 N--CA 1.449 -0.438 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.882 -179.009 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -112.51 38.63 2.69 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.389 0.614 . . . . 0.0 109.776 178.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . 0.41 ' HA ' ' HB3' ' A' ' 6' ' ' SER . 0.0 OUTLIER 71.05 111.35 0.06 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.778 -179.431 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 50.2 23.67 6.09 Favored Glycine 0 CA--C 1.517 0.213 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.793 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 11.2 p . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.258 -0.877 . . . . 0.0 110.933 -179.998 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.122 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -111.86 -43.05 3.67 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.85 0.357 . . . . 0.0 110.895 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 60.76 -174.09 0.12 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.019 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 204' ' ' PTR . . . . . 0.539 ' HE2' ' CE ' ' A' ' 26' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 21.3 p30 -135.32 49.76 2.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.843 0.354 . . . . 0.0 110.935 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 206' ' ' ASP . . . . . 0.416 ' O ' ' N ' ' B' ' 208' ' ' PHE . 2.5 m-20 58.37 163.98 0.08 OUTLIER Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.65 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . 0.421 ' O ' ' N ' ' B' ' 209' ' ' NH2 . 34.8 Cg_endo -63.38 62.83 0.18 Allowed 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.777 2.318 . . . . 0.0 112.974 -179.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 208' ' ' PHE . . . . . 0.571 ' HB3' ' HB3' ' A' ' 11' ' ' GLN . 0.0 OUTLIER 44.23 18.17 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 121.023 0.44 . . . . 0.0 111.904 179.37 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 209' ' ' NH2 . . . . . 0.421 ' N ' ' O ' ' B' ' 207' ' ' PRO . . . . . . . . 0 C--N 1.329 -0.32 0 O-C-N 122.289 -0.257 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.417 ' O ' ' N ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.416 0 CA-C-O 120.681 0.277 . . . . 0.0 111.228 . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.407 ' HB3' HG21 ' A' ' 58' ' ' THR . 0.7 OUTLIER 41.46 -90.67 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.832 -179.991 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.459 ' CD1' ' HB2' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -159.69 -46.37 0.05 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.831 0.348 . . . . 0.0 110.983 -179.752 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 169.59 138.65 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.423 -179.855 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.586 HD13 ' CD2' ' A' ' 117' ' ' LEU . 0.0 OUTLIER -55.97 -65.46 0.6 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.739 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p -49.98 -42.8 49.72 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.092 0.405 . . . . 0.0 112.092 -179.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . 0.422 ' O ' ' NE2' ' A' ' 11' ' ' GLN . 1.4 m-20 -73.42 -60.51 2.21 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 121.116 0.484 . . . . 0.0 110.009 179.724 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.528 ' HB3' ' CD2' ' A' ' 117' ' ' LEU . 12.4 tp -47.0 -44.18 20.03 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.394 179.157 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.544 ' HB2' HD22 ' A' ' 117' ' ' LEU . 38.4 t-80 -65.26 -44.84 86.8 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.644 0.735 . . . . 0.0 109.35 178.477 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.453 ' HB3' ' CZ ' ' B' ' 208' ' ' PHE . 12.8 mmt85 -54.78 -54.67 39.08 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.772 -1.104 . . . . 0.0 111.584 -179.383 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.422 ' NE2' ' O ' ' A' ' 7' ' ' ASP . 0.0 OUTLIER -65.95 -48.14 72.32 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 120.951 -0.3 . . . . 0.0 111.757 -179.274 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.465 HG13 ' O ' ' A' ' 8' ' ' LEU . 9.6 p -63.52 -49.6 81.89 Favored 'Isoleucine or valine' 0 C--O 1.243 0.725 0 CA-C-O 121.056 0.455 . . . . 0.0 111.266 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.626 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 72.8 m -56.41 -57.88 10.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.38 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.433 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 30.8 ttm180 -59.69 -35.47 74.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.149 0.5 . . . . 0.0 110.628 -179.645 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.416 HD13 HG23 ' A' ' 31' ' ' VAL . 10.6 mt -56.92 -65.33 0.63 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.866 -0.606 . . . . 0.0 112.155 -179.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.535 ' HB ' ' NZ ' ' A' ' 114' ' ' LYS . 1.4 t -70.93 -26.44 27.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 C-N-CA 120.276 -0.57 . . . . 0.0 110.724 -179.429 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.47 ' CG ' ' O ' ' A' ' 13' ' ' SER . 8.1 mm-40 -72.83 -21.87 60.89 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.367 179.596 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.433 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 11.7 pt20 -161.66 60.85 0.26 Allowed 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.767 0.317 . . . . 0.0 111.189 179.323 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 176.39 -61.62 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.778 179.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.422 ' OG ' ' CB ' ' A' ' 33' ' ' ALA . 0.4 OUTLIER -78.43 -81.28 0.1 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.78 0.324 . . . . 0.0 111.647 -179.229 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 106.06 60.32 0.61 Allowed Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.327 -179.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.8 t70 68.76 28.4 5.53 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.783 0.325 . . . . 0.0 111.142 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -91.02 -162.92 0.96 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.369 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.492 ' HA ' ' HB ' ' A' ' 109' ' ' THR . 0.0 OUTLIER -103.96 165.24 11.17 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 179.579 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.502 ' HA2' ' O ' ' A' ' 32' ' ' ALA . . . -133.67 153.02 20.67 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.013 -1.089 . . . . 0.0 113.276 -179.182 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.626 ' HB2' ' CB ' ' A' ' 51' ' ' SER . 0.0 OUTLIER -116.9 131.38 56.97 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 179.491 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.9 tt -105.93 146.75 29.6 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.168 0.509 . . . . 0.0 111.777 -179.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.31 53.94 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.032 -179.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 86.27 -0.65 87.34 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 110.261 -1.135 . . . . 0.0 110.261 -177.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.458 ' HA ' ' HA ' ' B' ' 207' ' ' PRO . 0.0 OUTLIER -165.95 165.49 18.05 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 179.683 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.428 ' O ' ' CG2' ' A' ' 31' ' ' VAL . 0.9 OUTLIER -121.02 116.62 50.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 C-N-CA 120.151 -0.62 . . . . 0.0 111.351 179.794 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.502 ' O ' ' HA2' ' A' ' 25' ' ' GLY . . . -104.74 166.99 10.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.596 -179.694 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.422 ' CB ' ' OG ' ' A' ' 20' ' ' SER . . . -102.8 138.42 39.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.345 0.593 . . . . 0.0 111.872 -178.778 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 17.5 t30 -118.98 118.08 30.52 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.487 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.74 -29.79 5.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.226 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -59.38 -44.33 92.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.924 0.392 . . . . 0.0 110.911 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 30.6 p -121.33 -174.86 2.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.711 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 45.3 p -124.0 -115.64 0.29 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.14 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.56 ' CG ' ' N ' ' A' ' 40' ' ' GLN . 0.4 OUTLIER -171.47 -84.81 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.529 179.712 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.56 ' N ' ' CG ' ' A' ' 39' ' ' PHE . 0.5 OUTLIER 80.74 32.26 0.15 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 122.726 0.41 . . . . 0.0 112.001 179.872 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.499 ' CA ' ' HB3' ' A' ' 105' ' ' SER . . . 71.55 -20.11 0.83 Allowed Glycine 0 CA--C 1.526 0.746 0 C-N-CA 121.286 -0.483 . . . . 0.0 113.447 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.622 ' N ' ' NE2' ' A' ' 107' ' ' GLN . 7.0 tp -25.95 140.33 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.292 0.637 . . . . 0.0 112.635 179.175 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -99.15 30.47 3.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.392 -179.799 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.405 ' CD1' ' CE ' ' A' ' 53' ' ' LYS . 1.2 mp 67.5 3.24 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 179.79 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.71 -27.97 23.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.692 0.282 . . . . 0.0 111.475 -179.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.411 ' CB ' HD12 ' A' ' 42' ' ' LEU . 0.3 OUTLIER -91.32 -36.21 13.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.511 -179.632 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . 0.409 ' N ' HD23 ' A' ' 42' ' ' LEU . . . 156.13 48.49 0.01 OUTLIER Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.368 -0.92 . . . . 0.0 113.163 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.496 ' CB ' ' OE1' ' A' ' 107' ' ' GLN . . . -119.15 -172.46 2.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.851 0.358 . . . . 0.0 110.749 179.566 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -119.69 129.32 54.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.132 179.268 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -43.42 -30.06 0.51 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.96 0.41 . . . . 0.0 111.043 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.626 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -51.32 -59.92 3.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.303 179.769 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.59 ' CB ' ' HG2' ' A' ' 107' ' ' GLN . 3.3 mm-40 -53.57 -40.07 65.31 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.348 0.594 . . . . 0.0 109.886 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.557 ' HG3' ' HB3' ' A' ' 106' ' ' ASP . 0.1 OUTLIER -62.79 -65.49 0.68 Allowed 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.941 179.254 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.581 HG22 ' O ' ' A' ' 51' ' ' SER . 0.5 OUTLIER -51.37 -40.65 24.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 CA-C-O 120.862 0.363 . . . . 0.0 110.319 179.919 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.495 ' O ' ' OG1' ' A' ' 58' ' ' THR . 0.8 OUTLIER -56.76 -44.86 82.2 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 178.586 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.459 ' O ' ' CD1' ' A' ' 60' ' ' LEU . . . -56.61 -60.21 3.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.145 0.498 . . . . 0.0 109.794 178.56 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.452 ' O ' ' CB ' ' A' ' 61' ' ' SER . 2.0 mm-40 -46.95 -37.38 8.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.323 179.547 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.495 ' OG1' ' O ' ' A' ' 55' ' ' PHE . 26.3 p -66.87 -50.78 61.41 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.608 -179.423 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.654 HG12 HD21 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -62.2 -46.33 96.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 120.187 -0.605 . . . . 0.0 112.349 -179.065 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.571 ' CD2' HD22 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -73.86 -28.48 61.6 Favored 'General case' 0 CA--C 1.515 -0.404 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.412 -179.313 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.452 ' CB ' ' O ' ' A' ' 57' ' ' GLN . 7.0 t -65.26 -54.58 27.22 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.019 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . 0.491 ' CD2' HD21 ' A' ' 5' ' ' LEU . 0.1 OUTLIER -69.06 -20.86 64.11 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 177.894 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.592 ' HA ' HG13 ' A' ' 66' ' ' VAL . 94.3 t -110.73 60.19 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.039 178.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -80.77 21.94 0.63 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.137 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 164.95 -53.08 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.908 0.385 . . . . 0.0 110.387 -179.55 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.592 HG13 ' HA ' ' A' ' 63' ' ' VAL . 27.2 m 43.49 -134.87 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.895 179.727 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.526 ' O ' ' O ' ' A' ' 98' ' ' SER . 3.5 p -156.4 -31.74 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 C-N-CA 120.586 -0.446 . . . . 0.0 111.835 -179.836 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.605 ' HB3' ' HB2' ' A' ' 72' ' ' ASP . 1.1 mt 37.84 98.73 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.434 -0.803 . . . . 0.0 113.052 178.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 33.9 p -73.46 -179.0 3.26 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.236 -0.654 . . . . 0.0 109.236 178.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.49 -34.09 3.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.998 0.428 . . . . 0.0 110.964 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -64.92 -63.06 1.2 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.929 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.605 ' HB2' ' HB3' ' A' ' 68' ' ' LEU . 0.6 OUTLIER -55.86 -39.3 71.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.761 -179.899 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.67 -59.84 4.29 Favored 'General case' 0 C--O 1.241 0.625 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.794 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.496 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . . . -56.9 -28.86 62.43 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 177.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.566 ' HB2' ' HA ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -60.91 -54.82 40.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.651 -1.159 . . . . 0.0 110.412 179.057 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.409 ' HG ' ' CG1' ' A' ' 115' ' ' VAL . 4.0 mp -60.71 -54.09 49.46 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.674 179.651 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.496 ' CD2' ' HA ' ' A' ' 74' ' ' ALA . 3.7 pp -57.88 -29.2 64.85 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 120.462 -0.495 . . . . 0.0 110.583 -179.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 44.4 tt0 -66.26 -59.41 3.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.985 0.421 . . . . 0.0 110.215 179.063 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 84.1 p -57.91 -28.25 64.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.799 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 4.3 m -80.95 -59.26 2.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.284 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 25.0 m -55.6 -26.07 19.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.582 -179.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.31 -30.08 0.76 Allowed 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.814 0.34 . . . . 0.0 111.237 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -147.17 149.21 32.53 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.747 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 22.8 m-20 -62.46 83.69 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.915 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 1.6 tt -177.72 114.8 0.08 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.016 179.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 35.4 t30 -105.04 107.86 19.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.636 179.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 30.6 p30 -115.71 -20.36 10.13 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.556 -179.646 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.543 ' CD2' HD11 ' A' ' 100' ' ' LEU . 0.9 OUTLIER -99.06 141.75 31.42 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.226 -179.499 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.664 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.0 OUTLIER -113.42 139.55 48.82 Favored 'General case' 0 N--CA 1.436 -1.157 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 179.945 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 22.8 mt -137.37 147.18 45.31 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 112.909 0.707 . . . . 0.0 112.909 -177.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.439 ' O ' ' CB ' ' A' ' 98' ' ' SER . 25.9 mtm180 -125.32 142.69 51.35 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 177.797 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.402 ' O ' ' CG1' ' A' ' 93' ' ' VAL . 4.0 p -105.3 139.13 40.41 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 113.49 0.922 . . . . 0.0 113.49 -178.567 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.412 ' O ' ' C ' ' A' ' 94' ' ' GLY . 20.5 m -161.59 -133.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.774 0 CA-C-N 113.674 -1.603 . . . . 0.0 107.641 178.548 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.483 ' O ' ' N ' ' A' ' 96' ' ' GLY . . . 34.41 34.86 0.04 OUTLIER Glycine 0 CA--C 1.518 0.23 0 C-N-CA 121.088 -0.577 . . . . 0.0 113.491 178.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . 0.41 ' N ' ' O ' ' A' ' 93' ' ' VAL . 35.8 t30 66.67 -67.57 0.16 Allowed 'General case' 0 N--CA 1.461 0.117 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -178.222 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.483 ' N ' ' O ' ' A' ' 94' ' ' GLY . . . -126.13 21.12 6.2 Favored Glycine 0 N--CA 1.446 -0.698 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 177.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.44 ' OD1' ' HA3' ' A' ' 94' ' ' GLY . 0.2 OUTLIER -114.55 166.67 11.46 Favored 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 122.153 0.181 . . . . 0.0 110.545 -179.686 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.526 ' O ' ' O ' ' A' ' 67' ' ' VAL . 0.9 OUTLIER -135.78 165.43 25.62 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.523 0.678 . . . . 0.0 111.384 -179.895 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -103.52 148.92 7.88 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.227 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.543 HD11 ' CD2' ' A' ' 88' ' ' TYR . 0.2 OUTLIER -103.72 108.34 19.59 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 -177.699 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.664 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -127.04 106.18 15.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 N-CA-C 104.735 -2.32 . . . . 0.0 104.735 175.378 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.569 ' OG ' ' N ' ' A' ' 89' ' ' ASP . 37.2 m -151.49 164.66 36.3 Favored 'General case' 0 C--N 1.309 -1.184 0 C-N-CA 117.922 -1.511 . . . . 0.0 114.776 -174.57 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.571 HD22 ' CD2' ' A' ' 60' ' ' LEU . 0.0 OUTLIER 157.16 -90.92 0.0 OUTLIER 'General case' 0 N--CA 1.435 -1.2 0 CA-C-N 112.877 -1.965 . . . . 0.0 111.745 175.635 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.656 ' O ' ' HB2' ' A' ' 105' ' ' SER . 0.0 OUTLIER 60.74 12.36 3.69 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 120.692 -0.403 . . . . 0.0 109.97 -179.218 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.656 ' HB2' ' O ' ' A' ' 104' ' ' ARG . 0.3 OUTLIER 157.94 162.25 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 -178.948 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.557 ' HB3' ' HG3' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -107.3 101.03 10.44 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 119.482 -0.887 . . . . 0.0 112.793 -179.08 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.622 ' NE2' ' N ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -169.12 164.33 11.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.714 177.033 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.46 ' CE ' ' HA ' ' A' ' 108' ' ' MET . 0.7 OUTLIER -165.16 147.88 8.1 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 179.68 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.523 ' CG2' ' CZ ' ' A' ' 39' ' ' PHE . 2.3 p -107.92 165.22 11.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.751 179.04 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.478 ' HB3' ' CG2' ' A' ' 16' ' ' VAL . 2.6 mt -56.21 -53.2 59.93 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.716 -0.393 . . . . 0.0 110.18 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.554 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 1.1 tp60 -49.22 -65.57 0.54 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.985 0.422 . . . . 0.0 110.089 179.431 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.531 ' O ' ' HB ' ' A' ' 115' ' ' VAL . 0.6 OUTLIER -48.71 -43.34 37.2 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.883 179.201 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.456 ' O ' HD11 ' A' ' 117' ' ' LEU . . . -52.51 -62.7 1.47 Allowed 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.928 179.361 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.626 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -62.65 -26.98 68.91 Favored 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.75 179.975 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.55 ' CG2' ' CG ' ' A' ' 75' ' ' LYS . 59.1 t -56.89 -65.3 0.41 Allowed 'Isoleucine or valine' 0 C--O 1.248 0.99 0 CA-C-O 122.252 1.025 . . . . 0.0 110.495 179.101 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.654 HD21 HG12 ' A' ' 59' ' ' VAL . 0.0 OUTLIER -60.33 -41.43 93.53 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 114.554 -1.203 . . . . 0.0 109.349 -179.7 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.586 ' CD2' HD13 ' A' ' 5' ' ' LEU . 0.2 OUTLIER -67.41 -18.39 65.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.001 179.169 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.636 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 0.9 OUTLIER -73.23 -44.59 59.29 Favored 'General case' 0 CA--C 1.503 -0.845 0 N-CA-C 106.721 -1.585 . . . . 0.0 106.721 177.968 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -78.04 -28.6 49.05 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.106 177.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.526 ' HB3' ' CG2' ' A' ' 63' ' ' VAL . . . -69.37 -53.99 16.75 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.46 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.571 ' O ' ' N ' ' A' ' 126' ' ' GLY . 0.0 OUTLIER -65.08 -44.47 88.79 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.765 179.869 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.636 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -56.62 -46.2 81.07 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.638 179.819 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 19.9 mm100 -86.96 -28.94 22.41 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -177.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . 0.462 ' CG ' ' O ' ' A' ' 120' ' ' ALA . 0.5 OUTLIER -96.04 -67.03 0.87 Allowed 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 113.761 1.023 . . . . 0.0 113.761 -177.992 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.453 ' HA ' ' HA2' ' A' ' 129' ' ' GLY . 0.0 OUTLIER -96.24 -66.32 0.91 Allowed 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -177.275 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . 0.571 ' N ' ' O ' ' A' ' 121' ' ' LEU . . . 80.7 77.55 0.98 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.943 -0.646 . . . . 0.0 111.597 -178.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.45 ' O ' ' CB ' ' A' ' 128' ' ' ARG . . . 87.31 -32.15 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 122.942 0.497 . . . . 0.0 110.379 -178.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . 0.45 ' CB ' ' O ' ' A' ' 127' ' ' ALA . 0.7 OUTLIER 158.64 43.17 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 121.353 0.596 . . . . 0.0 110.523 178.972 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . 0.453 ' HA2' ' HA ' ' A' ' 125' ' ' SER . . . 62.14 16.72 54.04 Favored Glycine 0 C--N 1.316 -0.537 0 C-N-CA 120.72 -0.752 . . . . 0.0 111.868 -179.026 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.202 -0.904 . . . . 0.0 110.8 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.109 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -167.9 84.27 0.2 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.844 0.354 . . . . 0.0 110.926 . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.6 -167.64 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.713 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 204' ' ' PTR . . . . . 0.417 ' CD1' ' HE3' ' A' ' 26' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -145.91 -94.77 0.09 Allowed 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 121.093 -0.243 . . . . 0.0 111.56 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 206' ' ' ASP . . . . . 0.504 ' O ' ' N ' ' B' ' 208' ' ' PHE . 1.2 m-20 -145.96 157.69 50.04 Favored Pre-proline 0 C--N 1.334 -0.102 0 CA-C-O 120.551 0.215 . . . . 0.0 110.995 -179.698 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . 0.458 ' HA ' ' HA ' ' A' ' 30' ' ' ASN . 12.7 Cg_endo -55.15 71.44 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 123.371 2.714 . . . . 0.0 113.292 -179.621 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 208' ' ' PHE . . . . . 0.504 ' N ' ' O ' ' B' ' 206' ' ' ASP . 0.2 OUTLIER 163.97 -31.41 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.73 179.333 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.458 -0.337 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 54.1 mtp . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.829 0.347 . . . . 0.0 111.179 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.425 ' CB ' ' CG2' ' A' ' 58' ' ' THR . 1.2 p-10 -97.62 -166.06 1.34 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.88 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.51 ' CD1' ' HB2' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -106.91 -176.01 2.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.238 179.133 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -59.66 -176.91 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.905 0.384 . . . . 0.0 111.109 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.515 ' CD1' ' CD2' ' A' ' 117' ' ' LEU . 0.1 OUTLIER -90.72 -62.77 1.38 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.218 179.718 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.465 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 93.0 p -44.14 -38.51 3.72 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.773 -179.41 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.42 -47.61 32.72 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.878 0.37 . . . . 0.0 110.138 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.516 ' O ' ' HG2' ' A' ' 11' ' ' GLN . 26.9 tp -60.4 -48.71 80.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.117 179.313 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.48 ' HA ' ' CG1' ' A' ' 12' ' ' VAL . 35.9 t-80 -61.99 -40.59 96.15 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 178.654 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.465 ' HB2' ' O ' ' A' ' 6' ' ' SER . 7.8 mtp180 -60.32 -55.13 37.35 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.34 179.815 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.674 ' HG3' ' CG1' ' A' ' 31' ' ' VAL . 2.6 pt20 -60.56 -55.42 33.55 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.643 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.585 ' HA ' ' CD1' ' A' ' 15' ' ' LEU . 14.6 p -56.63 -51.71 62.79 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 CA-C-O 120.854 0.359 . . . . 0.0 111.371 179.774 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.596 ' HA ' ' HE2' ' A' ' 114' ' ' LYS . 44.1 t -65.05 -23.85 67.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 0.0 112.021 -179.669 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -77.54 -40.67 41.76 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 120.721 -0.392 . . . . 0.0 111.429 -179.014 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.585 ' CD1' ' HA ' ' A' ' 12' ' ' VAL . 0.0 OUTLIER -72.0 -46.84 55.73 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 119.472 -0.891 . . . . 0.0 109.224 179.343 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.609 ' HB ' ' CE ' ' A' ' 114' ' ' LYS . 42.0 t -57.84 -55.85 19.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.529 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.433 ' HG2' ' HE3' ' A' ' 114' ' ' LYS . 0.0 OUTLIER -70.5 -6.48 36.41 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.154 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.453 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 7.3 pt20 -171.87 64.47 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.586 -0.446 . . . . 0.0 111.883 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.453 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 1.9 tt0 174.58 -59.62 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.112 179.467 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.409 ' CB ' ' CD1' ' A' ' 110' ' ' LEU . 58.5 m -102.06 -42.32 6.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.402 -179.348 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 94.15 -46.7 2.22 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.643 -0.789 . . . . 0.0 111.766 -179.158 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.422 ' O ' ' O ' ' A' ' 23' ' ' CYS . 0.0 OUTLIER -176.71 12.5 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 111.636 0.236 . . . . 0.0 111.636 179.794 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.453 ' HB3' ' O ' ' A' ' 34' ' ' ASN . 48.2 m -57.06 -154.08 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.935 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.599 HG21 ' H ' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -104.28 151.13 23.78 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 121.068 0.461 . . . . 0.0 111.061 -179.727 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -104.81 135.97 12.83 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.651 -0.785 . . . . 0.0 113.481 -178.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.728 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 2.5 tmtm? -104.7 120.65 41.84 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.098 -0.705 . . . . 0.0 109.098 179.078 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.452 HD12 ' CD1' ' A' ' 55' ' ' PHE . 0.4 OUTLIER -104.42 145.86 29.67 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.44 0.638 . . . . 0.0 112.578 -178.488 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 162.23 63.97 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.621 179.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 76.03 -4.45 46.53 Favored Glycine 0 C--N 1.336 0.569 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.098 -177.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.532 ' C ' ' ND2' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -166.36 166.23 16.72 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 -179.927 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.728 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 13.9 p -111.04 143.71 20.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.193 0.52 . . . . 0.0 111.592 178.667 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.596 ' CB ' ' HB3' ' A' ' 26' ' ' LYS . . . -124.9 165.32 18.28 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.538 178.625 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -104.82 115.3 30.07 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -178.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.58 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 33.3 t30 -102.55 136.67 41.95 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.659 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.1 ptmt -154.43 36.32 0.42 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.044 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -115.4 -23.06 9.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.265 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.423 ' O ' ' OG1' ' A' ' 38' ' ' THR . 3.4 m -125.99 -47.72 1.64 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.997 0.427 . . . . 0.0 110.88 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.423 ' OG1' ' O ' ' A' ' 37' ' ' THR . 2.5 p 82.83 86.46 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 122.046 0.927 . . . . 0.0 111.469 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.599 ' H ' HG21 ' A' ' 24' ' ' THR . 2.0 m-85 -82.02 131.85 35.25 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 113.952 -1.477 . . . . 0.0 110.575 179.348 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 2.4 pm0 -115.74 -34.57 4.78 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.439 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.548 ' O ' ' HB2' ' A' ' 105' ' ' SER . . . 151.98 50.75 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 N-CA-C 111.372 -0.691 . . . . 0.0 111.372 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.473 ' HG ' ' N ' ' A' ' 43' ' ' THR . 0.0 OUTLIER -108.14 -173.8 2.37 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.962 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.511 ' O ' ' N ' ' A' ' 45' ' ' ALA . 94.1 m -119.08 67.43 0.79 Allowed 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -178.016 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.402 HG12 ' HE3' ' A' ' 53' ' ' LYS . 1.0 OUTLIER 45.76 5.97 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 178.591 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.511 ' N ' ' O ' ' A' ' 43' ' ' THR . . . -72.0 -57.35 4.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.693 0.282 . . . . 0.0 111.584 -179.145 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.422 ' H ' ' CD1' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -58.31 -61.31 2.67 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.867 0.365 . . . . 0.0 110.687 -179.773 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -179.69 31.06 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.672 179.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.47 ' CB ' ' OE1' ' A' ' 107' ' ' GLN . . . -80.58 -166.91 1.18 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.014 0.435 . . . . 0.0 111.216 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.537 ' N ' ' OE2' ' A' ' 52' ' ' GLU . 3.2 mmt180 -137.82 -159.15 0.93 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.165 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.514 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 3.6 mp0 -95.17 -30.71 13.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.594 0.235 . . . . 0.0 111.606 -179.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.554 ' O ' HG22 ' A' ' 54' ' ' VAL . 0.6 OUTLIER -62.04 -45.41 93.67 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.283 -0.417 . . . . 0.0 112.051 -179.228 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.537 ' OE2' ' N ' ' A' ' 49' ' ' ARG . 0.8 OUTLIER -59.28 -65.24 0.7 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.029 0.443 . . . . 0.0 110.294 179.94 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.601 ' HB3' ' O ' ' A' ' 106' ' ' ASP . 0.0 OUTLIER -46.44 -59.44 2.96 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.604 179.648 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.554 HG22 ' O ' ' A' ' 51' ' ' SER . 11.7 m -49.09 -44.12 16.08 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-O 120.988 0.423 . . . . 0.0 110.308 179.561 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.452 ' CD1' HD12 ' A' ' 27' ' ' LEU . 0.4 OUTLIER -53.5 -53.14 55.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.805 178.768 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.07 -46.44 75.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.811 179.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -66.12 -42.25 89.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.221 0.534 . . . . 0.0 110.561 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.425 ' CG2' ' CB ' ' A' ' 2' ' ' ASN . 93.0 m -60.01 -47.54 85.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.956 -179.858 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.505 ' CG2' ' HB2' ' A' ' 116' ' ' LEU . 11.1 p -69.96 -38.03 74.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.853 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.505 ' N ' HG11 ' A' ' 59' ' ' VAL . 4.0 tp -59.29 -37.59 78.06 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 121.146 0.498 . . . . 0.0 109.766 179.551 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 15.5 t -72.2 -52.96 14.08 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.032 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . 0.421 ' HB3' ' CD2' ' A' ' 5' ' ' LEU . 7.2 m-70 -55.49 -35.06 65.15 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 121.092 0.472 . . . . 0.0 110.322 179.573 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.575 HG13 HG13 ' A' ' 66' ' ' VAL . 57.0 t -83.7 -69.97 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.176 179.172 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.493 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 42.82 28.67 0.14 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.605 178.9 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.493 ' CB ' ' O ' ' A' ' 64' ' ' ALA . 0.7 OUTLIER 157.37 -75.97 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.782 0 CA-C-O 120.709 0.29 . . . . 0.0 111.647 179.853 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.575 HG13 HG13 ' A' ' 63' ' ' VAL . 35.4 m 46.52 -139.25 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.614 -179.475 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.506 ' O ' ' O ' ' A' ' 98' ' ' SER . 3.5 p -158.05 -20.84 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -179.199 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.534 ' HB3' ' HB2' ' A' ' 72' ' ' ASP . 2.0 mp 36.68 90.13 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 179.705 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 30.5 p -67.18 -173.69 0.29 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 179.006 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.5 -30.49 8.43 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.954 0.406 . . . . 0.0 110.749 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.09 -65.04 0.72 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.691 179.661 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.534 ' HB2' ' HB3' ' A' ' 68' ' ' LEU . 0.9 OUTLIER -54.95 -35.06 63.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.978 -179.942 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.0 m -59.36 -61.69 2.44 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 109.125 -0.695 . . . . 0.0 109.125 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.522 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . . . -56.86 -26.24 58.24 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 121.501 0.667 . . . . 0.0 109.241 177.744 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.546 ' HB3' ' CG1' ' A' ' 115' ' ' VAL . 1.0 OUTLIER -62.18 -62.32 1.85 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.718 -1.128 . . . . 0.0 111.005 179.4 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.433 ' HG ' HG11 ' A' ' 115' ' ' VAL . 0.6 OUTLIER -59.33 -49.52 77.5 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.691 179.891 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.522 ' CD2' ' HA ' ' A' ' 74' ' ' ALA . 1.5 pp -61.16 -29.43 69.78 Favored 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.222 179.653 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.1 -56.95 11.28 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 178.73 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.13 -29.2 67.23 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.289 179.113 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.484 ' HA ' ' CB ' ' A' ' 85' ' ' LEU . 51.6 m -68.01 -65.1 0.74 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.181 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 10.9 p -60.05 -24.3 29.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.25 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 2.5 mtpp -64.64 -66.58 0.52 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.831 -179.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . 0.439 ' O ' ' N ' ' A' ' 85' ' ' LEU . 36.1 m170 -131.19 106.76 8.54 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.227 0.455 . . . . 0.0 112.227 -179.004 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 36.53 -89.74 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.191 179.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.505 ' O ' ' CB ' ' A' ' 86' ' ' ASN . 0.0 OUTLIER 75.31 -140.91 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.83 -179.992 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.505 ' CB ' ' O ' ' A' ' 85' ' ' LEU . 3.7 t-20 89.31 35.76 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.171 0.51 . . . . 0.0 110.172 -179.235 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . 0.489 ' CB ' ' HA3' ' A' ' 41' ' ' GLY . 0.6 OUTLIER -121.81 -27.0 4.74 Favored 'General case' 0 C--O 1.251 1.162 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.006 -179.704 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 1.344 ' HA ' ' OG ' ' A' ' 102' ' ' SER . 95.0 m-85 -99.13 125.42 44.66 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 115.608 -0.724 . . . . 0.0 112.179 -178.353 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.655 ' HB3' ' O ' ' A' ' 101' ' ' VAL . 0.7 OUTLIER -104.64 136.54 43.98 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 -179.966 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.443 HD23 ' O ' ' A' ' 99' ' ' VAL . 30.6 mt -129.48 155.08 46.3 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 -176.352 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.689 ' O ' ' CB ' ' A' ' 98' ' ' SER . 0.0 OUTLIER -132.31 161.71 32.86 Favored 'General case' 0 C--O 1.215 -0.746 0 CA-C-N 114.703 -1.135 . . . . 0.0 108.558 177.585 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.444 ' O ' ' CG1' ' A' ' 93' ' ' VAL . 22.9 p -103.64 158.64 16.23 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.882 0.849 . . . . 0.0 112.676 -178.87 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.576 ' O ' ' O ' ' A' ' 97' ' ' ASN . 0.0 OUTLIER 166.18 151.05 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.437 -1.117 0 CA-C-N 113.695 -1.593 . . . . 0.0 107.884 -179.141 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.477 ' C ' ' H ' ' A' ' 96' ' ' GLY . . . 91.51 19.89 39.76 Favored Glycine 0 C--N 1.291 -1.957 0 C-N-CA 119.899 -1.143 . . . . 0.0 112.901 -179.63 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 74.02 -46.96 0.63 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.825 -0.805 . . . . 0.0 108.825 -178.1 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.477 ' H ' ' C ' ' A' ' 94' ' ' GLY . . . -141.58 15.2 2.69 Favored Glycine 0 N--CA 1.441 -0.983 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.852 178.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.576 ' O ' ' O ' ' A' ' 93' ' ' VAL . 0.4 OUTLIER -105.46 166.64 10.29 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 117.252 0.526 . . . . 0.0 109.831 179.25 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.689 ' CB ' ' O ' ' A' ' 91' ' ' ARG . 0.2 OUTLIER -139.27 164.98 28.39 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.294 0.569 . . . . 0.0 110.784 179.772 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.457 HG11 ' HB2' ' A' ' 91' ' ' ARG . 0.5 OUTLIER -104.2 152.25 6.57 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.292 179.636 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.559 ' CD2' HG11 ' A' ' 63' ' ' VAL . 7.5 tp -103.19 105.24 15.48 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 121.638 0.732 . . . . 0.0 112.56 -178.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.655 ' O ' ' HB3' ' A' ' 89' ' ' ASP . 1.6 p -123.68 110.04 24.8 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.96 0 N-CA-C 104.982 -2.229 . . . . 0.0 104.982 175.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 1.344 ' OG ' ' HA ' ' A' ' 88' ' ' TYR . 2.5 t -166.85 166.79 15.42 Favored 'General case' 0 CA--C 1.495 -1.171 0 N-CA-C 115.27 1.582 . . . . 0.0 115.27 -174.178 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.637 ' O ' ' C ' ' A' ' 104' ' ' ARG . 0.1 OUTLIER 168.99 -45.41 0.01 OUTLIER 'General case' 0 N--CA 1.435 -1.215 0 CA-C-N 113.721 -1.581 . . . . 0.0 112.09 174.032 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.637 ' C ' ' O ' ' A' ' 103' ' ' LEU . 0.0 OUTLIER 16.1 81.25 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.671 0 O-C-N 123.58 0.55 . . . . 0.0 110.044 178.457 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.548 ' HB2' ' O ' ' A' ' 41' ' ' GLY . 0.7 OUTLIER 86.02 -166.43 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 -176.28 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.601 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -132.42 101.74 5.46 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 119.989 -0.684 . . . . 0.0 110.629 179.368 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.55 ' HG2' ' HB3' ' A' ' 39' ' ' PHE . 1.5 mt-30 -169.13 165.51 11.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.441 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.492 ' HE3' HD23 ' A' ' 116' ' ' LEU . 0.7 OUTLIER -159.87 143.09 14.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.488 0.661 . . . . 0.0 112.588 178.505 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.51 HG23 ' HA ' ' A' ' 24' ' ' THR . 0.2 OUTLIER -104.31 164.77 11.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.572 -1.195 . . . . 0.0 109.048 178.31 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.53 ' HB3' ' CG2' ' A' ' 16' ' ' VAL . 2.4 mt -57.32 -51.77 68.03 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.708 0.289 . . . . 0.0 111.044 -179.368 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.434 ' NE2' ' CD ' ' A' ' 114' ' ' LYS . 0.1 OUTLIER -54.7 -61.45 2.3 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.576 179.364 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.498 ' HA ' HG22 ' A' ' 115' ' ' VAL . 11.7 m-20 -44.07 -53.81 6.04 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-O 121.074 0.464 . . . . 0.0 111.295 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.466 ' O ' HD12 ' A' ' 117' ' ' LEU . . . -49.92 -60.27 3.08 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.188 179.33 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.609 ' CE ' ' HB ' ' A' ' 16' ' ' VAL . 0.2 OUTLIER -54.02 -32.49 54.45 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.414 179.473 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.546 ' CG1' ' HB3' ' A' ' 75' ' ' LYS . 48.1 t -61.99 -65.36 0.51 Allowed 'Isoleucine or valine' 0 C--O 1.241 0.63 0 CA-C-O 121.737 0.78 . . . . 0.0 111.912 -178.518 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.509 ' O ' ' HB2' ' A' ' 120' ' ' ALA . 0.3 OUTLIER -63.32 -34.12 77.0 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.298 -178.941 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.515 ' CD2' ' CD1' ' A' ' 5' ' ' LEU . 0.6 OUTLIER -73.15 -21.92 60.61 Favored 'General case' 0 CA--C 1.512 -0.498 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.549 178.898 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.554 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 6.5 tp10 -70.17 -46.89 63.7 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 106.267 -1.753 . . . . 0.0 106.267 177.134 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . 0.44 ' CB ' ' HG ' ' A' ' 68' ' ' LEU . . . -74.36 -24.25 59.14 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.085 -1.416 . . . . 0.0 110.236 177.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.509 ' HB2' ' O ' ' A' ' 116' ' ' LEU . . . -77.01 -50.72 12.49 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.471 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.48 ' HB3' ' O ' ' A' ' 117' ' ' LEU . 0.0 OUTLIER -62.68 -38.88 92.09 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.715 179.383 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.554 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.1 OUTLIER -73.7 -38.34 64.89 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.313 -179.558 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.406 ' HB2' ' O ' ' A' ' 119' ' ' ALA . 29.6 mm100 -89.89 -24.88 21.24 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -178.033 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -84.72 -66.97 0.83 Allowed 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.415 -179.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 9.5 t -96.94 -54.3 3.24 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.363 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 108.25 63.27 0.56 Allowed Glycine 0 CA--C 1.498 -1.012 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 -178.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . 49.22 28.03 2.06 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 -177.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.74 -57.98 1.95 Allowed 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 114.789 -1.096 . . . . 0.0 111.59 -178.076 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . 0.413 ' HA2' ' HB3' ' A' ' 6' ' ' SER . . . 110.62 -21.77 23.03 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.462 -179.413 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 19.3 p . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.218 -0.896 . . . . 0.0 111.12 179.942 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.114 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 61.11 -81.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.726 0.298 . . . . 0.0 110.969 . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -146.15 162.4 38.07 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.839 0.352 . . . . 0.0 110.723 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 204' ' ' PTR . . . . . 0.407 ' HB3' ' HB3' ' A' ' 30' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 37.0 m-20 44.62 -90.44 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.773 -0.649 . . . . 0.0 112.548 179.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 206' ' ' ASP . . . . . 0.425 ' CB ' ' HD2' ' B' ' 207' ' ' PRO . 1.9 m-20 -110.18 165.93 11.73 Favored Pre-proline 0 CA--C 1.528 0.125 0 CA-C-O 120.911 0.386 . . . . 0.0 111.682 -178.841 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . 0.512 ' HB3' ' NE2' ' A' ' 11' ' ' GLN . 11.0 Cg_endo -52.89 164.87 1.4 Allowed 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 123.216 2.61 . . . . 0.0 112.698 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 208' ' ' PHE . . . . . 0.505 ' CE2' ' HA ' ' A' ' 11' ' ' GLN . 95.0 m-85 64.87 -15.42 0.09 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.435 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 116.736 -0.211 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.765 0.317 . . . . 0.0 111.277 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -158.34 -162.3 1.11 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.765 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.4 mp -85.49 -99.29 0.06 Allowed 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.735 179.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.418 ' O ' ' CB ' ' A' ' 8' ' ' LEU . 1.4 m -168.33 161.05 11.84 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 179.672 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.528 ' HA ' HD23 ' A' ' 117' ' ' LEU . 21.7 mt -56.82 -65.08 0.68 Allowed 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 121.37 0.605 . . . . 0.0 111.002 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.8 t -46.71 -45.4 19.47 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-N 115.165 -0.925 . . . . 0.0 112.091 -178.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.23 -64.5 1.12 Allowed 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.805 0.336 . . . . 0.0 110.65 -179.682 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.449 ' CD2' HD21 ' A' ' 117' ' ' LEU . 5.6 tp -44.27 -42.35 6.57 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.258 179.351 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.461 ' CD2' ' CD2' ' A' ' 121' ' ' LEU . 85.0 t60 -70.51 -44.19 68.13 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.325 178.364 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.464 ' HB3' ' CZ ' ' B' ' 208' ' ' PHE . 11.3 mmt180 -55.67 -53.66 53.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.768 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.512 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER -63.46 -54.78 31.19 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 120.885 -0.326 . . . . 0.0 111.253 -179.88 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.555 ' HA ' HD13 ' A' ' 15' ' ' LEU . 13.2 p -54.19 -48.58 66.1 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 CA-C-O 121.189 0.519 . . . . 0.0 110.942 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.623 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 60.8 m -62.96 -33.78 76.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.484 -0.78 . . . . 0.0 112.101 -179.519 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.28 -29.0 61.46 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.318 -179.295 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.555 HD13 ' HA ' ' A' ' 12' ' ' VAL . 0.5 OUTLIER -75.84 -50.77 14.16 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.517 179.628 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.851 ' CG2' ' HB3' ' A' ' 110' ' ' LEU . 69.6 t -66.71 -54.42 25.6 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.408 0 CA-C-O 121.202 0.525 . . . . 0.0 111.519 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -63.23 -8.59 8.61 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.767 -178.46 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -141.88 25.12 1.98 Allowed 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 120.996 -0.282 . . . . 0.0 111.594 179.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.453 ' N ' ' O ' ' A' ' 15' ' ' LEU . 3.8 tt0 179.73 -69.93 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.534 ' HB3' ' HB2' ' A' ' 23' ' ' CYS . 0.7 OUTLIER -83.44 68.83 9.89 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.992 0.425 . . . . 0.0 111.917 -178.161 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -36.41 -34.55 0.09 OUTLIER Glycine 0 CA--C 1.521 0.441 0 CA-C-N 115.73 -0.668 . . . . 0.0 114.009 -179.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -166.57 9.04 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -179.508 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.534 ' HB2' ' HB3' ' A' ' 20' ' ' SER . 96.2 m -53.72 -171.26 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.708 0.289 . . . . 0.0 110.819 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.448 ' CG2' ' HB3' ' A' ' 39' ' ' PHE . 8.2 m -103.57 148.04 26.46 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 179.829 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -104.51 144.23 15.8 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.095 -1.05 . . . . 0.0 113.507 -178.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.493 ' HB2' ' CB ' ' A' ' 51' ' ' SER . 0.0 OUTLIER -112.35 126.45 55.29 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 179.17 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.415 HD11 ' CD1' ' A' ' 55' ' ' PHE . 0.4 OUTLIER -104.67 144.2 32.05 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.308 0.575 . . . . 0.0 111.893 -178.846 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 171.12 57.28 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.135 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 84.52 -2.25 88.13 Favored Glycine 0 N--CA 1.451 -0.35 0 N-CA-C 111.129 -0.788 . . . . 0.0 111.129 -177.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.524 ' HB2' ' HA ' ' B' ' 207' ' ' PRO . 0.0 OUTLIER -166.45 165.5 16.97 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 179.731 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.436 HG23 ' N ' ' A' ' 12' ' ' VAL . 1.3 m -119.78 117.8 54.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 C-N-CA 119.857 -0.737 . . . . 0.0 111.487 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.403 ' CB ' ' CG ' ' A' ' 26' ' ' LYS . . . -108.26 166.87 10.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.111 -179.296 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.414 ' CB ' HD11 ' A' ' 110' ' ' LEU . . . -103.33 132.24 49.75 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.221 0.534 . . . . 0.0 111.485 -179.305 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 5.2 t30 -115.33 121.24 42.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.67 -179.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.5 tttt -113.69 -10.88 13.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.512 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -79.91 -66.78 0.83 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.781 0.324 . . . . 0.0 111.27 -179.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.6 168.93 17.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.332 -179.531 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 61.6 p -131.48 114.58 15.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.496 179.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.502 ' CG ' ' N ' ' A' ' 40' ' ' GLN . 0.0 OUTLIER -79.59 -179.72 7.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.19 -179.586 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.502 ' N ' ' CG ' ' A' ' 39' ' ' PHE . 0.8 OUTLIER 165.63 36.28 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.512 179.716 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.468 ' C ' ' HB2' ' A' ' 107' ' ' GLN . . . 89.37 -34.83 3.86 Favored Glycine 0 CA--C 1.52 0.375 0 CA-C-N 115.76 -0.655 . . . . 0.0 112.367 -179.33 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.513 ' O ' ' HB2' ' A' ' 107' ' ' GLN . 0.4 OUTLIER -21.0 139.51 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.404 0.681 . . . . 0.0 112.785 179.579 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.9 27.41 1.82 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.599 -179.791 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.45 ' HA ' ' HB1' ' A' ' 48' ' ' ALA . 8.7 mm 65.65 5.6 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -87.24 -29.12 21.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.777 0.322 . . . . 0.0 111.439 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.3 t -87.21 -32.52 19.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.081 -179.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.41 40.16 0.03 OUTLIER Glycine 0 CA--C 1.518 0.281 0 C-N-CA 120.462 -0.875 . . . . 0.0 113.197 179.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.45 ' HB1' ' HA ' ' A' ' 44' ' ' ILE . . . -106.86 169.28 8.64 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.841 0.32 . . . . 0.0 110.846 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 14.9 mtp180 -87.98 132.13 34.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.844 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -52.12 -30.46 26.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.056 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.493 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 19.5 p -61.31 -55.11 35.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.969 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.502 ' CB ' ' HG2' ' A' ' 107' ' ' GLN . 13.8 mt-10 -51.6 -44.36 62.81 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.082 0.468 . . . . 0.0 110.411 179.733 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.422 ' HG3' ' HB3' ' A' ' 106' ' ' ASP . 0.1 OUTLIER -56.57 -62.52 1.67 Allowed 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.33 178.945 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 33.5 t -49.81 -32.04 7.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 121.167 0.508 . . . . 0.0 110.33 179.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.445 ' HB3' ' HB3' ' A' ' 108' ' ' MET . 0.1 OUTLIER -64.98 -48.02 75.47 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.362 179.306 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.27 -39.12 81.89 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-O 121.028 0.442 . . . . 0.0 110.061 179.118 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.1 mm-40 -69.21 -33.85 73.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.943 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 48.3 m -75.59 -50.97 13.94 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 120.911 0.386 . . . . 0.0 110.505 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 3.0 m -62.75 -37.33 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.694 179.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.9 tp -70.14 -44.51 68.71 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.556 179.415 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 74.8 m -60.85 -62.23 2.01 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.612 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . 0.433 ' CG ' HD22 ' A' ' 5' ' ' LEU . 1.9 m-70 -49.33 -43.27 43.52 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 121.08 0.467 . . . . 0.0 110.703 -179.768 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.529 HG11 HG12 ' A' ' 66' ' ' VAL . 67.7 t -74.2 -80.15 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.242 179.228 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . 75.21 -26.02 0.2 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.358 -0.383 . . . . 0.0 112.005 179.389 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.432 ' H ' ' C ' ' A' ' 63' ' ' VAL . 1.5 p30 -170.03 -51.99 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.065 0.46 . . . . 0.0 110.396 -179.197 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.67 HG13 ' HA ' ' A' ' 120' ' ' ALA . 35.9 m 46.56 -139.72 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.555 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.532 ' O ' ' O ' ' A' ' 98' ' ' SER . 3.4 p -153.47 -24.85 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 N-CA-C 113.367 0.876 . . . . 0.0 113.367 -179.259 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.456 HD11 ' HB2' ' A' ' 100' ' ' LEU . 1.5 mp 34.07 98.42 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 112.659 0.615 . . . . 0.0 112.659 179.432 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.422 ' O ' ' O ' ' A' ' 68' ' ' LEU . 68.8 p -60.66 -122.94 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 179.081 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.35 -39.54 9.98 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.347 0.594 . . . . 0.0 109.869 179.139 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.492 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 2.1 tt0 -59.6 -64.92 0.77 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.215 -179.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.546 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 96.1 m-20 -52.44 -33.14 42.77 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.237 -179.676 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 97.8 m -61.62 -63.9 1.12 Allowed 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.66 -24.25 60.84 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 177.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.567 ' CG ' ' CG2' ' A' ' 115' ' ' VAL . 0.2 OUTLIER -59.23 -65.09 0.72 Allowed 'General case' 0 C--O 1.234 0.261 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.428 179.017 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.522 HD13 HG11 ' A' ' 115' ' ' VAL . 0.4 OUTLIER -58.55 -38.92 78.84 Favored 'General case' 0 CA--C 1.52 -0.206 0 N-CA-C 109.425 -0.584 . . . . 0.0 109.425 178.981 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -50.75 -49.83 57.1 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.726 179.648 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -67.36 -53.04 33.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.878 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.33 -21.54 59.93 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.161 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 45.8 m -94.32 -49.07 5.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.145 -179.819 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 7.2 p -76.7 -6.11 8.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.74 -179.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 10.6 ptmm? -46.62 -33.19 3.99 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.899 0.381 . . . . 0.0 111.134 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -179.23 -57.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.785 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -101.08 75.88 1.7 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.734 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.16 85.13 7.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.052 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -173.39 37.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.391 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 16.5 p-10 -125.77 -52.33 1.57 Allowed 'General case' 0 C--O 1.234 0.269 0 C-N-CA 121.08 -0.248 . . . . 0.0 111.457 179.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.742 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 1.3 m-85 -103.05 137.28 41.44 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.691 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.676 ' O ' ' O ' ' A' ' 101' ' ' VAL . 0.4 OUTLIER -105.1 140.84 37.67 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 121.958 0.885 . . . . 0.0 110.921 -177.597 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.504 HD22 HD11 ' A' ' 76' ' ' LEU . 11.3 mt -132.2 150.1 52.23 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.137 -0.938 . . . . 0.0 113.134 -178.027 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.453 ' O ' ' CB ' ' A' ' 98' ' ' SER . 0.0 OUTLIER -137.18 148.99 46.94 Favored 'General case' 0 C--O 1.219 -0.534 0 N-CA-C 107.67 -1.234 . . . . 0.0 107.67 177.551 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.477 ' HA ' ' HA ' ' A' ' 98' ' ' SER . 11.4 p -111.26 141.88 44.2 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 -178.384 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.424 ' CG1' ' O ' ' A' ' 92' ' ' SER . 15.9 m -163.36 -130.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 CA-C-N 113.848 -1.524 . . . . 0.0 108.283 178.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.536 ' O ' ' N ' ' A' ' 96' ' ' GLY . . . 32.94 35.87 0.03 OUTLIER Glycine 0 C--N 1.332 0.33 0 C-N-CA 121.321 -0.466 . . . . 0.0 113.662 178.691 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . 0.418 ' N ' ' O ' ' A' ' 93' ' ' VAL . 8.4 t30 64.57 -70.13 0.08 Allowed 'General case' 0 N--CA 1.462 0.134 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 -178.297 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.536 ' N ' ' O ' ' A' ' 94' ' ' GLY . . . -122.47 23.69 7.08 Favored Glycine 0 N--CA 1.445 -0.723 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 177.852 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.403 ' ND2' ' HA3' ' A' ' 94' ' ' GLY . 0.0 OUTLIER -119.92 166.64 13.05 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.555 0.216 . . . . 0.0 110.616 -179.708 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.532 ' O ' ' O ' ' A' ' 67' ' ' VAL . 0.2 OUTLIER -133.1 165.57 24.45 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.518 0.675 . . . . 0.0 111.122 -179.981 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -103.93 140.04 23.19 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 179.087 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.53 HD21 ' CD1' ' A' ' 116' ' ' LEU . 8.7 tp -104.29 106.37 16.84 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -178.2 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.676 ' O ' ' O ' ' A' ' 89' ' ' ASP . 0.5 OUTLIER -122.48 123.05 67.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 104.741 -2.318 . . . . 0.0 104.741 176.361 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.742 ' HB2' ' HA ' ' A' ' 88' ' ' TYR . 72.2 p -165.31 166.79 18.44 Favored 'General case' 0 C--N 1.312 -1.06 0 C-N-CA 116.876 -1.93 . . . . 0.0 116.161 -173.782 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.498 HD23 ' O ' ' A' ' 102' ' ' SER . 0.1 OUTLIER 161.5 -89.73 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 112.815 -1.993 . . . . 0.0 111.789 175.52 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.573 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 52.75 40.16 29.95 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 -179.729 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.573 ' CB ' ' O ' ' A' ' 104' ' ' ARG . 57.7 m 116.64 156.65 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.392 1.077 . . . . 0.0 108.298 -177.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.422 ' HB3' ' HG3' ' A' ' 53' ' ' LYS . 1.5 m-20 -104.92 102.55 12.07 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -178.27 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.513 ' HB2' ' O ' ' A' ' 42' ' ' LEU . 0.7 OUTLIER -167.65 148.55 5.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.058 177.522 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.588 ' CE ' ' CZ ' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -143.72 159.22 42.88 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -179.98 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.461 HG21 ' CZ ' ' A' ' 39' ' ' PHE . 1.2 t -117.5 160.82 20.59 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.405 -1.27 . . . . 0.0 109.409 179.133 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.851 ' HB3' ' CG2' ' A' ' 16' ' ' VAL . 1.0 OUTLIER -50.24 -55.92 13.29 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 120.732 0.301 . . . . 0.0 111.284 -179.502 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.588 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 0.2 OUTLIER -50.37 -65.36 0.57 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.243 -179.853 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.562 ' HA ' HG23 ' A' ' 115' ' ' VAL . 11.5 m-20 -47.64 -55.46 9.33 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.88 0.371 . . . . 0.0 110.986 -179.58 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -42.39 -59.04 1.98 Allowed 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.104 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.648 ' HE2' ' HB ' ' A' ' 16' ' ' VAL . 0.0 OUTLIER -63.26 -34.62 78.07 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.084 179.894 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.567 ' CG2' ' CG ' ' A' ' 75' ' ' LYS . 93.3 t -52.48 -65.37 0.3 Allowed 'Isoleucine or valine' 0 C--O 1.248 1.009 0 CA-C-O 122.127 0.965 . . . . 0.0 111.342 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.53 ' CD1' HD21 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -61.35 -42.94 99.51 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 114.485 -1.234 . . . . 0.0 110.237 -178.876 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.528 HD23 ' HA ' ' A' ' 5' ' ' LEU . 0.2 OUTLIER -68.09 -16.1 63.87 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.245 179.952 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.56 ' HA ' HD22 ' A' ' 121' ' ' LEU . 2.7 tm-20 -72.15 -56.58 5.33 Favored 'General case' 0 N--CA 1.438 -1.06 0 N-CA-C 105.453 -2.055 . . . . 0.0 105.453 176.53 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . 0.465 ' HA ' ' CD ' ' A' ' 122' ' ' ARG . . . -64.24 -33.98 77.05 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 114.166 -1.379 . . . . 0.0 110.866 177.725 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.67 ' HA ' HG13 ' A' ' 66' ' ' VAL . . . -64.16 -57.88 8.25 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.035 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.611 ' HG ' ' N ' ' A' ' 122' ' ' ARG . 0.1 OUTLIER -56.87 -45.81 82.24 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.997 -179.324 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.611 ' N ' ' HG ' ' A' ' 121' ' ' LEU . 0.0 OUTLIER -63.1 -65.7 0.65 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 119.549 -0.861 . . . . 0.0 111.97 -179.823 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -53.65 -29.79 40.08 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.177 -0.92 . . . . 0.0 113.041 -178.302 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . 0.41 ' CG ' ' O ' ' A' ' 120' ' ' ALA . 4.6 mm-40 -95.11 -66.24 0.93 Allowed 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -178.685 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.458 ' CB ' ' N ' ' A' ' 129' ' ' GLY . 0.1 OUTLIER -96.03 -65.49 0.97 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -178.529 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . 0.514 ' N ' ' O ' ' A' ' 121' ' ' LEU . . . 98.57 74.39 1.15 Allowed Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 -178.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.502 ' CB ' ' O ' ' A' ' 126' ' ' GLY . . . 92.87 -27.83 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 123.04 0.536 . . . . 0.0 109.867 -178.008 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . 0.471 ' CB ' ' O ' ' A' ' 127' ' ' ALA . 0.0 OUTLIER 153.49 120.75 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.39 178.696 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . 0.458 ' N ' ' CB ' ' A' ' 125' ' ' SER . . . -145.03 -50.47 0.03 OUTLIER Glycine 0 C--N 1.319 -0.414 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.518 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 41.0 p . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.232 -0.889 . . . . 0.0 110.913 -179.996 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.083 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 22.5 p30 -140.42 153.92 46.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.754 0.311 . . . . 0.0 110.896 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.47 76.16 1.14 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.901 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 204' ' ' PTR . . . . . 0.413 ' HE1' ' HE3' ' A' ' 26' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -118.93 -43.83 2.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.703 179.861 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 206' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -104.06 119.2 55.05 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.616 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . 0.524 ' HA ' ' HB2' ' A' ' 30' ' ' ASN . 19.1 Cg_endo -59.02 -75.21 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.402 2.068 . . . . 0.0 112.761 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 208' ' ' PHE . . . . . 0.464 ' CZ ' ' HB3' ' A' ' 10' ' ' ARG . 1.4 p90 -140.72 -41.48 0.4 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.871 0.367 . . . . 0.0 111.016 -179.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 209' ' ' NH2 . . . . . 0.422 ' N ' ' CD1' ' B' ' 208' ' ' PHE . . . . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 116.482 -0.326 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.3 mmm . . . . . 0 N--CA 1.485 1.304 0 CA-C-O 120.646 0.26 . . . . 0.0 111.144 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.437 ' ND2' ' CE1' ' A' ' 62' ' ' HIS . 8.6 p-10 36.97 -147.71 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.68 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.585 ' CD1' ' N ' ' A' ' 3' ' ' LEU . 0.6 OUTLIER -99.9 16.37 24.04 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.457 0.17 . . . . 0.0 111.428 -179.342 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.1 m 72.79 -166.6 0.12 Allowed 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -178.568 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.427 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 7.7 mt -95.51 -64.89 1.01 Allowed 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.234 0.54 . . . . 0.0 111.916 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.486 ' HB3' ' CA ' ' A' ' 129' ' ' GLY . 1.9 p -45.19 -47.07 12.51 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.297 -0.865 . . . . 0.0 112.367 -178.013 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . 0.418 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 0.6 OUTLIER -73.4 -64.56 0.96 Allowed 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 120.857 0.361 . . . . 0.0 110.078 179.73 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.439 ' O ' HG12 ' A' ' 12' ' ' VAL . 14.5 tp -41.39 -47.5 3.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.363 179.134 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.441 ' CG ' HD22 ' A' ' 121' ' ' LEU . 32.6 t-80 -64.97 -43.87 91.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.614 178.538 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.432 ' HB3' ' CZ ' ' B' ' 208' ' ' PHE . 3.4 mmt-85 -53.68 -54.08 42.98 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.995 -1.002 . . . . 0.0 111.586 -179.634 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.556 HE21 HD22 ' A' ' 3' ' ' LEU . 1.0 OUTLIER -67.72 -51.27 51.28 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.518 -179.505 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.492 HG11 ' CB ' ' A' ' 114' ' ' LYS . 11.0 p -57.69 -44.36 85.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 CA-C-O 121.137 0.494 . . . . 0.0 110.644 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.762 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 95.0 p -62.84 -51.63 66.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.727 179.417 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.471 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 1.0 OUTLIER -66.64 -17.6 64.93 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.934 179.977 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.9 mt -79.6 -59.62 2.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.709 -179.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.496 ' HB ' ' NZ ' ' A' ' 114' ' ' LYS . 1.0 OUTLIER -71.42 -27.66 29.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 C-N-CA 120.904 -0.319 . . . . 0.0 110.92 -179.798 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.414 ' HB2' ' O ' ' A' ' 13' ' ' SER . 5.6 mm-40 -74.98 -13.97 60.57 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.804 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.471 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 10.5 pt20 -170.48 62.53 0.04 OUTLIER 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.78 0.324 . . . . 0.0 111.167 179.498 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 173.12 -60.11 0.01 OUTLIER 'General case' 0 C--O 1.232 0.16 0 CA-C-O 120.835 0.35 . . . . 0.0 111.37 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.484 ' HB2' ' HA ' ' A' ' 16' ' ' VAL . 15.0 m -85.2 -36.85 20.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.603 -179.237 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 55.95 71.83 0.67 Allowed Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.335 -179.594 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 53.77 97.05 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.967 0.413 . . . . 0.0 110.881 -179.751 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.405 ' O ' HG23 ' A' ' 109' ' ' THR . 0.2 OUTLIER -161.82 -161.25 0.76 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.021 -179.731 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.513 ' HA ' ' HA ' ' A' ' 109' ' ' THR . 35.4 m -104.1 136.73 43.19 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.336 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.453 ' CA ' ' HG ' ' A' ' 110' ' ' LEU . . . -104.8 140.83 15.15 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.407 -0.901 . . . . 0.0 113.554 -178.706 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.578 ' HB2' ' CB ' ' A' ' 51' ' ' SER . 0.0 OUTLIER -104.95 133.65 49.38 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.194 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.424 ' HB2' ' CG ' ' A' ' 55' ' ' PHE . 1.2 tt -104.72 148.87 26.11 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.327 0.584 . . . . 0.0 111.927 -179.252 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 169.01 58.37 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 114.993 -1.003 . . . . 0.0 108.969 -179.821 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 72.3 6.07 64.38 Favored Glycine 0 CA--C 1.52 0.358 0 N-CA-C 110.424 -1.071 . . . . 0.0 110.424 -177.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.554 ' HA ' ' CD2' ' A' ' 3' ' ' LEU . 0.0 OUTLIER -166.36 165.15 17.37 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 -179.74 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.432 HG11 ' CG ' ' A' ' 11' ' ' GLN . 0.8 OUTLIER -119.54 122.85 69.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.399 0.618 . . . . 0.0 111.234 179.021 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.478 ' CB ' ' HG3' ' A' ' 26' ' ' LYS . . . -111.91 166.04 11.56 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.313 179.528 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.415 ' CB ' ' OG ' ' A' ' 20' ' ' SER . . . -103.73 142.68 33.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.318 0.58 . . . . 0.0 112.176 -178.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.477 HD21 ' HB ' ' A' ' 24' ' ' THR . 6.7 t30 -126.96 120.2 28.52 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.1 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.05 21.61 3.49 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.99 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -106.08 -23.98 12.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.192 -179.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 12.3 t -135.7 -176.54 4.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.095 0.474 . . . . 0.0 111.615 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.594 ' O ' ' NE2' ' A' ' 40' ' ' GLN . 41.5 p -120.66 126.53 50.46 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.24 -179.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.695 ' O ' ' HB2' ' A' ' 42' ' ' LEU . 3.2 p90 -81.87 -43.28 18.41 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.132 -179.559 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.594 ' NE2' ' O ' ' A' ' 38' ' ' THR . 0.8 OUTLIER 21.09 69.85 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.17 0.988 . . . . 0.0 113.164 -179.669 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.567 ' O ' ' HB2' ' A' ' 105' ' ' SER . . . 36.72 46.02 1.09 Allowed Glycine 0 C--O 1.226 -0.391 0 C-N-CA 120.907 -0.664 . . . . 0.0 112.313 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.704 ' HB3' ' OE1' ' A' ' 107' ' ' GLN . 1.3 tp -85.06 -156.93 0.27 Allowed 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.491 HG23 ' HB2' ' A' ' 106' ' ' ASP . 0.2 OUTLIER -155.93 31.67 0.35 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.238 0.542 . . . . 0.0 111.197 179.81 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.537 ' CD1' ' HD2' ' A' ' 53' ' ' LYS . 4.7 mp 54.23 5.17 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.656 179.296 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.457 ' H ' ' C ' ' A' ' 43' ' ' THR . . . -87.8 -22.85 24.28 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.931 0.396 . . . . 0.0 110.672 179.556 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -108.34 -28.06 9.62 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.0 179.846 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 160.12 73.3 0.02 OUTLIER Glycine 0 C--N 1.333 0.398 0 C-N-CA 120.295 -0.955 . . . . 0.0 113.512 179.732 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.463 ' HB2' ' HA ' ' A' ' 44' ' ' ILE . . . -152.53 174.33 14.05 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.836 0.35 . . . . 0.0 111.245 179.136 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -105.52 147.45 28.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.611 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.454 ' HA ' ' CD ' ' A' ' 53' ' ' LYS . 33.1 tt0 -50.34 -39.99 47.81 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.265 0.555 . . . . 0.0 110.861 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.578 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 2.8 p -48.32 -55.17 11.34 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.189 179.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -40.52 -62.46 0.77 Allowed 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 120.794 0.33 . . . . 0.0 111.04 179.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.638 ' HG2' ' N ' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -54.02 -40.11 66.75 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.713 179.513 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.638 ' N ' ' HG2' ' A' ' 53' ' ' LYS . 40.7 t -63.33 -43.37 98.57 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.197 0 CA-C-O 121.192 0.52 . . . . 0.0 110.017 179.76 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.424 ' CG ' ' HB2' ' A' ' 27' ' ' LEU . 0.1 OUTLIER -63.82 -32.91 74.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.334 179.386 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.56 -59.18 3.33 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.035 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -56.48 -37.46 70.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.813 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 7.5 p -64.71 -60.58 2.94 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.74 179.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.51 ' CG2' ' HB2' ' A' ' 116' ' ' LEU . 10.1 p -62.29 -45.01 99.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.78 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.3 tp -56.06 -39.23 71.75 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 120.972 0.415 . . . . 0.0 110.282 179.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 44.1 m -65.24 -59.08 4.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.131 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . 0.437 ' CE1' ' ND2' ' A' ' 2' ' ' ASN . 9.8 m170 -54.52 -42.81 71.27 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 121.186 0.517 . . . . 0.0 110.111 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.584 HG12 HG13 ' A' ' 66' ' ' VAL . 2.7 t -88.52 54.14 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.443 179.368 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.453 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . -84.16 36.94 0.59 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.292 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.453 ' CB ' ' O ' ' A' ' 64' ' ' ALA . 0.8 OUTLIER 156.8 -62.99 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 122.744 0.417 . . . . 0.0 110.825 -179.757 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.584 HG13 HG12 ' A' ' 63' ' ' VAL . 33.3 m 40.73 -147.91 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.983 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.527 ' O ' ' O ' ' A' ' 98' ' ' SER . 4.9 p -149.62 -25.88 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -179.393 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.549 ' HB3' ' HB2' ' A' ' 72' ' ' ASP . 0.6 OUTLIER 32.75 88.94 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.616 0.598 . . . . 0.0 112.616 178.933 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.627 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 0.9 OUTLIER -75.13 -169.77 1.01 Allowed 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.694 -0.403 . . . . 0.0 110.729 179.508 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -40.28 -41.32 1.31 Allowed 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.2 -0.454 . . . . 0.0 112.162 -179.284 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.78 -65.11 0.74 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.086 -179.743 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.549 ' HB2' ' HB3' ' A' ' 68' ' ' LEU . 55.0 m-20 -58.47 -44.8 89.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.249 -179.613 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.512 ' HA ' HD23 ' A' ' 76' ' ' LEU . 0.6 OUTLIER -48.93 -57.98 5.6 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.547 0.689 . . . . 0.0 109.659 178.83 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.67 -27.22 68.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.059 -0.973 . . . . 0.0 108.87 177.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.547 ' HB2' ' HA ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -63.76 -46.57 84.71 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.935 -1.029 . . . . 0.0 109.227 178.436 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.642 HD12 HG13 ' A' ' 115' ' ' VAL . 1.4 mm? -61.06 -59.84 4.71 Favored 'General case' 0 C--N 1.343 0.284 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 178.078 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 73' ' ' THR . 5.9 mt -55.19 -30.87 60.8 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.906 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -64.13 -51.99 61.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.303 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' SER . . . . . 0.434 ' CB ' ' HG2' ' A' ' 111' ' ' GLN . 0.3 OUTLIER -68.31 -26.43 65.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.257 179.851 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.426 ' HB ' ' CE2' ' A' ' 88' ' ' TYR . 0.6 OUTLIER -86.04 -30.34 22.73 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.734 0.302 . . . . 0.0 111.33 -179.519 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 9.6 p -89.34 -20.05 7.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.529 -179.72 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 4.3 ptmt -45.24 -30.16 1.15 Allowed 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.837 0.351 . . . . 0.0 111.304 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -174.53 55.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.913 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 61.13 -168.7 0.17 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.697 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.412 ' CD1' ' N ' ' A' ' 86' ' ' ASN . 2.2 tm? 76.1 141.96 0.07 Allowed 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.197 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.412 ' N ' ' CD1' ' A' ' 85' ' ' LEU . 3.4 p30 -152.91 88.85 1.34 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.647 179.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . 0.401 ' OD1' ' CE1' ' A' ' 88' ' ' TYR . 12.4 p-10 -93.11 -13.7 28.18 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.634 -179.638 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.535 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 0.1 OUTLIER -106.38 153.87 21.61 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.24 0.543 . . . . 0.0 111.118 -179.877 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.652 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.4 OUTLIER -120.12 150.06 41.22 Favored 'General case' 0 N--CA 1.435 -1.177 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -179.208 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.473 ' CD1' ' HG ' ' A' ' 76' ' ' LEU . 49.3 mt -142.21 161.64 37.49 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -177.547 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.455 ' O ' ' OG ' ' A' ' 98' ' ' SER . 0.0 OUTLIER -134.4 133.65 40.78 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 114.334 -1.303 . . . . 0.0 107.9 177.716 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.467 ' O ' ' CG1' ' A' ' 93' ' ' VAL . 90.4 p -104.33 150.41 24.5 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -177.666 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.467 ' CG1' ' O ' ' A' ' 92' ' ' SER . 1.1 m -177.22 -120.03 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-N 113.596 -1.638 . . . . 0.0 108.355 179.529 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.412 ' C ' ' O ' ' A' ' 93' ' ' VAL . . . 28.47 39.4 0.01 OUTLIER Glycine 0 C--N 1.339 0.748 0 N-CA-C 114.928 0.731 . . . . 0.0 114.928 178.262 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . 0.422 ' N ' ' O ' ' A' ' 93' ' ' VAL . 2.5 p-10 38.61 34.11 0.08 Allowed 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 117.528 0.664 . . . . 0.0 111.018 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 135.74 10.35 1.41 Allowed Glycine 0 N--CA 1.449 -0.494 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.973 -179.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.627 ' HA ' ' HA ' ' A' ' 69' ' ' THR . 0.2 OUTLIER -121.7 166.06 14.85 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 120.651 0.263 . . . . 0.0 110.469 179.99 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.527 ' O ' ' O ' ' A' ' 67' ' ' VAL . 4.1 t -139.97 161.19 38.19 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.294 0.569 . . . . 0.0 110.635 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 1.2 t -103.35 150.0 7.08 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.975 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 178.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.536 HD21 ' HG ' ' A' ' 116' ' ' LEU . 0.3 OUTLIER -103.68 114.13 28.16 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -178.105 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.652 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 1.3 p -126.06 103.8 12.12 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.11 0 N-CA-C 103.198 -2.89 . . . . 0.0 103.198 174.108 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.535 ' HB2' ' HA ' ' A' ' 88' ' ' TYR . 8.2 p -143.82 165.24 28.23 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 113.879 1.066 . . . . 0.0 113.879 -174.016 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.507 ' CB ' ' O ' ' A' ' 102' ' ' SER . 0.1 OUTLIER 155.13 -88.13 0.0 OUTLIER 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 113.817 -1.538 . . . . 0.0 112.019 176.589 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.472 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 60.23 21.13 10.52 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 -178.54 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.567 ' HB2' ' O ' ' A' ' 41' ' ' GLY . 4.6 m 144.43 176.32 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 114.471 -1.24 . . . . 0.0 108.104 -179.082 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.608 ' O ' ' NE2' ' A' ' 107' ' ' GLN . 0.3 OUTLIER -104.04 101.17 10.94 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.315 -0.554 . . . . 0.0 111.037 -179.483 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.704 ' OE1' ' HB3' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -168.51 151.35 5.32 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.429 178.665 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.422 ' HB3' ' HB3' ' A' ' 55' ' ' PHE . 0.9 OUTLIER -153.64 147.91 25.87 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.144 0.497 . . . . 0.0 111.613 178.369 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.543 ' HB ' ' CZ ' ' A' ' 39' ' ' PHE . 0.3 OUTLIER -115.28 160.94 19.16 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.229 -179.916 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.474 ' HB3' ' CG2' ' A' ' 16' ' ' VAL . 0.4 OUTLIER -48.91 -60.46 2.74 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.683 0.278 . . . . 0.0 110.444 179.818 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.652 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 3.3 tp60 -45.47 -65.18 0.57 Allowed 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.537 179.586 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.435 ' O ' ' CD2' ' A' ' 116' ' ' LEU . 29.6 m-20 -45.95 -53.13 10.48 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.113 0.482 . . . . 0.0 110.482 179.331 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.419 ' O ' HD13 ' A' ' 117' ' ' LEU . . . -44.81 -63.16 0.97 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.202 179.732 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.762 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -64.41 -27.07 68.75 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.657 -179.756 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.642 HG13 HD12 ' A' ' 76' ' ' LEU . 92.6 t -58.72 -64.96 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.868 0 CA-C-O 122.148 0.975 . . . . 0.0 110.627 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.536 ' HG ' HD21 ' A' ' 100' ' ' LEU . 0.1 OUTLIER -62.95 -40.08 96.57 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 114.512 -1.222 . . . . 0.0 110.04 -179.415 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.468 HD13 ' CG2' ' A' ' 59' ' ' VAL . 0.2 OUTLIER -67.78 -22.26 65.2 Favored 'General case' 0 CA--C 1.511 -0.536 0 O-C-N 123.235 0.335 . . . . 0.0 110.925 179.641 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.55 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 5.5 tp10 -69.03 -51.65 36.91 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 106.345 -1.724 . . . . 0.0 106.345 177.291 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . 0.465 ' HB1' ' HA ' ' A' ' 68' ' ' LEU . . . -73.72 -19.15 60.89 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 114.464 -1.244 . . . . 0.0 110.877 177.858 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.494 ' HB3' ' O ' ' A' ' 116' ' ' LEU . . . -77.59 -59.93 2.58 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.684 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.516 HD21 ' HA ' ' A' ' 118' ' ' GLU . 0.1 OUTLIER -59.82 -30.14 68.72 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.739 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.55 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.9 OUTLIER -68.45 -54.82 14.52 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.33 -179.7 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.86 -30.07 26.74 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -177.142 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . 0.406 ' OE1' ' CD1' ' A' ' 5' ' ' LEU . 2.7 mt-10 -78.05 -66.57 0.83 Allowed 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.222 -0.591 . . . . 0.0 112.366 -178.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.435 ' CB ' ' HB2' ' A' ' 128' ' ' ARG . 0.3 OUTLIER -96.49 -44.66 7.08 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.094 0.474 . . . . 0.0 111.747 -179.086 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 94.13 76.04 1.31 Allowed Glycine 0 CA--C 1.5 -0.845 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.342 -178.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . 48.42 28.87 1.81 Allowed 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -177.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . 0.435 ' HB2' ' CB ' ' A' ' 125' ' ' SER . 0.4 OUTLIER -101.65 -71.67 0.71 Allowed 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.026 -0.988 . . . . 0.0 112.013 -177.936 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . 0.486 ' CA ' ' HB3' ' A' ' 6' ' ' SER . . . 88.7 19.78 50.25 Favored Glycine 0 C--N 1.334 0.42 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.576 -179.541 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 45.5 m . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.884 -179.933 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.082 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 44.1 m-20 60.39 83.31 0.14 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.833 0.349 . . . . 0.0 110.86 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -137.08 174.84 10.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.926 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 204' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.1 -71.03 0.19 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.881 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 206' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -97.58 154.09 38.07 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.911 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . 0.413 ' CB ' ' NE2' ' A' ' 11' ' ' GLN . 13.1 Cg_endo -55.61 -77.25 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.722 2.282 . . . . 0.0 112.423 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 208' ' ' PHE . . . . . 0.497 ' CD1' ' OE1' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -159.26 -17.07 0.06 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.769 0.318 . . . . 0.0 111.352 -179.987 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 209' ' ' NH2 . . . . . 0.454 ' N ' ' CD1' ' B' ' 208' ' ' PHE . . . . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.686 -0.234 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 mtm . . . . . 0 N--CA 1.487 1.385 0 CA-C-O 120.86 0.362 . . . . 0.0 111.169 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 12.8 p-10 -127.19 -154.04 0.61 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.716 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.5 mp -71.39 -79.69 0.07 Allowed 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.941 0.4 . . . . 0.0 110.8 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.467 ' O ' ' HB2' ' A' ' 8' ' ' LEU . 0.4 OUTLIER -165.54 -166.43 0.97 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.963 179.934 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.485 ' O ' ' CD2' ' A' ' 117' ' ' LEU . 0.4 OUTLIER -95.68 -66.36 0.91 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 122.013 0.911 . . . . 0.0 111.6 -179.949 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.405 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 1.3 p -63.97 -38.36 90.8 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.46 -1.246 . . . . 0.0 112.337 -178.16 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.97 -34.12 64.13 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.517 -0.473 . . . . 0.0 109.919 179.324 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.467 ' HB2' ' O ' ' A' ' 4' ' ' SER . 13.5 tp -66.98 -49.7 64.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.947 179.24 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.485 ' CG ' ' CD2' ' A' ' 121' ' ' LEU . 56.5 t-80 -61.09 -46.11 91.98 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.969 178.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.42 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 5.0 mtp180 -56.73 -42.36 79.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.857 179.367 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.602 ' HA ' ' CZ ' ' B' ' 208' ' ' PHE . 5.4 tp-100 -67.13 -65.65 0.66 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.834 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.469 ' HA ' ' CD1' ' A' ' 15' ' ' LEU . 14.4 p -52.29 -46.93 46.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 121.071 0.462 . . . . 0.0 111.204 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.705 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 41.0 m -64.28 -37.88 89.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.802 -179.467 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.42 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 3.7 mmt180 -69.0 -30.7 69.15 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.513 -179.573 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.501 ' CD1' HG21 ' A' ' 31' ' ' VAL . 2.4 mt -72.67 -62.11 1.56 Allowed 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.671 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.752 ' CG2' ' HB3' ' A' ' 110' ' ' LEU . 56.3 t -57.7 -53.61 42.44 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.471 0 CA-C-O 121.217 0.532 . . . . 0.0 111.425 -179.489 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -62.55 -7.35 4.52 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.539 -178.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -150.12 37.15 0.69 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 120.953 -0.299 . . . . 0.0 111.699 179.266 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.491 ' N ' ' O ' ' A' ' 15' ' ' LEU . 1.4 mt-10 168.33 -66.79 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.607 ' HB3' ' CD1' ' A' ' 110' ' ' LEU . 0.8 OUTLIER -76.29 80.09 3.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.669 -177.669 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -66.64 73.5 0.16 Allowed Glycine 0 C--N 1.311 -0.843 0 CA-C-N 114.937 -1.029 . . . . 0.0 112.759 179.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.8 t70 75.94 22.09 1.49 Allowed 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 179.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.472 ' HB2' ' HB3' ' A' ' 20' ' ' SER . 96.4 m -70.21 -165.79 0.11 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 179.329 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.599 ' O ' HD11 ' A' ' 110' ' ' LEU . 0.2 OUTLIER -104.39 163.42 12.45 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.818 0.342 . . . . 0.0 110.506 179.692 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -104.28 131.2 10.54 Favored Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.131 -1.033 . . . . 0.0 113.344 -179.229 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.551 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 0.0 OUTLIER -104.42 110.75 23.13 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.927 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.0 tt -104.0 139.47 39.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.474 0.654 . . . . 0.0 112.231 -178.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 165.08 51.71 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.109 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.447 ' HA3' ' O ' ' B' ' 202' ' ' ASP . . . 94.02 -5.53 72.22 Favored Glycine 0 CA--C 1.519 0.287 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.402 -178.259 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.435 ' C ' ' ND2' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -165.55 151.98 9.86 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.818 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.568 HG21 ' HG3' ' A' ' 11' ' ' GLN . 1.5 m -104.81 123.91 59.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.469 179.19 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -114.02 166.34 11.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.211 -178.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.412 ' HB3' ' HB3' ' A' ' 20' ' ' SER . . . -103.29 105.97 16.38 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.22 0.533 . . . . 0.0 111.25 -179.628 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.446 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 0.8 OUTLIER -85.11 124.57 31.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.559 -179.884 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -125.08 28.19 6.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.923 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -110.39 -39.35 4.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.795 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.474 ' HB ' ' CD2' ' A' ' 39' ' ' PHE . 0.8 OUTLIER -104.96 -53.46 2.66 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.115 -179.963 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.6 p 60.58 96.13 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.351 0.596 . . . . 0.0 109.627 -179.269 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.592 ' CG ' ' OE1' ' A' ' 107' ' ' GLN . 18.7 m-85 -133.13 -177.52 4.55 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 113.745 1.017 . . . . 0.0 113.745 -177.793 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.426 ' N ' ' CD ' ' A' ' 40' ' ' GLN . 0.0 OUTLIER -149.75 -56.31 0.18 Allowed 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 114.838 -1.074 . . . . 0.0 110.703 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.511 ' HA3' ' CB ' ' A' ' 87' ' ' ASN . . . -150.66 101.27 0.21 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.495 -0.86 . . . . 0.0 112.911 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.516 HD22 ' OE1' ' A' ' 107' ' ' GLN . 0.1 OUTLIER -156.74 172.84 17.9 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.787 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.482 ' C ' ' H ' ' A' ' 45' ' ' ALA . 0.2 OUTLIER -108.67 40.9 1.69 Allowed 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -176.946 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.44 ' N ' HD12 ' A' ' 42' ' ' LEU . 3.3 mt 55.1 0.89 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 179.299 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.482 ' H ' ' C ' ' A' ' 43' ' ' THR . . . -68.83 -35.92 77.56 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.204 0.526 . . . . 0.0 109.974 179.541 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 6.6 t -74.96 -59.77 2.59 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.393 179.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 173.5 31.75 0.03 OUTLIER Glycine 0 CA--C 1.52 0.36 0 C-N-CA 120.638 -0.792 . . . . 0.0 113.246 179.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.504 ' CB ' ' OE1' ' A' ' 107' ' ' GLN . . . -67.67 -167.42 0.07 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.268 0.556 . . . . 0.0 111.535 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 17.0 mmm180 -145.67 143.4 29.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.937 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.402 ' O ' ' CG2' ' A' ' 54' ' ' VAL . 4.6 mp0 -45.06 -31.49 1.37 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.884 0.373 . . . . 0.0 111.381 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.435 ' CB ' ' HG2' ' A' ' 26' ' ' LYS . 0.4 OUTLIER -60.49 -61.49 2.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.253 -179.936 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.415 ' HG2' ' CG2' ' A' ' 24' ' ' THR . 54.1 mt-10 -48.88 -65.35 0.58 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.122 0.487 . . . . 0.0 110.957 -179.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.5 ' HG2' ' N ' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -45.01 -57.59 3.74 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.345 179.72 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.5 ' N ' ' HG2' ' A' ' 53' ' ' LYS . 78.2 t -52.58 -35.25 20.45 Favored 'Isoleucine or valine' 0 C--O 1.232 0.133 0 CA-C-O 120.945 0.402 . . . . 0.0 110.534 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.557 ' HB3' ' HB3' ' A' ' 108' ' ' MET . 0.2 OUTLIER -65.35 -47.31 76.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.306 179.462 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -55.6 -49.2 73.43 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-O 120.982 0.42 . . . . 0.0 110.59 179.339 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -59.98 -45.57 92.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.816 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 82.0 p -66.97 -52.83 37.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.804 -179.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.609 ' HA ' ' CE1' ' A' ' 62' ' ' HIS . 13.4 p -56.2 -46.49 81.29 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-O 120.828 0.347 . . . . 0.0 111.267 -179.189 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.1 tp -67.62 -36.85 81.59 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.533 179.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 33.3 m -61.44 -65.23 0.72 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.123 -0.49 . . . . 0.0 112.036 -179.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . 0.609 ' CE1' ' HA ' ' A' ' 59' ' ' VAL . 9.7 p-80 -50.09 -44.99 52.2 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.019 0.438 . . . . 0.0 110.365 -179.726 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.606 HG11 HG12 ' A' ' 66' ' ' VAL . 16.8 t -63.79 -66.63 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.776 178.552 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.503 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 37.82 36.17 0.09 Allowed 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.541 178.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.503 ' CB ' ' O ' ' A' ' 64' ' ' ALA . 11.2 t-20 154.97 -80.44 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 122.479 0.311 . . . . 0.0 110.979 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.616 HG13 ' HA ' ' A' ' 120' ' ' ALA . 17.0 m 45.38 -154.41 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.546 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.603 ' CG1' ' O ' ' A' ' 67' ' ' VAL . 3.2 p -163.98 69.34 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.334 -0.084 0 CA-C-O 121.869 0.842 . . . . 0.0 111.4 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.551 ' HB3' ' HB2' ' A' ' 72' ' ' ASP . 1.0 OUTLIER -53.39 107.0 0.2 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.12 -0.945 . . . . 0.0 112.32 -179.904 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.695 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 74.1 p -71.14 -176.83 1.52 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 0.0 109.778 178.767 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.402 ' HA ' ' OG1' ' A' ' 73' ' ' THR . 0.0 OUTLIER -46.08 -34.59 4.26 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.159 0.504 . . . . 0.0 111.115 -179.786 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.83 -65.05 0.75 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.793 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.579 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 43.9 m-20 -55.21 -29.45 57.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.971 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.406 ' CG2' ' HB3' ' A' ' 98' ' ' SER . 1.5 p -65.65 -60.95 2.38 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 178.443 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.73 -25.97 55.92 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 177.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.579 ' HB2' ' HA ' ' A' ' 72' ' ' ASP . 0.1 OUTLIER -57.71 -65.07 0.7 Allowed 'General case' 0 C--O 1.234 0.262 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.564 178.922 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.406 HD12 HD22 ' A' ' 68' ' ' LEU . 0.4 OUTLIER -59.01 -38.96 80.44 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 121.2 0.524 . . . . 0.0 109.87 179.085 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -52.25 -44.37 64.85 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.617 179.766 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -72.31 -58.24 3.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.887 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -56.53 -23.93 43.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.491 -179.822 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 51.1 m -95.12 -57.61 2.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.772 0.32 . . . . 0.0 111.63 -179.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 48.9 t -64.51 -14.22 15.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.972 -179.379 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 25.6 tttm -56.33 -40.47 74.48 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.617 0.246 . . . . 0.0 111.149 -179.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 68.2 t60 -80.32 -85.9 0.09 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.175 -179.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 44.5 t30 179.38 -73.69 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.813 0.339 . . . . 0.0 110.992 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.77 -171.33 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.067 -179.778 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -117.11 139.66 50.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.057 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . 0.529 ' HA ' ' HB2' ' A' ' 104' ' ' ARG . 11.5 p-10 -133.37 -47.71 0.83 Allowed 'General case' 0 C--O 1.244 0.772 0 CA-C-O 121.585 0.707 . . . . 0.0 110.496 179.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.618 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 3.1 m-85 -108.83 138.35 45.29 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.53 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.649 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.1 OUTLIER -104.64 150.49 24.65 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.444 -178.437 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.441 ' N ' ' OD1' ' A' ' 89' ' ' ASP . 12.5 mt -138.53 144.65 40.03 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -178.013 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -132.88 114.53 14.17 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 178.178 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.53 ' HA ' ' CB ' ' A' ' 98' ' ' SER . 1.6 m -104.24 146.25 29.05 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 113.739 1.015 . . . . 0.0 113.739 -177.043 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.541 ' O ' ' O ' ' A' ' 94' ' ' GLY . 12.7 m -158.34 -130.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 CA-C-N 114.107 -1.406 . . . . 0.0 108.753 179.163 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.541 ' O ' ' O ' ' A' ' 93' ' ' VAL . . . 52.02 163.49 0.01 OUTLIER Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 119.957 -1.116 . . . . 0.0 112.587 178.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -54.07 -25.65 22.83 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 177.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -173.29 43.76 0.16 Allowed Glycine 0 N--CA 1.441 -1.024 0 CA-C-N 114.102 -1.408 . . . . 0.0 109.948 178.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.695 ' HA ' ' HA ' ' A' ' 69' ' ' THR . 0.0 OUTLIER -133.61 166.21 23.11 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-O 121.281 0.563 . . . . 0.0 111.422 -179.129 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.53 ' CB ' ' HA ' ' A' ' 92' ' ' SER . 39.9 t -146.28 165.12 30.19 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.472 -179.165 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 2.3 t -116.07 152.9 17.73 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.541 179.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.438 ' CD2' HG12 ' A' ' 63' ' ' VAL . 0.0 OUTLIER -104.69 126.39 51.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.7 0.762 . . . . 0.0 112.447 -179.586 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.649 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -130.71 110.67 18.9 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 N-CA-C 104.976 -2.231 . . . . 0.0 104.976 175.955 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.759 ' O ' ' HB2' ' A' ' 103' ' ' LEU . 17.8 p -153.14 165.33 35.97 Favored 'General case' 0 C--N 1.309 -1.169 0 C-N-CA 118.401 -1.32 . . . . 0.0 114.544 -174.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.759 ' HB2' ' O ' ' A' ' 102' ' ' SER . 0.8 OUTLIER 136.21 74.72 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 113.21 -1.814 . . . . 0.0 112.457 176.05 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.529 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -108.51 29.02 7.78 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 177.464 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.508 ' HB3' ' N ' ' A' ' 42' ' ' LEU . 2.8 m 153.35 163.49 0.01 OUTLIER 'General case' 0 C--O 1.231 0.117 0 CA-C-N 114.188 -1.369 . . . . 0.0 107.509 -178.489 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.446 ' O ' ' HG3' ' A' ' 107' ' ' GLN . 0.8 OUTLIER -104.79 100.98 10.61 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.977 -179.159 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.592 ' OE1' ' CG ' ' A' ' 39' ' ' PHE . 4.1 mt-30 -169.17 163.35 10.99 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.708 177.656 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.557 ' HB3' ' HB3' ' A' ' 55' ' ' PHE . 1.0 OUTLIER -165.93 135.23 3.25 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.293 0.568 . . . . 0.0 112.126 178.293 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.504 ' HA ' ' HA ' ' A' ' 24' ' ' THR . 0.4 OUTLIER -103.13 160.93 14.21 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.004 178.608 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.752 ' HB3' ' CG2' ' A' ' 16' ' ' VAL . 4.0 mt -45.77 -54.71 7.53 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -178.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.578 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 0.1 OUTLIER -48.31 -65.45 0.57 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.747 0.308 . . . . 0.0 111.04 -179.928 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.484 ' O ' ' HB ' ' A' ' 115' ' ' VAL . 1.6 m-20 -47.2 -46.02 23.62 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.247 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -52.08 -60.54 3.08 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.648 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.705 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -65.34 -22.53 66.83 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.993 179.745 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.566 ' CG2' ' CG ' ' A' ' 75' ' ' LYS . 53.0 t -61.51 -61.95 1.35 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.876 0 CA-C-O 121.894 0.854 . . . . 0.0 109.973 179.556 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.488 ' HB3' ' CG2' ' A' ' 63' ' ' VAL . 9.1 mp -61.83 -39.48 91.97 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.595 179.653 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.559 ' HG ' ' NE2' ' A' ' 62' ' ' HIS . 0.1 OUTLIER -68.05 -23.17 64.93 Favored 'General case' 0 CA--C 1.507 -0.685 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.677 179.265 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.676 ' HA ' HD22 ' A' ' 121' ' ' LEU . 9.3 tp10 -66.62 -54.95 17.83 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 106.271 -1.751 . . . . 0.0 106.271 177.114 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -67.99 -20.13 64.99 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.497 177.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.616 ' HA ' HG13 ' A' ' 66' ' ' VAL . . . -77.04 -64.49 1.12 Allowed 'General case' 0 CA--C 1.509 -0.627 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.717 179.802 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.676 HD22 ' HA ' ' A' ' 118' ' ' GLU . 0.2 OUTLIER -60.63 -21.76 63.06 Favored 'General case' 0 N--CA 1.444 -0.74 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.63 179.416 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.534 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 14.6 ttm-85 -73.9 -57.35 4.04 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.904 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.454 ' HG3' HG13 ' A' ' 67' ' ' VAL . 0.8 OUTLIER -94.37 -21.18 19.12 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -177.395 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -86.42 -66.58 0.89 Allowed 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -178.091 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -96.22 -60.35 1.64 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -178.665 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . 0.484 ' N ' ' O ' ' A' ' 121' ' ' LEU . . . 93.47 73.49 1.22 Allowed Glycine 0 CA--C 1.5 -0.869 0 N-CA-C 110.783 -0.927 . . . . 0.0 110.783 -178.19 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . 51.48 26.6 3.29 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 -177.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.87 -70.76 0.7 Allowed 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.55 -178.231 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 106.6 24.93 6.48 Favored Glycine 0 C--N 1.332 0.343 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.47 -179.687 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 16.8 t . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.887 179.981 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.088 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 202' ' ' ASP . . . . . 0.447 ' O ' ' HA3' ' A' ' 29' ' ' GLY . 0.3 OUTLIER 69.22 -79.32 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.732 0.301 . . . . 0.0 111.061 . . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 69.59 -65.87 0.29 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.835 0.35 . . . . 0.0 110.99 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 204' ' ' PTR . . . . . 0.406 ' N ' ' HD1' ' B' ' 204' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 42.53 -91.6 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.749 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 206' ' ' ASP . . . . . 0.405 ' N ' ' O ' ' B' ' 204' ' ' PTR . 0.9 OUTLIER -168.98 165.87 6.62 Favored Pre-proline 0 C--N 1.332 -0.165 0 CA-C-O 120.613 0.244 . . . . 0.0 110.808 -179.827 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . 0.421 ' O ' ' HB2' ' B' ' 208' ' ' PHE . 12.7 Cg_endo -56.18 139.38 85.67 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.545 2.164 . . . . 0.0 112.336 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 208' ' ' PHE . . . . . 0.602 ' CZ ' ' HA ' ' A' ' 11' ' ' GLN . 46.2 m-85 67.2 106.82 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.681 -179.753 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.37 0 CA-C-N 116.544 -0.298 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.993 0.425 . . . . 0.0 111.177 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.403 ' OD1' ' CE1' ' A' ' 62' ' ' HIS . 3.7 p-10 -130.36 -157.66 0.84 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.712 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.4 mp -84.95 -80.47 0.21 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.857 0.361 . . . . 0.0 111.054 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.428 ' O ' ' CB ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER 171.3 154.33 0.07 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.884 -179.89 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.469 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 30.1 mt -49.17 -65.12 0.62 Allowed 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 121.205 0.526 . . . . 0.0 111.936 -179.392 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.2 t -42.4 -56.76 2.87 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.225 -0.898 . . . . 0.0 112.516 -178.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.86 -56.16 5.61 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.663 0.268 . . . . 0.0 111.055 -179.517 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.428 ' CB ' ' O ' ' A' ' 4' ' ' SER . 15.8 tp -45.52 -55.01 6.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.106 0.479 . . . . 0.0 110.218 179.317 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.497 ' CG ' ' CD2' ' A' ' 121' ' ' LEU . 51.5 t-80 -59.62 -47.76 84.33 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.532 178.564 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.477 ' HB3' ' CZ ' ' B' ' 208' ' ' PHE . 9.2 mmt-85 -49.99 -45.63 51.84 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.512 179.607 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.436 ' CG ' HG22 ' A' ' 31' ' ' VAL . 0.2 OUTLIER -64.68 -65.51 0.66 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.517 179.98 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.444 ' N ' HG23 ' A' ' 31' ' ' VAL . 12.5 p -57.92 -48.17 84.62 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.768 -179.242 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.739 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 39.6 p -58.24 -53.55 57.03 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.098 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.44 ' HD2' ' CE1' ' B' ' 208' ' ' PHE . 8.9 ttm-85 -65.1 -23.81 67.25 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.831 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.407 ' CD1' HG22 ' A' ' 31' ' ' VAL . 7.5 mt -69.94 -61.73 1.66 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.806 0.336 . . . . 0.0 111.46 -179.727 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.575 ' HA ' ' H ' ' A' ' 21' ' ' GLY . 1.2 t -71.41 -27.74 29.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.035 -179.609 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.413 ' CG ' ' O ' ' A' ' 13' ' ' SER . 9.5 mm-40 -72.57 -20.2 61.36 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.727 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.432 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 7.1 pt20 -162.42 57.43 0.23 Allowed 'General case' 0 CA--C 1.527 0.087 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.539 179.516 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 178.64 -60.71 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.159 0 N-CA-C 111.86 0.319 . . . . 0.0 111.86 179.614 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.46 ' HB2' ' HA ' ' A' ' 16' ' ' VAL . 70.2 m -85.89 -78.86 0.26 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.878 0.371 . . . . 0.0 111.514 -179.069 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.575 ' H ' ' HA ' ' A' ' 16' ' ' VAL . . . 123.3 -28.47 5.55 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 121.1 -0.571 . . . . 0.0 112.722 -179.752 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.475 ' HB3' ' O ' ' A' ' 21' ' ' GLY . 0.0 OUTLIER 167.43 6.08 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.801 0.301 . . . . 0.0 111.61 179.958 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.452 ' O ' ' O ' ' A' ' 22' ' ' ASP . 62.9 m -51.76 -164.75 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.083 0.468 . . . . 0.0 111.535 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.598 ' HA ' ' HA ' ' A' ' 109' ' ' THR . 12.5 m -103.61 155.53 18.48 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.556 ' CA ' HD22 ' A' ' 110' ' ' LEU . . . -106.02 129.05 9.6 Favored Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.249 -0.976 . . . . 0.0 113.878 -178.183 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.55 ' HB2' ' CB ' ' A' ' 51' ' ' SER . 0.0 OUTLIER -109.87 123.62 49.91 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.504 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 9.9 tt -107.61 154.5 21.34 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.156 0.503 . . . . 0.0 111.739 -178.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 161.5 52.08 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.067 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 96.32 -9.44 67.23 Favored Glycine 0 N--CA 1.452 -0.286 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -178.024 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -165.77 165.04 18.75 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 179.665 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.444 HG23 ' N ' ' A' ' 12' ' ' VAL . 1.5 m -112.69 138.24 42.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 C-N-CA 120.359 -0.536 . . . . 0.0 110.979 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.465 ' CB ' ' HG3' ' A' ' 26' ' ' LYS . . . -130.42 165.85 21.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.544 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.442 ' CB ' ' OG ' ' A' ' 20' ' ' SER . . . -103.49 115.09 29.88 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.137 0.494 . . . . 0.0 111.574 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.518 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 0.8 OUTLIER -90.93 119.56 31.22 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.184 179.786 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.27 -22.42 10.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.019 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.423 ' CG ' ' N ' ' A' ' 37' ' ' THR . 2.2 pt-20 -55.37 -48.52 74.16 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.854 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.423 ' N ' ' CG ' ' A' ' 36' ' ' GLU . 8.9 p -103.33 -161.24 0.82 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.411 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 58.7 p -132.83 -35.99 1.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -179.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.621 ' HB2' ' NE2' ' A' ' 107' ' ' GLN . 0.0 OUTLIER 74.25 172.82 0.28 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.828 0.347 . . . . 0.0 110.236 -179.356 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.56 ' N ' ' CG ' ' A' ' 39' ' ' PHE . 0.2 OUTLIER 169.36 37.52 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.122 179.708 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.639 ' C ' ' HB2' ' A' ' 107' ' ' GLN . . . 82.66 -22.05 6.93 Favored Glycine 0 CA--C 1.519 0.313 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.15 -179.141 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.497 ' HB3' ' OE1' ' A' ' 107' ' ' GLN . 12.6 tp -24.17 138.68 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.257 0.623 . . . . 0.0 112.186 179.195 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 12.8 m -91.58 26.56 2.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.795 -179.42 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.562 HD13 ' HG2' ' A' ' 53' ' ' LYS . 4.4 mm 71.69 3.18 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 179.537 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -74.05 -26.88 60.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.768 0.318 . . . . 0.0 111.113 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -95.33 -40.52 9.49 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.074 -179.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.79 38.45 0.03 OUTLIER Glycine 0 CA--C 1.519 0.318 0 C-N-CA 120.394 -0.908 . . . . 0.0 113.353 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.421 ' CB ' ' CD1' ' A' ' 44' ' ' ILE . . . -81.98 159.19 23.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.936 0.368 . . . . 0.0 110.624 179.483 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.421 ' HB3' ' HG2' ' A' ' 52' ' ' GLU . 0.0 OUTLIER -80.2 130.61 35.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.695 179.902 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.663 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 4.7 mp0 -52.76 -25.66 11.92 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.075 0.464 . . . . 0.0 110.868 179.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.55 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 92.8 p -69.55 -48.65 59.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.026 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.445 ' H ' ' HG2' ' A' ' 52' ' ' GLU . 0.0 OUTLIER -55.28 -56.99 13.69 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 179.15 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.663 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -52.06 -58.78 5.53 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.667 179.654 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.529 ' H ' ' HG3' ' A' ' 53' ' ' LYS . 16.0 m -52.73 -45.86 49.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 CA-C-O 121.17 0.509 . . . . 0.0 110.401 179.726 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.455 ' CE2' ' HB2' ' A' ' 113' ' ' ALA . 0.9 OUTLIER -51.42 -46.86 63.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.363 179.237 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.05 -46.65 87.71 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.13 179.168 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 -57.93 -40.58 80.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.417 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 89.2 m -68.4 -58.57 4.15 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.212 179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.5 HG21 ' HB2' ' A' ' 116' ' ' LEU . 7.2 p -55.92 -42.45 71.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.021 -179.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.417 ' CD2' ' HG ' ' A' ' 103' ' ' LEU . 4.9 tp -64.41 -45.2 88.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.553 179.725 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 72.3 m -57.08 -61.2 2.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.872 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . 0.403 ' CE1' ' OD1' ' A' ' 2' ' ' ASN . 0.3 OUTLIER -49.85 -40.03 40.96 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.009 0.433 . . . . 0.0 110.211 179.572 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.581 HG11 HG11 ' A' ' 66' ' ' VAL . 56.1 t -71.47 -80.39 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.648 178.742 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.415 ' O ' ' HB2' ' A' ' 65' ' ' ASN . . . 67.12 -6.11 0.62 Allowed 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 178.298 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.415 ' HB2' ' O ' ' A' ' 64' ' ' ALA . 2.6 t-20 175.35 -56.2 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 120.806 0.336 . . . . 0.0 110.172 -179.587 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.689 HG12 ' HA ' ' A' ' 120' ' ' ALA . 27.7 m 42.94 -157.68 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.326 178.99 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.632 ' CG1' ' O ' ' A' ' 67' ' ' VAL . 0.5 OUTLIER -161.53 89.66 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 CA-C-O 122.088 0.947 . . . . 0.0 108.708 179.531 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.581 ' HB3' ' CB ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -89.99 112.64 24.12 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.812 -1.085 . . . . 0.0 113.007 -177.34 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.489 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 9.2 p -62.63 174.95 0.88 Allowed 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.34 -0.845 . . . . 0.0 109.389 178.248 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -43.8 -30.34 0.65 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.869 0.366 . . . . 0.0 111.445 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.405 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 0.2 OUTLIER -63.04 -65.31 0.71 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.138 -179.909 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.598 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 60.1 m-20 -62.25 -28.95 70.06 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.42 -179.644 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -61.34 -60.32 3.91 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 179.047 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.469 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . . . -58.87 -28.16 65.87 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.487 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.598 ' HB2' ' HA ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -56.08 -52.49 64.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.601 -1.181 . . . . 0.0 110.154 178.513 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.482 ' CD2' HD11 ' A' ' 116' ' ' LEU . 0.5 OUTLIER -67.01 -54.19 24.07 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.308 179.089 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.469 ' CD2' ' HA ' ' A' ' 74' ' ' ALA . 0.4 OUTLIER -54.83 -24.76 24.47 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.4 -179.901 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -75.65 -63.66 1.25 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.399 179.096 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' SER . . . . . 0.422 ' CB ' ' HG2' ' A' ' 111' ' ' GLN . 0.0 OUTLIER -56.54 -23.09 37.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.498 179.985 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 2.0 m -95.1 -59.45 1.9 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -179.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 10.3 t -71.44 -7.05 8.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -179.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.07 -75.66 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.839 0.352 . . . . 0.0 111.031 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 -103.94 45.93 0.94 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.861 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 57.7 101.03 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.681 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.411 ' CD1' ' HA ' ' A' ' 40' ' ' GLN . 1.6 tt -147.18 151.29 36.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.953 0.406 . . . . 0.0 111.054 -179.872 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -146.92 66.69 1.16 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.326 179.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -116.6 -33.83 4.74 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.907 -179.475 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.559 ' CD2' ' CB ' ' A' ' 102' ' ' SER . 5.2 m-85 -107.37 140.56 40.1 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 120.62 -0.432 . . . . 0.0 111.438 -179.453 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.61 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.7 OUTLIER -108.92 145.36 35.53 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 -179.593 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.437 ' N ' ' OD1' ' A' ' 89' ' ' ASP . 6.2 mt -132.67 148.39 52.35 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 -177.254 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.451 ' O ' ' O ' ' A' ' 99' ' ' VAL . 5.1 ttp180 -146.36 105.04 3.84 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 105.715 -1.957 . . . . 0.0 105.715 177.363 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.693 ' HB2' ' HB3' ' A' ' 98' ' ' SER . 0.1 OUTLIER -103.37 165.4 11.05 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 116.22 1.933 . . . . 0.0 116.22 -174.041 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.525 ' HB ' HD21 ' A' ' 97' ' ' ASN . 0.2 OUTLIER -121.64 43.52 0.63 Allowed 'Isoleucine or valine' 0 C--O 1.242 0.705 0 CA-C-N 111.48 -2.6 . . . . 0.0 106.863 177.67 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -24.63 147.6 0.01 OUTLIER Glycine 0 N--CA 1.435 -1.431 0 CA-C-N 111.584 -2.553 . . . . 0.0 114.824 -177.101 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 74.94 30.99 0.89 Allowed 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 113.561 -1.319 . . . . 0.0 110.762 179.772 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 163.88 -38.85 0.32 Allowed Glycine 0 N--CA 1.444 -0.772 0 C-N-CA 120.117 -1.04 . . . . 0.0 113.604 179.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.525 HD21 ' HB ' ' A' ' 93' ' ' VAL . 0.0 OUTLIER -163.95 168.21 19.61 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 117.767 0.784 . . . . 0.0 111.877 -178.208 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.693 ' HB3' ' HB2' ' A' ' 92' ' ' SER . 3.7 m -153.96 141.33 19.66 Favored 'General case' 0 N--CA 1.436 -1.173 0 CA-C-N 114.987 -1.006 . . . . 0.0 109.633 178.772 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.451 ' O ' ' O ' ' A' ' 91' ' ' ARG . 76.4 t -104.99 123.04 58.84 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.143 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.499 -179.516 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.513 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 0.0 OUTLIER -102.91 133.33 48.18 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 122.094 0.949 . . . . 0.0 112.821 -178.028 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.61 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 0.2 OUTLIER -127.26 117.22 46.63 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 N-CA-C 104.943 -2.243 . . . . 0.0 104.943 176.829 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.757 ' O ' ' HB2' ' A' ' 103' ' ' LEU . 0.1 OUTLIER -146.36 165.15 30.19 Favored 'General case' 0 C--N 1.307 -1.267 0 C-N-CA 118.589 -1.244 . . . . 0.0 114.205 -174.91 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.757 ' HB2' ' O ' ' A' ' 102' ' ' SER . 0.6 OUTLIER 126.13 72.41 0.0 OUTLIER 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 112.816 -1.993 . . . . 0.0 112.759 176.11 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -89.3 -5.28 57.69 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.714 -1.13 . . . . 0.0 108.171 176.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' A' ' 41' ' ' GLY . 70.1 m -175.79 172.94 2.42 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 113.891 -1.504 . . . . 0.0 107.405 179.299 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.417 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.4 OUTLIER -104.77 102.4 11.97 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 119.581 -0.848 . . . . 0.0 112.326 -178.982 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.639 ' HB2' ' C ' ' A' ' 41' ' ' GLY . 2.2 mt-30 -168.49 165.22 12.57 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.394 178.393 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.529 ' CE ' ' CD2' ' A' ' 116' ' ' LEU . 4.1 tpt -162.04 149.87 14.54 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 179.333 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.598 ' HA ' ' HA ' ' A' ' 24' ' ' THR . 0.7 OUTLIER -116.88 165.21 13.58 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.98 178.732 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.556 HD22 ' CA ' ' A' ' 25' ' ' GLY . 0.0 OUTLIER -51.73 -59.09 4.69 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 120.837 0.351 . . . . 0.0 110.323 179.513 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.62 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 2.7 tp60 -48.59 -65.54 0.55 Allowed 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.726 179.743 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.473 ' HB3' ' HE3' ' A' ' 108' ' ' MET . 4.0 t0 -41.95 -54.1 3.6 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-O 121.317 0.579 . . . . 0.0 111.212 179.697 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.455 ' HB2' ' CE2' ' A' ' 55' ' ' PHE . . . -47.98 -64.17 0.87 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.219 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.739 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -60.71 -25.31 66.33 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.956 -0.297 . . . . 0.0 111.253 -179.673 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.541 ' CG2' ' CG ' ' A' ' 75' ' ' LYS . 89.7 t -60.57 -65.49 0.47 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.819 0 CA-C-O 121.58 0.705 . . . . 0.0 110.996 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.529 ' CD2' ' CE ' ' A' ' 108' ' ' MET . 0.1 OUTLIER -65.26 -37.41 87.13 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.368 -179.402 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.469 ' CD2' ' HA ' ' A' ' 5' ' ' LEU . 0.1 OUTLIER -67.59 -24.6 65.52 Favored 'General case' 0 CA--C 1.508 -0.669 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.397 179.422 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.475 ' O ' ' CB ' ' A' ' 122' ' ' ARG . 1.1 tp10 -67.65 -50.38 58.21 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 177.097 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . 0.456 ' CB ' HD21 ' A' ' 68' ' ' LEU . . . -69.62 -24.21 63.62 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.507 -1.224 . . . . 0.0 110.376 177.242 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.689 ' HA ' HG12 ' A' ' 66' ' ' VAL . . . -75.69 -65.34 0.91 Allowed 'General case' 0 CA--C 1.51 -0.588 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.711 -179.692 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.498 ' O ' ' N ' ' A' ' 126' ' ' GLY . 0.1 OUTLIER -56.16 -31.72 63.63 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.115 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.475 ' CB ' ' O ' ' A' ' 118' ' ' GLU . 2.3 ttt85 -66.95 -48.8 67.45 Favored 'General case' 0 CA--C 1.528 0.102 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.597 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.563 ' HG3' ' CG1' ' A' ' 67' ' ' VAL . 0.0 OUTLIER -89.24 -19.1 25.8 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -177.658 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . 0.423 ' HB2' ' CD1' ' A' ' 5' ' ' LEU . 3.5 mm-40 -95.35 -66.51 0.91 Allowed 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -178.541 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.408 ' CB ' ' N ' ' A' ' 129' ' ' GLY . 0.3 OUTLIER -96.23 -65.46 0.97 Allowed 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -178.501 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . 0.503 ' O ' ' CB ' ' A' ' 127' ' ' ALA . . . 97.96 70.32 0.99 Allowed Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 -178.133 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.503 ' CB ' ' O ' ' A' ' 126' ' ' GLY . . . 92.72 -27.47 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.134 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 -177.616 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . 0.475 ' CB ' ' O ' ' A' ' 127' ' ' ALA . 1.1 tmt_? 151.41 120.92 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.414 178.614 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . 0.408 ' N ' ' CB ' ' A' ' 125' ' ' SER . . . 163.59 48.18 0.02 OUTLIER Glycine 0 C--N 1.32 -0.354 0 CA-C-N 115.3 -0.864 . . . . 0.0 112.645 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.196 -0.907 . . . . 0.0 110.953 -179.964 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.131 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -128.11 147.7 50.55 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.769 0.318 . . . . 0.0 110.914 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -134.36 -174.95 3.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.737 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 204' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 1.3 t0 50.54 -170.02 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.535 179.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 206' ' ' ASP . . . . . 0.468 ' CB ' ' HD2' ' B' ' 207' ' ' PRO . 0.2 OUTLIER -80.05 168.81 23.16 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.825 -179.927 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . 0.468 ' HD2' ' CB ' ' B' ' 206' ' ' ASP . 4.7 Cg_endo -46.9 156.81 0.62 Allowed 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.884 2.389 . . . . 0.0 112.522 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 208' ' ' PHE . . . . . 0.477 ' CZ ' ' HB3' ' A' ' 10' ' ' ARG . 29.3 m-85 46.48 -92.88 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.359 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.705 -0.225 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.471 0 CA-C-O 120.783 0.325 . . . . 0.0 110.988 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.439 ' HB3' ' CG2' ' A' ' 58' ' ' THR . 6.6 p30 44.87 -162.86 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.714 179.697 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.431 HD13 ' CB ' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -88.51 -95.69 0.1 Allowed 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.187 -179.846 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.5 ' O ' ' HB2' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -166.45 146.39 5.98 Favored 'General case' 0 CA--C 1.527 0.082 0 CA-C-O 120.608 0.242 . . . . 0.0 110.349 -179.893 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.44 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 19.5 mt -45.87 -65.06 0.6 Allowed 'General case' 0 CA--C 1.51 -0.57 0 CA-C-O 121.018 0.437 . . . . 0.0 111.913 -179.444 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -41.71 -62.05 0.97 Allowed 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.625 -178.327 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -59.79 -47.06 87.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.842 179.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.566 ' HB3' ' CD2' ' A' ' 117' ' ' LEU . 0.1 OUTLIER -54.81 -65.82 0.51 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.997 -179.642 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.53 ' CG ' ' CD2' ' A' ' 121' ' ' LEU . 40.5 t-80 -51.73 -34.3 38.46 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-O 121.61 0.719 . . . . 0.0 109.72 179.166 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.38 -61.38 2.64 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.665 -1.152 . . . . 0.0 110.523 179.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.628 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 7.1 pt20 -64.44 -53.22 51.83 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 120.774 -0.37 . . . . 0.0 111.743 -179.691 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.498 ' CG1' ' HA ' ' A' ' 9' ' ' HIS . 13.1 p -51.42 -48.45 34.27 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 121.078 0.466 . . . . 0.0 111.077 -179.67 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.621 ' HA ' ' NZ ' ' A' ' 114' ' ' LYS . 52.4 p -67.58 -31.41 71.44 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.417 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.71 -27.0 61.8 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -178.384 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.628 ' HG ' ' O ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -93.45 -37.99 11.66 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 119.308 -0.957 . . . . 0.0 110.579 179.565 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.785 ' CG2' ' HB3' ' A' ' 110' ' ' LEU . 59.5 t -68.67 -50.08 58.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 120.864 0.364 . . . . 0.0 111.239 179.688 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -70.08 -5.66 28.38 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.392 -179.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.0 mt-30 -145.14 32.22 1.11 Allowed 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 111.671 0.248 . . . . 0.0 111.671 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.449 ' N ' ' O ' ' A' ' 15' ' ' LEU . 0.4 OUTLIER 175.46 -71.95 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 179.847 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.462 ' HB3' HD13 ' A' ' 110' ' ' LEU . 0.7 OUTLIER -76.65 75.87 3.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.595 -178.629 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -62.83 74.72 0.03 OUTLIER Glycine 0 C--N 1.318 -0.445 0 CA-C-N 115.219 -0.9 . . . . 0.0 112.882 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.42 ' N ' ' O ' ' A' ' 20' ' ' SER . 16.3 t70 78.53 9.84 1.94 Allowed 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 179.226 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.476 ' O ' ' OG1' ' A' ' 109' ' ' THR . 0.9 OUTLIER -61.78 -167.49 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.191 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.132 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.49 ' HB ' ' ND2' ' A' ' 34' ' ' ASN . 94.6 m -103.56 142.34 34.45 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.629 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.599 ' CA ' ' HG ' ' A' ' 110' ' ' LEU . . . -104.76 149.45 16.89 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.049 -1.072 . . . . 0.0 114.157 -178.101 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.507 ' HB2' ' CB ' ' A' ' 51' ' ' SER . 0.0 OUTLIER -114.19 133.35 55.66 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 178.552 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.489 ' HB2' ' CG ' ' A' ' 55' ' ' PHE . 7.8 tt -113.17 149.94 32.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.377 0.608 . . . . 0.0 111.966 -179.285 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 165.42 64.23 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.183 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 78.25 -4.87 57.38 Favored Glycine 0 C--N 1.334 0.417 0 C-N-CA 120.681 -0.771 . . . . 0.0 111.214 -177.89 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.497 ' C ' ' ND2' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -166.26 166.11 17.01 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 -179.772 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.614 ' CG1' ' HG3' ' A' ' 11' ' ' GLN . 13.5 p -105.71 144.76 14.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.223 0.535 . . . . 0.0 111.765 179.361 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.46 ' CB ' ' HG3' ' A' ' 26' ' ' LYS . . . -129.68 159.76 35.45 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.25 178.385 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.427 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -104.17 120.78 41.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.21 0.529 . . . . 0.0 111.832 -179.246 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.49 ' ND2' ' HB ' ' A' ' 24' ' ' THR . 5.0 t30 -104.41 110.11 22.24 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.133 179.528 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -110.82 -32.29 6.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.518 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -63.67 -49.13 74.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.736 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -95.46 171.85 8.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.613 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.4 p -141.15 110.3 6.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.062 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.511 ' CZ ' ' CG2' ' A' ' 109' ' ' THR . 0.0 OUTLIER -62.64 -175.85 0.1 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.374 179.829 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.506 ' HB3' ' O ' ' A' ' 39' ' ' PHE . 1.1 pm0 160.94 44.56 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.094 179.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 48.8 88.61 0.01 OUTLIER Glycine 0 CA--C 1.52 0.346 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.006 -178.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -125.9 -155.12 0.66 Allowed 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.83 8.46 3.54 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.466 HD11 ' HG2' ' A' ' 53' ' ' LYS . 3.6 mm 75.2 2.32 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 179.685 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -93.85 -24.28 17.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.814 0.34 . . . . 0.0 110.896 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.6 t -93.59 -66.64 0.91 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.003 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -163.13 32.76 0.29 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.556 -0.83 . . . . 0.0 112.904 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.415 ' CB ' ' CD1' ' A' ' 44' ' ' ILE . . . -99.54 165.7 11.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.647 0.26 . . . . 0.0 110.925 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -109.74 149.39 29.85 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.876 0.37 . . . . 0.0 111.188 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.635 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 1.0 OUTLIER -58.66 -26.83 64.19 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.849 179.719 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.513 ' O ' HG23 ' A' ' 54' ' ' VAL . 20.6 p -70.34 -52.31 23.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.817 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.499 ' HB3' ' HG2' ' A' ' 107' ' ' GLN . 1.0 OUTLIER -53.03 -52.08 59.62 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.991 0.424 . . . . 0.0 110.535 179.434 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.635 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -57.9 -54.9 41.69 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.313 -179.967 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.534 HG23 ' O ' ' A' ' 50' ' ' GLU . 19.4 m -55.9 -46.56 80.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 CA-C-O 121.114 0.483 . . . . 0.0 110.165 179.6 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.489 ' CG ' ' HB2' ' A' ' 27' ' ' LEU . 0.5 OUTLIER -50.78 -45.73 59.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.899 178.767 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.428 ' HA ' HG23 ' A' ' 59' ' ' VAL . . . -60.36 -41.98 94.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.407 179.143 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.8 mm-40 -66.42 -36.91 84.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.371 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.439 ' CG2' ' HB3' ' A' ' 2' ' ' ASN . 59.5 p -73.9 -50.72 18.88 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 121.091 0.472 . . . . 0.0 110.045 179.774 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.553 ' O ' HG22 ' A' ' 63' ' ' VAL . 5.1 m -61.49 -46.81 95.82 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.696 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.988 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.419 ' N ' ' CG2' ' A' ' 59' ' ' VAL . 14.3 tp -66.38 -47.09 74.46 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.636 -0.256 . . . . 0.0 111.547 -179.858 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.5 m -61.06 -63.88 1.15 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.189 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -47.39 -30.36 3.24 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 121.101 0.477 . . . . 0.0 110.607 -179.737 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.633 HG13 HG11 ' A' ' 66' ' ' VAL . 25.1 t -80.32 -69.75 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.753 179.034 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.406 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 40.19 26.1 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 178.678 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.406 ' CB ' ' O ' ' A' ' 64' ' ' ALA . 0.7 OUTLIER 163.78 -74.38 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.775 0.321 . . . . 0.0 110.688 -179.764 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.817 HG12 ' HA ' ' A' ' 120' ' ' ALA . 25.0 m 44.02 -165.9 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.727 179.821 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.536 ' HB ' ' HB3' ' A' ' 97' ' ' ASN . 26.9 m -149.6 60.54 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.435 -1.206 0 CA-C-O 120.906 0.384 . . . . 0.0 111.511 -178.539 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.556 ' HB3' ' HB2' ' A' ' 72' ' ' ASP . 1.1 mp -49.21 101.4 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.619 -179.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 22.6 p -60.99 -166.78 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.92 -33.79 67.32 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.11 0.481 . . . . 0.0 110.862 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.42 ' O ' ' HE3' ' A' ' 75' ' ' LYS . 1.6 tm-20 -70.72 -65.45 0.73 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.205 -179.828 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.585 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 3.1 m-20 -51.03 -26.25 5.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.021 -179.655 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.446 ' CG2' ' OG ' ' A' ' 98' ' ' SER . 1.1 p -72.7 -54.62 8.49 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 177.868 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.48 ' HA ' ' CG ' ' A' ' 77' ' ' LEU . . . -54.45 -29.38 49.46 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 176.6 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.585 ' HB2' ' HA ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -58.75 -60.8 3.26 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 113.742 -1.572 . . . . 0.0 110.489 178.289 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.486 HD22 HD23 ' A' ' 100' ' ' LEU . 1.0 OUTLIER -52.83 -56.91 12.3 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.139 0.495 . . . . 0.0 110.483 179.41 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.48 ' CG ' ' HA ' ' A' ' 74' ' ' ALA . 3.3 pp -59.67 -31.13 69.27 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.119 -179.481 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.418 ' HB2' ' O ' ' A' ' 74' ' ' ALA . 20.0 mm-40 -70.59 -58.62 3.49 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.945 0.402 . . . . 0.0 110.351 179.321 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.2 t -50.46 -35.78 30.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.813 179.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.457 ' OG1' ' CE1' ' A' ' 88' ' ' TYR . 2.7 m -85.06 -59.28 2.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.986 -179.452 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.4 ' CG1' ' O ' ' A' ' 77' ' ' LEU . 9.8 p -45.85 -30.92 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-O 120.68 0.276 . . . . 0.0 111.592 -179.371 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.46 -50.12 53.27 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.9 0.381 . . . . 0.0 110.849 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER 169.6 81.44 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.794 179.744 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -158.67 156.37 29.84 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.004 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -83.65 58.77 4.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.642 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.9 m120 58.08 -92.31 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.645 -179.641 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . 0.428 ' O ' ' HB2' ' A' ' 104' ' ' ARG . 0.1 OUTLIER 74.07 -47.42 0.64 Allowed 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 179.359 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.468 ' CE2' ' HB3' ' A' ' 76' ' ' LEU . 8.8 p90 -87.24 146.3 26.03 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-O 121.109 0.481 . . . . 0.0 111.702 -179.08 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.779 ' O ' ' O ' ' A' ' 101' ' ' VAL . 1.3 t0 -129.01 154.08 46.97 Favored 'General case' 0 N--CA 1.431 -1.404 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 178.62 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.496 ' N ' ' CD1' ' A' ' 90' ' ' LEU . 0.0 OUTLIER -157.9 147.79 20.17 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 114.668 1.358 . . . . 0.0 114.668 -178.578 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.528 ' HB3' ' HB ' ' A' ' 99' ' ' VAL . 0.0 OUTLIER -107.71 165.2 11.61 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 105.127 -2.175 . . . . 0.0 105.127 174.876 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.552 ' HA ' ' HA ' ' A' ' 98' ' ' SER . 75.6 p -139.42 165.18 27.9 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 116.065 1.876 . . . . 0.0 116.065 -177.689 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.594 ' C ' ' O ' ' A' ' 97' ' ' ASN . 0.2 OUTLIER -136.0 21.3 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 111.448 -2.614 . . . . 0.0 107.502 178.583 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.416 ' O ' ' N ' ' A' ' 97' ' ' ASN . . . 60.31 -162.6 18.66 Favored Glycine 0 N--CA 1.441 -0.97 0 CA-C-N 113.176 -1.829 . . . . 0.0 115.939 -178.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -43.32 -38.39 2.64 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 114.221 -0.989 . . . . 0.0 110.043 -179.045 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -62.3 -47.65 88.11 Favored Glycine 0 N--CA 1.435 -1.387 0 C-N-CA 120.01 -1.09 . . . . 0.0 110.492 178.422 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.594 ' O ' ' C ' ' A' ' 93' ' ' VAL . 0.3 OUTLIER -165.91 168.54 15.7 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-O 121.535 0.683 . . . . 0.0 111.885 179.558 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.552 ' HA ' ' HA ' ' A' ' 92' ' ' SER . 2.1 m -149.94 145.02 26.24 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 179.052 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.528 ' HB ' ' HB3' ' A' ' 91' ' ' ARG . 73.7 t -103.48 152.69 6.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 120.887 0.375 . . . . 0.0 111.669 -177.033 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.56 ' CD2' ' HG ' ' A' ' 116' ' ' LEU . 0.0 OUTLIER -108.95 130.47 55.45 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 114.916 1.45 . . . . 0.0 114.916 -177.211 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.779 ' O ' ' O ' ' A' ' 89' ' ' ASP . 2.1 p -143.95 103.02 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 N-CA-C 104.581 -2.377 . . . . 0.0 104.581 174.315 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.536 ' HB2' ' H ' ' A' ' 89' ' ' ASP . 0.1 OUTLIER -146.42 164.49 32.29 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 119.065 -1.054 . . . . 0.0 113.17 -174.843 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.524 HD23 ' O ' ' A' ' 102' ' ' SER . 0.1 OUTLIER 156.17 -90.96 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 113.505 -1.679 . . . . 0.0 111.372 176.722 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.431 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 60.04 18.16 7.4 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 -179.407 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.431 ' CB ' ' O ' ' A' ' 104' ' ' ARG . 1.1 p 153.18 170.95 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -178.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.407 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.4 OUTLIER -110.73 100.02 8.85 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 119.25 -0.98 . . . . 0.0 111.452 179.264 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.499 ' HG2' ' HB3' ' A' ' 52' ' ' GLU . 1.3 mt-30 -169.19 164.96 11.1 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.742 -1.117 . . . . 0.0 109.174 177.685 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.4 ' HG2' HG21 ' A' ' 59' ' ' VAL . 2.3 tpt -160.76 145.49 14.13 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.121 0.486 . . . . 0.0 111.495 178.668 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.511 ' CG2' ' CZ ' ' A' ' 39' ' ' PHE . 0.6 OUTLIER -107.62 156.06 19.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.053 179.513 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.785 ' HB3' ' CG2' ' A' ' 16' ' ' VAL . 0.6 OUTLIER -46.77 -53.48 11.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.746 0.308 . . . . 0.0 111.151 -179.51 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.578 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 0.2 OUTLIER -54.05 -61.95 1.97 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.212 179.324 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.585 ' HA ' HG21 ' A' ' 115' ' ' VAL . 0.8 OUTLIER -46.54 -47.07 19.67 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.935 179.511 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.457 ' CB ' ' CZ ' ' A' ' 55' ' ' PHE . . . -53.01 -56.51 15.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.838 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.621 ' NZ ' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -66.11 -28.77 69.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.827 179.94 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.585 HG21 ' HA ' ' A' ' 112' ' ' ASP . 94.1 t -57.15 -65.27 0.42 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.729 0 CA-C-O 122.029 0.919 . . . . 0.0 110.588 179.235 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.587 ' HB3' HG22 ' A' ' 63' ' ' VAL . 9.5 mp -63.5 -40.63 97.58 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 114.437 -1.256 . . . . 0.0 111.003 -179.131 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.566 ' CD2' ' HB3' ' A' ' 8' ' ' LEU . 0.6 OUTLIER -73.62 -15.92 61.25 Favored 'General case' 0 CA--C 1.512 -0.507 0 C-N-CA 120.325 -0.55 . . . . 0.0 111.341 -179.809 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.465 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 20.5 tt0 -73.57 -47.84 37.48 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 105.928 -1.878 . . . . 0.0 105.928 176.143 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . 0.416 ' CB ' ' HG ' ' A' ' 68' ' ' LEU . . . -71.77 -29.02 64.03 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 114.693 -1.139 . . . . 0.0 109.868 177.073 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.817 ' HA ' HG12 ' A' ' 66' ' ' VAL . . . -68.27 -64.82 0.79 Allowed 'General case' 0 CA--C 1.504 -0.808 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.612 179.614 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.681 ' O ' ' N ' ' A' ' 126' ' ' GLY . 0.2 OUTLIER -57.52 -39.27 76.17 Favored 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 119.987 -0.685 . . . . 0.0 109.24 179.509 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.553 ' N ' ' HG ' ' A' ' 121' ' ' LEU . 19.8 ttm-85 -54.73 -45.16 74.05 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.94 179.153 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.407 ' HG3' HG22 ' A' ' 67' ' ' VAL . 1.4 tt0 -86.21 -31.63 21.62 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -178.806 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -95.75 -66.52 0.9 Allowed 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 -178.197 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.4 ' O ' ' HB2' ' A' ' 128' ' ' ARG . 47.8 t -95.59 -65.95 0.94 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 -177.595 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . 0.681 ' N ' ' O ' ' A' ' 121' ' ' LEU . . . 60.82 45.15 97.05 Favored Glycine 0 CA--C 1.493 -1.333 0 C-N-CA 120.192 -1.004 . . . . 0.0 110.764 -178.35 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . 47.95 24.7 0.64 Allowed 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 -176.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . 0.468 ' N ' ' C ' ' A' ' 126' ' ' GLY . 0.0 OUTLIER -117.54 -52.84 2.45 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 114.565 -1.198 . . . . 0.0 111.286 -178.088 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . -55.35 -35.93 61.93 Favored Glycine 0 C--N 1.336 0.538 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.77 -179.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 28.3 m . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.257 -0.878 . . . . 0.0 110.924 179.967 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.099 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -170.7 139.15 1.5 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.82 0.343 . . . . 0.0 110.899 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . 0.409 ' O ' ' C ' ' B' ' 204' ' ' PTR . 9.5 pt-20 -130.37 42.32 3.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.0 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 204' ' ' PTR . . . . . 0.445 ' CB ' ' HB3' ' A' ' 30' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -71.18 -14.57 62.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.69 -179.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 206' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -121.44 135.29 24.93 Favored Pre-proline 0 C--N 1.331 -0.196 0 CA-C-O 120.609 0.242 . . . . 0.0 111.314 -179.714 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -51.88 -74.39 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.864 2.376 . . . . 0.0 112.384 179.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 208' ' ' PHE . . . . . 0.412 ' CE2' ' HA ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -176.26 -172.68 0.5 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.983 -179.898 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.516 -0.311 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.719 0.295 . . . . 0.0 111.17 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -125.07 -150.41 0.45 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.831 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.526 ' HG ' HD13 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -106.85 -81.83 0.55 Allowed 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.108 -179.632 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.499 ' O ' ' HB2' ' A' ' 8' ' ' LEU . 34.9 t -178.23 -162.27 0.06 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.719 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.468 ' HB3' ' CB ' ' A' ' 121' ' ' LEU . 4.3 mt -95.38 -65.2 0.99 Allowed 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 121.24 0.543 . . . . 0.0 111.283 179.726 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.699 ' HB3' ' HA ' ' A' ' 128' ' ' ARG . 1.7 t -44.56 -39.32 4.83 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.636 -178.76 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.98 -62.8 1.58 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.266 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.526 HD13 ' HG ' ' A' ' 3' ' ' LEU . 2.7 tp -46.57 -41.69 14.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.357 0.598 . . . . 0.0 109.97 179.043 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.448 ' HA ' HG12 ' A' ' 12' ' ' VAL . 33.7 t-80 -69.34 -45.66 68.93 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.521 178.667 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.9 mtt-85 -54.87 -44.28 73.89 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.193 179.236 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.54 ' HB3' HG22 ' A' ' 31' ' ' VAL . 4.4 mp0 -64.63 -65.17 0.71 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.733 179.432 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.489 ' CA ' HG23 ' A' ' 31' ' ' VAL . 9.6 p -54.8 -47.81 74.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.082 -179.382 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.622 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 7.8 t -60.74 -50.22 74.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.404 -179.688 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -68.05 -22.47 64.94 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.374 -179.465 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 12.4 mt -74.31 -60.14 2.41 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.402 -179.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.613 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 0.9 OUTLIER -70.81 -28.57 34.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.204 -179.384 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.419 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 5.7 mm-40 -85.46 -9.07 57.98 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.73 -0.388 . . . . 0.0 111.312 -179.681 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.419 ' HG2' ' O ' ' A' ' 17' ' ' GLN . 7.0 mt-30 -152.92 42.38 0.61 Allowed 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 179.759 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 177.56 -69.54 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 179.667 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.613 ' HB2' ' HA ' ' A' ' 16' ' ' VAL . 20.0 m -70.62 -81.5 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.973 -0.558 . . . . 0.0 112.126 -178.315 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.604 ' H ' ' HA ' ' A' ' 16' ' ' VAL . . . 120.42 -33.43 4.5 Favored Glycine 0 N--CA 1.45 -0.376 0 N-CA-C 111.549 -0.62 . . . . 0.0 111.549 -179.22 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 169.64 28.18 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 120.764 0.316 . . . . 0.0 110.98 179.692 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.418 ' HB2' ' HB3' ' A' ' 20' ' ' SER . 0.8 OUTLIER -80.74 -156.34 0.13 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.467 -179.903 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.524 ' HA ' ' HA ' ' A' ' 109' ' ' THR . 0.1 OUTLIER -104.02 163.05 12.64 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.813 0.339 . . . . 0.0 110.589 -179.944 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . 0.416 ' HA3' ' CE2' ' A' ' 55' ' ' PHE . . . -110.71 150.72 17.72 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.541 -0.837 . . . . 0.0 113.647 -178.922 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.67 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 0.3 OUTLIER -114.33 104.44 12.07 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.229 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.484 HD11 ' CD2' ' A' ' 55' ' ' PHE . 0.5 OUTLIER -107.31 152.66 23.84 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -178.108 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.483 ' CB ' ' O ' ' A' ' 27' ' ' LEU . 5.7 ptp180 143.34 55.84 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 114.281 -1.327 . . . . 0.0 109.574 179.007 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.434 ' HA2' HD21 ' A' ' 3' ' ' LEU . . . 105.83 -12.8 45.98 Favored Glycine 0 C--N 1.333 0.407 0 N-CA-C 111.388 -0.685 . . . . 0.0 111.388 -178.71 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.459 ' HB2' ' HA ' ' B' ' 207' ' ' PRO . 0.0 OUTLIER -166.38 165.23 17.28 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 179.849 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.67 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 1.4 m -121.8 117.29 51.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.244 0.545 . . . . 0.0 110.975 179.228 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -107.99 166.27 10.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.874 -179.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.416 ' CB ' HD13 ' A' ' 110' ' ' LEU . . . -103.36 119.73 39.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.094 0.473 . . . . 0.0 111.316 -179.503 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.485 ' ND2' ' CE2' ' A' ' 39' ' ' PHE . 7.0 t30 -98.56 122.09 41.32 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.931 -179.741 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.2 mtmm -118.68 -22.51 7.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.131 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -68.86 -16.21 63.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.486 -179.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.428 ' HB ' ' CZ ' ' A' ' 39' ' ' PHE . 0.1 OUTLIER -134.82 -175.14 3.8 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.985 0.421 . . . . 0.0 111.261 -179.786 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 72.3 p -147.86 106.84 3.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.872 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.546 ' CD2' ' HG3' ' A' ' 52' ' ' GLU . 21.8 m-85 -116.21 138.12 51.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.484 0.659 . . . . 0.0 112.57 -178.839 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -126.17 -45.99 1.67 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.065 179.419 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.462 ' HA2' ' HB2' ' A' ' 107' ' ' GLN . . . 177.04 76.43 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.278 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.112 179.231 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.613 ' H ' ' HB2' ' A' ' 107' ' ' GLN . 0.1 OUTLIER -113.2 -159.53 0.69 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 179.636 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.19 26.75 2.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.733 0.301 . . . . 0.0 111.793 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.433 ' HA ' ' CB ' ' A' ' 48' ' ' ALA . 1.1 mp 68.14 3.49 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 112.141 0.422 . . . . 0.0 112.141 179.536 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -93.89 -33.51 13.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.865 0.364 . . . . 0.0 110.874 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 3.2 t -98.83 -29.47 12.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.833 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 159.4 83.47 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.617 -0.801 . . . . 0.0 112.559 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.545 ' CB ' ' OE1' ' A' ' 107' ' ' GLN . . . -141.58 -177.48 5.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.044 0.45 . . . . 0.0 111.381 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.1 tpm_? -140.78 143.64 35.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.154 179.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.507 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 2.5 mp0 -48.57 -35.16 12.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.216 0.532 . . . . 0.0 110.981 -179.846 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.465 ' CB ' ' HG2' ' A' ' 26' ' ' LYS . 0.7 OUTLIER -63.4 -60.61 3.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.374 -179.817 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.546 ' HG3' ' CD2' ' A' ' 39' ' ' PHE . 0.5 OUTLIER -44.41 -65.74 0.48 Allowed 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.149 0.5 . . . . 0.0 110.568 -179.752 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.507 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -47.16 -50.03 21.32 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.796 179.366 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.43 ' CG2' ' O ' ' A' ' 50' ' ' GLU . 57.0 t -56.53 -39.19 60.56 Favored 'Isoleucine or valine' 0 C--O 1.231 0.112 0 CA-C-O 121.013 0.435 . . . . 0.0 109.906 179.085 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.652 ' HB3' ' HB3' ' A' ' 108' ' ' MET . 0.1 OUTLIER -56.66 -51.05 70.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.01 179.23 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -62.34 -32.79 73.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.509 179.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.2 tp-100 -71.26 -52.29 19.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.012 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 2.2 m -60.15 -48.22 82.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.076 -179.594 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.549 HG11 ' N ' ' A' ' 60' ' ' LEU . 9.7 p -66.36 -44.79 90.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 C-N-CA 120.585 -0.446 . . . . 0.0 111.314 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.549 ' N ' HG11 ' A' ' 59' ' ' VAL . 0.6 OUTLIER -54.21 -44.98 72.09 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 121.028 0.442 . . . . 0.0 110.208 179.774 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 42.3 m -63.11 -59.17 5.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.179 179.781 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . 0.448 ' CD2' ' CG ' ' A' ' 5' ' ' LEU . 0.1 OUTLIER -50.89 -49.45 59.36 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-O 120.861 0.362 . . . . 0.0 110.564 -179.951 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.612 HG11 HG13 ' A' ' 66' ' ' VAL . 73.5 t -58.13 -66.51 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.86 178.82 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.493 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 36.78 32.21 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.859 178.682 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.493 ' CB ' ' O ' ' A' ' 64' ' ' ALA . 9.8 t-20 155.29 -79.47 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 122.466 0.307 . . . . 0.0 110.759 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.69 HG11 ' HA ' ' A' ' 120' ' ' ALA . 15.9 m 46.68 -155.9 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 116.121 -0.491 . . . . 0.0 112.001 179.683 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.504 ' CG1' ' O ' ' A' ' 67' ' ' VAL . 8.1 p -172.93 60.96 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.112 0 CA-C-O 121.643 0.735 . . . . 0.0 111.017 -179.506 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.521 ' HB3' ' CB ' ' A' ' 72' ' ' ASP . 0.5 OUTLIER -42.62 99.05 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.101 -0.954 . . . . 0.0 112.465 -179.551 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.469 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 75.1 p -60.25 178.06 0.22 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.751 178.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.23 -31.96 1.72 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.996 0.427 . . . . 0.0 110.955 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.81 -64.34 0.88 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.502 179.667 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.612 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 69.0 m-20 -60.55 -27.85 67.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.363 179.611 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 20.3 m -62.62 -61.34 2.49 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.0 -26.14 61.99 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 177.622 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.612 ' HB2' ' HA ' ' A' ' 72' ' ' ASP . 0.4 OUTLIER -57.24 -64.06 1.01 Allowed 'General case' 0 C--O 1.235 0.306 0 CA-C-N 114.777 -1.101 . . . . 0.0 110.134 178.783 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.474 HD12 ' CD2' ' A' ' 68' ' ' LEU . 0.4 OUTLIER -57.96 -39.22 77.58 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.806 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.402 ' O ' ' CG2' ' A' ' 81' ' ' VAL . 0.1 OUTLIER -52.63 -43.73 65.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.798 179.823 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.46 -50.54 30.66 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.595 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' SER . . . . . 0.442 ' HB3' ' CG ' ' A' ' 111' ' ' GLN . 35.6 p -62.24 -26.55 68.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.635 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.413 ' HA ' ' HB2' ' A' ' 86' ' ' ASN . 13.1 t -95.25 -31.56 13.42 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -179.124 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.402 ' CG2' ' O ' ' A' ' 77' ' ' LEU . 80.1 t -91.53 -8.29 10.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 -179.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 8.9 pttt -55.49 -27.37 48.07 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.655 0.264 . . . . 0.0 111.172 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -161.19 94.22 0.99 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.826 0.346 . . . . 0.0 111.27 -179.901 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 48.94 -172.51 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.314 179.544 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 70.2 mt -64.34 105.34 0.9 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.488 179.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.413 ' HB2' ' HA ' ' A' ' 80' ' ' THR . 0.8 OUTLIER -66.31 -89.08 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.166 -179.576 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . 0.493 ' HB2' ' O ' ' A' ' 103' ' ' LEU . 29.4 p-10 -179.82 7.96 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -179.481 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.482 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 3.3 m-85 -102.83 131.87 49.41 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 120.958 0.408 . . . . 0.0 111.208 -179.194 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.664 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 1.0 OUTLIER -109.22 144.28 37.54 Favored 'General case' 0 N--CA 1.435 -1.206 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 -179.445 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.416 HD22 ' O ' ' A' ' 99' ' ' VAL . 39.7 mt -135.28 158.84 43.34 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -177.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.674 ' O ' ' CB ' ' A' ' 98' ' ' SER . 0.1 OUTLIER -134.16 161.32 35.22 Favored 'General case' 0 C--O 1.216 -0.659 0 CA-C-N 114.63 -1.168 . . . . 0.0 108.355 178.101 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.43 ' O ' ' CG1' ' A' ' 93' ' ' VAL . 17.9 p -103.96 157.93 16.76 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.82 0.819 . . . . 0.0 112.74 -178.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.593 ' O ' ' O ' ' A' ' 97' ' ' ASN . 0.0 OUTLIER 168.57 151.68 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.435 -1.197 0 CA-C-N 113.87 -1.514 . . . . 0.0 108.089 -179.171 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.439 ' C ' ' H ' ' A' ' 96' ' ' GLY . . . 88.74 21.39 43.47 Favored Glycine 0 C--N 1.289 -2.042 0 C-N-CA 119.931 -1.128 . . . . 0.0 112.873 -179.747 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 8.5 t30 72.62 -51.15 0.7 Allowed 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 -178.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . 0.439 ' H ' ' C ' ' A' ' 94' ' ' GLY . . . -135.38 15.65 4.17 Favored Glycine 0 N--CA 1.441 -0.995 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.987 178.715 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.593 ' O ' ' O ' ' A' ' 93' ' ' VAL . 0.1 OUTLIER -106.88 166.76 10.36 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 117.304 0.552 . . . . 0.0 109.862 179.483 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.674 ' CB ' ' O ' ' A' ' 91' ' ' ARG . 0.1 OUTLIER -140.41 165.34 27.68 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.184 0.516 . . . . 0.0 110.908 179.847 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.416 ' O ' HD22 ' A' ' 90' ' ' LEU . 0.5 OUTLIER -104.14 150.68 7.13 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 115.361 -0.836 . . . . 0.0 108.869 179.562 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.608 HD22 ' HG ' ' A' ' 116' ' ' LEU . 3.2 tp -103.79 106.31 16.78 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 113.423 0.897 . . . . 0.0 113.423 -178.476 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.664 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 1.4 p -121.85 104.19 14.56 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.978 0 N-CA-C 104.007 -2.59 . . . . 0.0 104.007 174.623 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.536 ' O ' HD21 ' A' ' 103' ' ' LEU . 0.2 OUTLIER -149.87 161.31 42.53 Favored 'General case' 0 C--N 1.309 -1.194 0 C-N-CA 118.829 -1.148 . . . . 0.0 114.036 -173.841 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.536 HD21 ' O ' ' A' ' 102' ' ' SER . 0.1 OUTLIER 166.14 -69.48 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 113.478 -1.692 . . . . 0.0 112.278 175.343 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.552 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 35.14 56.18 0.79 Allowed 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.055 0.455 . . . . 0.0 110.228 179.6 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.552 ' CB ' ' O ' ' A' ' 104' ' ' ARG . 11.4 m 105.27 167.98 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.545 -177.579 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.42 ' HB3' ' CB ' ' A' ' 53' ' ' LYS . 0.5 OUTLIER -104.74 102.33 11.91 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.092 -0.643 . . . . 0.0 112.665 -178.545 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.613 ' HB2' ' H ' ' A' ' 42' ' ' LEU . 0.9 OUTLIER -168.72 165.1 12.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.841 177.989 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.652 ' HB3' ' HB3' ' A' ' 55' ' ' PHE . 18.6 ttm -165.59 143.4 5.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.346 0.593 . . . . 0.0 112.286 178.668 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.524 ' HA ' ' HA ' ' A' ' 24' ' ' THR . 0.1 OUTLIER -104.38 165.11 11.27 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.027 -0.988 . . . . 0.0 109.078 178.287 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.473 HD11 HG22 ' A' ' 16' ' ' VAL . 7.0 mt -56.03 -52.87 62.7 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.665 0.269 . . . . 0.0 111.395 -179.369 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.551 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 1.8 tp60 -50.45 -65.19 0.6 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.786 0.327 . . . . 0.0 110.642 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.473 ' HA ' HG23 ' A' ' 115' ' ' VAL . 0.3 OUTLIER -47.71 -45.53 28.69 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.096 0.474 . . . . 0.0 110.895 179.898 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.468 ' CB ' ' CE1' ' A' ' 55' ' ' PHE . . . -49.42 -61.24 2.21 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.936 179.664 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.622 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -66.36 -25.52 66.84 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.239 -179.982 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.564 ' CG2' ' CG ' ' A' ' 75' ' ' LYS . 76.6 t -58.36 -65.11 0.46 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.808 0 CA-C-O 121.991 0.9 . . . . 0.0 110.305 179.37 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.608 ' HG ' HD22 ' A' ' 100' ' ' LEU . 0.0 OUTLIER -62.95 -40.98 99.3 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.645 -179.476 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.453 ' CD1' ' CD2' ' A' ' 8' ' ' LEU . 0.1 OUTLIER -69.03 -22.41 64.05 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 120.792 0.33 . . . . 0.0 111.433 -179.763 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.587 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 30.8 tt0 -69.75 -49.51 52.4 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 106.008 -1.849 . . . . 0.0 106.008 177.324 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . 0.651 ' O ' ' HB2' ' A' ' 123' ' ' GLN . . . -70.18 -28.27 65.18 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.081 177.384 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.69 ' HA ' HG11 ' A' ' 66' ' ' VAL . . . -72.05 -63.58 1.11 Allowed 'General case' 0 CA--C 1.511 -0.537 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.397 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.631 ' O ' ' N ' ' A' ' 126' ' ' GLY . 0.0 OUTLIER -55.99 -42.35 76.23 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.314 -179.746 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.587 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.4 OUTLIER -67.37 -39.14 85.65 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.904 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.651 ' HB2' ' O ' ' A' ' 119' ' ' ALA . 1.7 mp0 -77.15 -36.73 54.99 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -178.711 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -96.17 -69.74 0.74 Allowed 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 -177.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.506 ' OG ' ' N ' ' A' ' 129' ' ' GLY . 26.0 t -99.53 -66.84 0.88 Allowed 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -178.774 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . 0.631 ' N ' ' O ' ' A' ' 121' ' ' LEU . . . 69.14 50.24 35.1 Favored Glycine 0 N--CA 1.445 -0.716 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.779 -178.367 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -177.54 -54.2 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.96 -0.62 . . . . 0.0 109.615 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . 0.699 ' HA ' ' HB3' ' A' ' 6' ' ' SER . 0.0 OUTLIER 168.77 36.57 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.552 178.976 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . 0.506 ' N ' ' OG ' ' A' ' 125' ' ' SER . . . 93.05 -4.4 74.59 Favored Glycine 0 C--N 1.315 -0.596 0 CA-C-N 115.683 -0.69 . . . . 0.0 112.636 -179.765 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 29.0 t . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.273 -0.87 . . . . 0.0 110.957 -179.982 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.113 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 1.4 t70 60.89 95.28 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.815 0.341 . . . . 0.0 110.931 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -105.95 167.42 9.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.956 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 204' ' ' PTR . . . . . 0.414 ' HD2' ' ND2' ' A' ' 30' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 205' ' ' ASP . . . . . 0.412 ' O ' ' O ' ' B' ' 206' ' ' ASP . 0.7 OUTLIER -93.66 91.66 7.14 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.77 -179.25 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 206' ' ' ASP . . . . . 0.476 ' HB2' ' HD2' ' B' ' 207' ' ' PRO . 0.6 OUTLIER 54.34 159.46 0.06 OUTLIER Pre-proline 0 CA--C 1.533 0.295 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.85 179.116 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . 0.476 ' HD2' ' HB2' ' B' ' 206' ' ' ASP . 19.1 Cg_endo -60.26 -165.45 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.697 2.265 . . . . 0.0 112.289 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 208' ' ' PHE . . . . . 0.414 ' CD1' ' HG3' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -66.08 -168.06 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.952 -179.807 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.512 -0.313 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 32.0 mmt . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.79 0.329 . . . . 0.0 111.149 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -88.42 -164.35 1.11 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.815 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.484 ' CD1' ' HA ' ' A' ' 30' ' ' ASN . 1.2 mt -68.87 -81.56 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.062 0.458 . . . . 0.0 110.368 179.469 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.414 ' CB ' ' OD1' ' A' ' 7' ' ' ASP . 0.6 OUTLIER -170.12 -156.11 0.13 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.616 179.732 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.459 ' CD2' ' HB1' ' A' ' 120' ' ' ALA . 0.3 OUTLIER -95.71 -66.31 0.92 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.712 0.768 . . . . 0.0 112.429 -179.33 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.2 p -65.08 -41.14 95.31 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.549 -1.205 . . . . 0.0 112.87 -177.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . 0.414 ' OD1' ' CB ' ' A' ' 4' ' ' SER . 0.1 OUTLIER -67.53 -48.21 67.67 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.23 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.476 ' O ' ' HG2' ' A' ' 11' ' ' GLN . 18.2 tp -51.74 -46.58 64.09 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.927 178.738 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.571 ' CG ' ' CD2' ' A' ' 121' ' ' LEU . 46.1 t-80 -65.06 -39.92 93.98 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.538 178.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -52.06 -53.14 45.79 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.258 -179.691 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.502 ' HG3' ' CG1' ' A' ' 31' ' ' VAL . 0.0 OUTLIER -69.64 -55.38 10.2 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 120.885 -0.326 . . . . 0.0 111.566 -179.706 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.476 HG12 ' HA ' ' A' ' 9' ' ' HIS . 2.4 p -55.82 -46.82 80.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 CA-C-O 120.973 0.416 . . . . 0.0 111.244 -179.814 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.774 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 56.0 p -60.96 -53.32 58.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.309 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.457 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 0.6 OUTLIER -60.73 -21.09 62.59 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.823 0.344 . . . . 0.0 110.445 -179.916 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.453 ' CD1' HG11 ' A' ' 31' ' ' VAL . 4.8 mt -78.11 -65.54 0.96 Allowed 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 112.74 0.645 . . . . 0.0 112.74 -179.247 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.543 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 0.9 OUTLIER -72.49 -26.75 24.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.526 -0.47 . . . . 0.0 111.662 -178.863 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.466 ' HB2' ' O ' ' A' ' 13' ' ' SER . 3.5 mm100 -70.54 -21.86 62.67 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.461 -0.495 . . . . 0.0 110.326 179.639 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.457 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 2.1 pt20 -165.99 63.33 0.11 Allowed 'General case' 0 CA--C 1.528 0.113 0 CA-C-O 120.75 0.31 . . . . 0.0 111.318 179.376 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 175.53 -57.72 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.537 179.779 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.543 ' HB2' ' HA ' ' A' ' 16' ' ' VAL . 63.5 m -85.51 -39.63 17.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.647 -179.179 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 59.53 69.23 1.34 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.45 -0.881 . . . . 0.0 111.969 -179.447 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 58.77 88.7 0.06 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.977 0.418 . . . . 0.0 110.7 -179.635 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . 0.446 ' HB2' ' HB3' ' A' ' 20' ' ' SER . 97.1 m -149.79 -162.91 1.66 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.962 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.564 ' HA ' ' HB ' ' A' ' 109' ' ' THR . 0.0 OUTLIER -104.46 147.96 26.99 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.713 -179.923 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -104.99 140.6 15.07 Favored Glycine 0 N--CA 1.443 -0.834 0 C-N-CA 120.282 -0.961 . . . . 0.0 113.386 -178.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.45 ' HB3' ' CB ' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -104.45 121.77 44.13 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 178.967 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.455 HD11 ' CD1' ' A' ' 55' ' ' PHE . 8.7 tt -104.6 149.04 25.86 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.327 0.584 . . . . 0.0 112.243 -178.762 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 162.33 55.76 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.383 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 90.61 -8.1 80.32 Favored Glycine 0 C--N 1.332 0.336 0 N-CA-C 111.355 -0.698 . . . . 0.0 111.355 -178.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.484 ' HA ' ' CD1' ' A' ' 3' ' ' LEU . 0.0 OUTLIER -165.92 162.97 18.54 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 179.815 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.502 ' CG1' ' HG3' ' A' ' 11' ' ' GLN . 7.4 p -104.7 133.58 48.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 121.482 0.658 . . . . 0.0 110.784 178.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.45 ' CB ' ' HB3' ' A' ' 26' ' ' LYS . . . -113.22 166.38 11.51 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.657 -179.699 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.411 ' CB ' ' OG ' ' A' ' 20' ' ' SER . . . -102.14 105.95 16.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.617 0.722 . . . . 0.0 110.573 -179.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.434 HD22 ' HE1' ' A' ' 39' ' ' PHE . 62.0 t30 -91.47 114.35 26.85 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.604 -1.18 . . . . 0.0 111.321 -179.015 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -131.08 40.22 3.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.558 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -110.93 -38.89 4.97 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.589 -179.383 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.568 ' HB ' ' CE1' ' A' ' 39' ' ' PHE . 89.5 m -122.51 -106.44 0.36 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.511 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.639 ' O ' ' O ' ' A' ' 39' ' ' PHE . 0.7 OUTLIER -174.44 -49.1 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 113.037 0.754 . . . . 0.0 113.037 179.933 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.639 ' O ' ' O ' ' A' ' 38' ' ' THR . 0.9 OUTLIER 45.1 122.38 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.879 0.847 . . . . 0.0 110.977 -177.72 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.1 pp0? -128.61 40.38 3.66 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.0 -178.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.592 ' C ' ' HB2' ' A' ' 107' ' ' GLN . . . 90.24 8.53 66.37 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 115.396 -0.82 . . . . 0.0 113.112 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.605 ' HB3' ' OE1' ' A' ' 107' ' ' GLN . 0.3 OUTLIER -49.41 -166.58 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 117.04 0.42 . . . . 0.0 111.364 179.311 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.5 m -132.58 24.17 4.38 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -179.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.429 ' HA ' ' HB1' ' A' ' 48' ' ' ALA . 1.3 mp 67.4 2.89 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 179.627 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.74 -32.51 60.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.847 0.356 . . . . 0.0 111.011 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.8 t -82.06 -62.64 1.57 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.095 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -175.07 32.54 0.09 OUTLIER Glycine 0 C--N 1.331 0.281 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.997 -179.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.539 ' CB ' ' OE1' ' A' ' 107' ' ' GLN . . . -83.7 -163.95 0.84 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.073 0.463 . . . . 0.0 111.64 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -130.79 -178.31 4.74 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.134 179.528 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -83.03 -27.88 30.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.91 0.386 . . . . 0.0 110.842 179.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.437 ' CB ' ' HG2' ' A' ' 26' ' ' LYS . 1.5 m -55.41 -65.14 0.64 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.743 -179.724 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.561 ' HG3' ' CD2' ' A' ' 39' ' ' PHE . 31.2 mm-40 -49.39 -67.38 0.27 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.901 0.381 . . . . 0.0 111.641 -179.08 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.5 ' HG2' ' N ' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -40.54 -54.38 2.52 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.917 179.147 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.5 ' N ' ' HG2' ' A' ' 53' ' ' LYS . 77.3 t -58.09 -44.83 88.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.806 179.178 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.56 ' CG ' ' CE ' ' A' ' 108' ' ' MET . 0.5 OUTLIER -55.31 -33.49 63.34 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.488 178.995 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.455 ' O ' ' HG ' ' A' ' 60' ' ' LEU . . . -64.17 -65.2 0.71 Allowed 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 177.837 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . 0.423 ' HA ' HD11 ' A' ' 60' ' ' LEU . 3.7 mm-40 -37.46 -47.64 0.9 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.652 179.753 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 68.8 p -67.27 -46.56 73.29 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -179.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.542 HG12 ' HG ' ' A' ' 60' ' ' LEU . 11.9 p -72.23 -28.21 28.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -178.183 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.567 ' CD2' ' CD2' ' A' ' 103' ' ' LEU . 0.0 OUTLIER -92.97 -21.38 19.81 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 120.201 -0.599 . . . . 0.0 110.525 179.486 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.407 ' CB ' ' O ' ' A' ' 57' ' ' GLN . 44.7 m -79.82 -42.9 23.42 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 178.259 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -61.96 -49.2 77.06 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.873 179.353 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.517 ' CG2' ' HA ' ' A' ' 60' ' ' LEU . 2.8 m -58.23 -60.64 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.035 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.467 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 40.36 28.66 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.237 -0.438 . . . . 0.0 112.06 179.659 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.475 ' O ' ' CG2' ' A' ' 66' ' ' VAL . 0.9 OUTLIER 159.19 -80.26 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 120.724 0.297 . . . . 0.0 111.697 -179.679 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.548 ' CG1' ' HA ' ' A' ' 120' ' ' ALA . 23.0 m 49.98 -158.85 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.95 -179.142 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.58 ' CG1' ' O ' ' A' ' 67' ' ' VAL . 4.5 p -163.92 87.28 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 121.597 0.713 . . . . 0.0 109.777 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.661 ' HB3' ' HB2' ' A' ' 72' ' ' ASP . 1.1 mp -80.87 112.73 18.52 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.66 -177.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.575 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 2.3 p -89.97 -177.18 5.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.52 179.033 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.434 ' HA ' ' OG1' ' A' ' 73' ' ' THR . 0.0 OUTLIER -34.67 -39.06 0.08 Allowed 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.018 -179.312 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -69.27 -65.35 0.72 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.406 -179.435 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.661 ' HB2' ' HB3' ' A' ' 68' ' ' LEU . 0.7 OUTLIER -60.57 -30.91 70.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.685 -179.902 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.532 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 1.5 p -61.86 -64.32 0.97 Allowed 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 178.247 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -53.23 -25.84 15.69 Favored 'General case' 0 N--CA 1.456 -0.163 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.594 ' HB2' ' HA ' ' A' ' 72' ' ' ASP . 0.1 OUTLIER -58.92 -56.33 23.66 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.187 178.765 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.405 HD11 ' CD1' ' A' ' 90' ' ' LEU . 1.3 mp -63.47 -47.91 79.85 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 178.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.532 ' HG ' ' O ' ' A' ' 73' ' ' THR . 4.9 mt -58.61 -29.68 66.67 Favored 'General case' 0 N--CA 1.461 0.097 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.355 179.406 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -72.72 -47.66 45.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.533 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 22.0 p -59.06 -38.76 80.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.697 179.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.415 HG21 ' HA ' ' A' ' 77' ' ' LEU . 15.3 t -75.97 -45.17 36.21 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.281 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 8.2 p -74.7 -12.43 15.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.645 -179.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 9.4 mmmt -46.64 -64.09 0.85 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.78 0.324 . . . . 0.0 111.291 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -179.9 44.8 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.8 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -172.7 -177.2 1.64 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.987 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.8 mp -111.03 116.23 30.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.709 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.402 ' HB2' ' CB ' ' A' ' 80' ' ' THR . 0.9 OUTLIER -88.26 157.33 18.8 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.969 0.414 . . . . 0.0 111.194 -179.672 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . 0.538 ' OD1' ' HA3' ' A' ' 41' ' ' GLY . 0.4 OUTLIER -116.69 35.07 4.74 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-O 121.703 0.763 . . . . 0.0 110.387 179.861 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.556 ' HA ' ' HB3' ' A' ' 102' ' ' SER . 4.7 m-85 -101.96 152.23 21.19 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.457 -179.85 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.721 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.2 OUTLIER -124.34 143.93 50.3 Favored 'General case' 0 N--CA 1.443 -0.813 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 -179.353 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.405 ' CD1' HD11 ' A' ' 76' ' ' LEU . 11.8 mt -133.02 151.96 52.01 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -177.232 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.636 ' O ' ' CB ' ' A' ' 98' ' ' SER . 0.0 OUTLIER -134.19 159.43 40.94 Favored 'General case' 0 C--O 1.218 -0.575 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.048 178.291 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.444 ' O ' ' CG1' ' A' ' 93' ' ' VAL . 0.7 OUTLIER -103.98 160.95 14.39 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.738 0.78 . . . . 0.0 112.56 -178.882 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.513 ' O ' ' O ' ' A' ' 97' ' ' ASN . 0.0 OUTLIER 167.07 141.42 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.891 0 CA-C-N 113.992 -1.458 . . . . 0.0 108.5 -179.215 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.452 ' HA3' ' ND2' ' A' ' 97' ' ' ASN . . . 98.11 26.4 9.57 Favored Glycine 0 C--N 1.298 -1.576 0 C-N-CA 119.659 -1.258 . . . . 0.0 113.052 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 41.94 30.52 0.18 Allowed 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 121.443 0.64 . . . . 0.0 109.649 -178.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 157.18 -7.93 0.21 Allowed Glycine 0 N--CA 1.442 -0.924 0 CA-C-N 115.062 -0.972 . . . . 0.0 112.893 -179.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.575 ' HA ' ' HA ' ' A' ' 69' ' ' THR . 0.0 OUTLIER -104.74 166.8 10.14 Favored 'General case' 0 C--N 1.346 0.428 0 CA-C-N 118.261 1.03 . . . . 0.0 109.823 179.389 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.636 ' CB ' ' O ' ' A' ' 91' ' ' ARG . 0.1 OUTLIER -141.85 163.95 31.52 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.278 0.561 . . . . 0.0 110.941 -179.811 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -104.72 151.65 7.04 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.825 179.782 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.568 ' HG ' ' HG ' ' A' ' 116' ' ' LEU . 0.1 OUTLIER -104.13 105.85 16.16 Favored 'General case' 0 CA--C 1.509 -0.602 0 CA-C-O 121.68 0.752 . . . . 0.0 112.439 -179.684 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.721 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 43.6 t -122.15 105.67 16.65 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.978 0 N-CA-C 105.348 -2.093 . . . . 0.0 105.348 175.761 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.643 ' O ' ' HB2' ' A' ' 103' ' ' LEU . 73.7 m -146.37 153.3 40.34 Favored 'General case' 0 C--N 1.309 -1.157 0 C-N-CA 119.256 -0.978 . . . . 0.0 113.051 -175.427 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.643 ' HB2' ' O ' ' A' ' 102' ' ' SER . 1.2 mm? 144.19 67.21 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 114.612 -1.176 . . . . 0.0 112.643 176.7 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.491 ' CB ' ' HB2' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -101.85 21.31 14.82 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 114.686 -1.143 . . . . 0.0 108.012 177.023 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.581 ' CB ' ' O ' ' A' ' 41' ' ' GLY . 4.3 m 159.02 160.32 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 -179.003 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.436 ' C ' ' O ' ' A' ' 42' ' ' LEU . 0.4 OUTLIER -104.79 102.85 12.39 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 -177.168 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.626 ' NE2' ' HB3' ' A' ' 39' ' ' PHE . 1.0 OUTLIER -168.39 162.66 12.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.289 177.278 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.56 ' CE ' ' CG ' ' A' ' 55' ' ' PHE . 0.0 OUTLIER -165.38 126.06 1.9 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.27 0.557 . . . . 0.0 112.067 179.95 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.564 ' HB ' ' HA ' ' A' ' 24' ' ' THR . 4.7 p -103.0 162.73 12.69 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.558 -179.638 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.535 HD11 HG21 ' A' ' 16' ' ' VAL . 1.0 OUTLIER -39.34 -64.85 0.43 Allowed 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.293 -179.576 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.492 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 1.5 tp60 -43.69 -64.35 0.67 Allowed 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.278 179.653 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -44.19 -41.75 5.98 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 121.232 0.539 . . . . 0.0 110.597 179.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.455 ' CA ' ' SD ' ' A' ' 108' ' ' MET . . . -60.07 -65.09 0.74 Allowed 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.494 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.774 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.2 OUTLIER -55.88 -25.56 43.07 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.967 179.611 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.537 ' CG2' ' CG ' ' A' ' 75' ' ' LYS . 72.7 t -65.36 -64.62 0.68 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.739 0 CA-C-O 121.657 0.741 . . . . 0.0 110.728 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.729 ' O ' ' HB2' ' A' ' 120' ' ' ALA . 9.8 mp -63.86 -30.74 71.8 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.448 -179.591 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.59 ' HA ' ' HB1' ' A' ' 120' ' ' ALA . 2.1 mp -79.07 -26.4 43.04 Favored 'General case' 0 CA--C 1.511 -0.535 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.256 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.53 ' HB2' ' O ' ' A' ' 114' ' ' LYS . 0.8 OUTLIER -66.38 -48.35 70.43 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 177.278 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . 0.409 ' N ' ' OD2' ' A' ' 72' ' ' ASP . . . -74.6 -25.35 59.19 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 114.992 -1.004 . . . . 0.0 109.695 177.1 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.729 ' HB2' ' O ' ' A' ' 116' ' ' LEU . . . -68.73 -60.17 2.59 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.469 179.496 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.604 ' O ' ' N ' ' A' ' 126' ' ' GLY . 1.0 OUTLIER -65.51 -33.77 76.71 Favored 'General case' 0 N--CA 1.444 -0.748 0 C-N-CA 120.202 -0.599 . . . . 0.0 109.695 179.638 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.523 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.1 OUTLIER -58.45 -46.47 86.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.828 179.494 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -94.53 -29.82 14.71 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 113.769 1.025 . . . . 0.0 113.769 -177.769 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -96.42 -68.38 0.8 Allowed 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -177.399 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' SER . . . . . 0.47 ' OG ' ' N ' ' A' ' 126' ' ' GLY . 6.0 p -96.89 -66.0 0.93 Allowed 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 113.005 0.742 . . . . 0.0 113.005 -177.503 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . 0.604 ' N ' ' O ' ' A' ' 121' ' ' LEU . . . 78.01 77.5 0.84 Allowed Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 111.104 -0.798 . . . . 0.0 111.104 -178.374 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . 0.454 ' CB ' ' O ' ' A' ' 126' ' ' GLY . . . 86.55 -39.2 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 -178.274 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . 0.4 ' CB ' ' O ' ' A' ' 127' ' ' ALA . 4.0 mtp180 165.12 45.58 0.0 OUTLIER 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.356 0.598 . . . . 0.0 111.064 178.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . -59.37 -25.89 61.05 Favored Glycine 0 C--N 1.315 -0.627 0 CA-C-N 115.511 -0.768 . . . . 0.0 112.538 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 2.6 p . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.896 179.927 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.146 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -72.76 128.99 37.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.821 0.343 . . . . 0.0 110.866 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -134.98 80.64 1.85 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.896 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 204' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.96 -65.65 0.65 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.15 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 206' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -107.48 157.09 36.58 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.269 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_endo -48.83 179.04 0.01 OUTLIER 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 123.174 2.583 . . . . 0.0 112.691 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 208' ' ' PHE . . . . . 0.475 ' CE1' ' HA ' ' A' ' 11' ' ' GLN . 68.0 m-85 56.48 173.89 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.99 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 116.471 -0.332 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.777 0.323 . . . . 0.0 111.239 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . 0.401 ' HB3' ' CG2' ' A' ' 58' ' ' THR . 0.2 OUTLIER -104.98 -162.98 0.92 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.899 -179.93 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.63 ' CD1' ' HB2' ' A' ' 8' ' ' LEU . 4.1 pp -68.89 -172.84 0.42 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.447 179.691 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' SER . . . . . 0.464 ' O ' ' CD1' ' A' ' 3' ' ' LEU . 0.1 OUTLIER -63.97 130.72 45.21 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.135 0.493 . . . . 0.0 112.03 -179.035 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.524 ' CD1' ' CD2' ' A' ' 117' ' ' LEU . 0.1 OUTLIER -51.08 -65.74 0.5 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.025 -179.939 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' SER . . . . . 0.426 ' OG ' ' N ' ' A' ' 128' ' ' ARG . 1.0 OUTLIER -48.96 -30.12 5.6 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.59 0.234 . . . . 0.0 111.418 -179.244 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . 0.516 ' O ' ' HB3' ' A' ' 11' ' ' GLN . 0.9 OUTLIER -73.39 -44.83 57.66 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.046 0.45 . . . . 0.0 109.973 179.385 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.63 ' HB2' ' CD1' ' A' ' 3' ' ' LEU . 1.5 tp -73.8 -30.57 62.8 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.964 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' HIS . . . . . 0.487 ' CE1' ' HA ' ' A' ' 118' ' ' GLU . 21.4 t60 -68.25 -54.3 18.59 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 121.677 0.751 . . . . 0.0 109.214 179.656 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.494 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 0.6 OUTLIER -63.57 -36.89 85.29 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 114.584 -1.189 . . . . 0.0 108.988 179.164 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.556 ' HG3' ' CG2' ' A' ' 31' ' ' VAL . 0.0 OUTLIER -60.49 -65.47 0.68 Allowed 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.917 178.477 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' VAL . . . . . 0.576 ' HA ' ' CD1' ' A' ' 15' ' ' LEU . 5.7 p -56.69 -51.99 59.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.809 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.519 ' O ' ' HB2' ' A' ' 17' ' ' GLN . 2.5 p -63.49 -27.3 69.18 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.224 -179.388 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.494 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -76.81 -41.03 45.94 Favored 'General case' 0 CA--C 1.514 -0.405 0 C-N-CA 120.281 -0.568 . . . . 0.0 111.344 -179.02 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.576 ' CD1' ' HA ' ' A' ' 12' ' ' VAL . 0.1 OUTLIER -68.67 -53.2 23.74 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 119.707 -0.797 . . . . 0.0 110.043 179.627 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . 0.727 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 10.4 p -65.47 -47.84 85.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.75 -178.483 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.519 ' HB2' ' O ' ' A' ' 13' ' ' SER . 1.0 OUTLIER -61.76 -18.65 60.64 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.169 -0.612 . . . . 0.0 110.964 -179.783 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.419 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 1.5 pt20 -158.84 61.65 0.42 Allowed 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 120.73 -0.388 . . . . 0.0 111.869 179.557 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.476 ' N ' ' O ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER 169.87 -44.59 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.331 179.339 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.727 ' HB2' ' HA ' ' A' ' 16' ' ' VAL . 14.7 m -105.69 -28.41 10.72 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.387 -179.39 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.403 ' N ' ' O ' ' A' ' 16' ' ' VAL . . . 79.41 -59.7 4.35 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.245 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -173.55 21.77 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 120.617 0.246 . . . . 0.0 111.227 179.712 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -61.09 -156.81 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.736 -179.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.63 ' HB ' ' HB3' ' A' ' 34' ' ' ASN . 0.3 OUTLIER -103.56 149.78 24.56 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 179.854 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -105.0 128.54 9.48 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.448 -0.882 . . . . 0.0 113.224 -179.009 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.625 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 0.0 OUTLIER -104.6 129.19 52.73 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 178.884 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.564 ' O ' ' HB2' ' A' ' 28' ' ' ARG . 0.3 OUTLIER -104.14 165.63 10.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.545 -179.024 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.564 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER 144.97 50.16 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.488 1.115 . . . . 0.0 109.949 179.891 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 93.7 -9.61 73.38 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 120.912 -0.661 . . . . 0.0 111.67 -179.1 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.466 ' C ' ' ND2' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -165.58 156.17 13.44 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 179.713 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.625 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 0.6 OUTLIER -109.5 132.18 58.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 C-N-CA 119.785 -0.766 . . . . 0.0 111.237 179.727 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.428 ' CB ' ' HG3' ' A' ' 26' ' ' LYS . . . -117.41 166.96 11.71 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.869 -1.059 . . . . 0.0 110.859 -179.406 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.418 ' CB ' ' OG ' ' A' ' 20' ' ' SER . . . -103.28 119.49 38.97 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.16 0.505 . . . . 0.0 111.3 -179.393 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.63 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 8.3 t30 -100.0 137.02 39.03 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.73 -179.728 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.7 ttmp? -121.9 9.9 10.1 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.51 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.63 -61.02 2.58 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 120.963 0.411 . . . . 0.0 110.428 179.709 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.517 ' CG2' ' CE1' ' A' ' 39' ' ' PHE . 0.1 OUTLIER -137.04 -78.94 0.39 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.264 179.339 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.455 ' O ' ' CG2' ' A' ' 24' ' ' THR . 9.3 t 176.03 -41.95 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.059 0.457 . . . . 0.0 111.352 179.727 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.517 ' CE1' ' CG2' ' A' ' 37' ' ' THR . 9.0 m-85 59.52 135.68 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.798 0.809 . . . . 0.0 111.498 -178.966 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLN . . . . . 0.599 ' H ' ' NE2' ' A' ' 107' ' ' GLN . 0.3 OUTLIER -169.41 76.61 0.1 Allowed 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.586 -1.188 . . . . 0.0 108.835 179.645 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.446 ' C ' ' HB2' ' A' ' 105' ' ' SER . . . 69.37 106.04 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.615 0 CA-C-N 115.353 -0.839 . . . . 0.0 112.696 -178.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.663 ' HB2' ' NE2' ' A' ' 107' ' ' GLN . 5.3 tp -159.01 -141.77 0.09 Allowed 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 178.798 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -162.72 25.62 0.1 Allowed 'General case' 0 C--N 1.33 -0.241 0 O-C-N 122.204 -0.31 . . . . 0.0 111.693 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.43 ' CG2' ' O ' ' A' ' 48' ' ' ALA . 29.4 mt 63.36 5.04 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 179.576 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -87.18 -55.55 3.76 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.801 0.334 . . . . 0.0 111.474 -179.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.74 -28.34 61.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.152 -179.627 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.14 80.19 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.196 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.606 ' HB2' ' OE1' ' A' ' 107' ' ' GLN . . . -151.52 132.5 14.26 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.714 0.292 . . . . 0.0 111.21 -179.634 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.2 mtt-85 -68.14 -177.18 0.81 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.745 0.307 . . . . 0.0 110.398 179.232 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.516 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 0.9 OUTLIER -87.8 -35.92 17.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.001 0.429 . . . . 0.0 110.766 179.821 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.592 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 18.2 p -56.05 -62.78 1.47 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.171 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.467 ' OE2' ' HB2' ' A' ' 48' ' ' ALA . 0.0 OUTLIER -34.72 -67.08 0.15 Allowed 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.882 -179.811 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.536 ' HB3' ' O ' ' A' ' 106' ' ' ASP . 2.7 ptpt -56.87 -46.75 81.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.418 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.471 ' CG2' ' O ' ' A' ' 50' ' ' GLU . 97.8 t -54.7 -41.32 55.39 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-O 121.046 0.45 . . . . 0.0 110.038 179.439 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.469 ' CE1' ' HB2' ' A' ' 113' ' ' ALA . 1.9 t80 -61.63 -49.75 75.34 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.872 178.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.488 ' HA ' ' SD ' ' A' ' 108' ' ' MET . . . -50.44 -48.06 56.49 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.108 179.805 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -62.25 -47.02 86.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.639 179.581 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' THR . . . . . 0.427 HG21 ' CD2' ' A' ' 27' ' ' LEU . 24.0 p -63.7 -49.5 72.87 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.378 -179.696 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . 0.509 HG22 HG22 ' A' ' 63' ' ' VAL . 14.0 p -65.67 -48.89 80.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.786 179.76 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.429 ' N ' HG11 ' A' ' 59' ' ' VAL . 13.1 tp -50.25 -49.9 51.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.725 0.298 . . . . 0.0 110.774 179.588 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.6 m -63.93 -41.81 97.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.736 179.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.21 -20.86 64.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.961 179.756 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' VAL . . . . . 0.617 HG12 HG11 ' A' ' 66' ' ' VAL . 4.6 t -105.01 37.81 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.061 0.458 . . . . 0.0 111.121 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.494 ' O ' ' HB2' ' A' ' 65' ' ' ASN . . . -65.64 91.23 0.13 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.677 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.494 ' HB2' ' O ' ' A' ' 64' ' ' ALA . 10.0 m120 93.28 -61.11 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.679 -0.691 . . . . 0.0 112.22 179.514 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.617 HG11 HG12 ' A' ' 63' ' ' VAL . 33.7 m 39.03 -140.08 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -179.387 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' VAL . . . . . 0.561 ' CG1' ' O ' ' A' ' 67' ' ' VAL . 4.6 p -175.62 67.42 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 CA-C-O 121.71 0.767 . . . . 0.0 111.215 179.63 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.531 ' N ' ' O ' ' A' ' 98' ' ' SER . 2.4 mp -62.66 103.69 0.45 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.86 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' THR . . . . . 0.828 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 0.6 OUTLIER -78.42 -177.88 5.48 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.642 179.278 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -37.34 -37.42 0.19 Allowed 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.3 -179.257 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.513 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 2.5 tt0 -66.12 -65.43 0.68 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.987 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.55 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 82.3 m-20 -60.3 -28.09 67.83 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.087 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 36.5 m -64.0 -64.06 0.99 Allowed 'General case' 0 C--O 1.239 0.516 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 178.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.488 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . . . -56.68 -25.11 53.13 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 108.787 -0.819 . . . . 0.0 108.787 177.407 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.562 ' CG ' ' CG2' ' A' ' 115' ' ' VAL . 0.3 OUTLIER -59.35 -54.63 44.55 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 114.733 -1.121 . . . . 0.0 110.224 178.743 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.426 ' HG ' ' CG1' ' A' ' 115' ' ' VAL . 1.9 mt -64.49 -48.04 76.71 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.838 0.352 . . . . 0.0 110.181 179.272 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.488 ' CD2' ' HA ' ' A' ' 74' ' ' ALA . 0.4 OUTLIER -63.83 -23.62 67.43 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.034 -179.765 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -78.37 -47.83 16.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.833 0.349 . . . . 0.0 110.883 179.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -64.6 -33.75 76.65 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.184 179.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' THR . . . . . 0.432 ' CG2' ' CD2' ' A' ' 88' ' ' TYR . 11.4 p -78.09 -62.8 1.56 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.943 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . . . . . . . . . 67.9 t -57.0 -24.36 20.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.128 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -47.14 -39.63 13.98 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.794 0.33 . . . . 0.0 110.936 179.792 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 175.36 163.58 0.29 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.052 179.811 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.453 ' CB ' ' HG2' ' A' ' 40' ' ' GLN . 8.0 m-80 61.99 -173.84 0.14 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.221 179.675 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -77.78 -175.66 4.04 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.396 -179.64 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 58.9 t-20 -132.47 135.4 46.01 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.72 -179.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . 0.472 ' HA ' ' HB2' ' A' ' 104' ' ' ARG . 7.0 p30 -123.01 5.53 9.3 Favored 'General case' 0 C--O 1.243 0.738 0 CA-C-O 120.871 0.367 . . . . 0.0 111.968 -179.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.509 ' HA ' ' CB ' ' A' ' 102' ' ' SER . 1.3 m-85 -99.79 135.62 40.94 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 120.435 -0.506 . . . . 0.0 110.447 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.697 ' HB3' ' O ' ' A' ' 101' ' ' VAL . 0.7 OUTLIER -107.47 142.44 37.33 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 -179.93 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 11.1 mt -132.23 147.24 52.4 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 113.337 0.865 . . . . 0.0 113.337 -176.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.416 ' O ' ' OG ' ' A' ' 98' ' ' SER . 0.0 OUTLIER -133.47 127.81 34.09 Favored 'General case' 0 C--O 1.224 -0.261 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 177.845 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' SER . . . . . 0.424 ' O ' ' CG1' ' A' ' 93' ' ' VAL . 0.7 OUTLIER -104.39 145.95 29.53 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 113.955 1.094 . . . . 0.0 113.955 -177.428 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 0.424 ' CG1' ' O ' ' A' ' 92' ' ' SER . 4.9 m -166.62 -124.68 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-N 113.691 -1.595 . . . . 0.0 108.558 179.09 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 36.85 34.33 0.1 OUTLIER Glycine 0 C--N 1.336 0.564 0 C-N-CA 121.143 -0.551 . . . . 0.0 114.202 178.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . 0.407 ' O ' ' ND2' ' A' ' 95' ' ' ASN . 1.5 p-10 40.64 34.54 0.25 Allowed 'General case' 0 C--O 1.231 0.131 0 CA-C-O 121.325 0.583 . . . . 0.0 110.945 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 140.39 -3.82 2.46 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.58 -179.026 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.828 ' HA ' ' HA ' ' A' ' 69' ' ' THR . 0.1 OUTLIER -112.8 166.36 11.44 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.702 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' SER . . . . . 0.531 ' O ' ' N ' ' A' ' 68' ' ' LEU . 3.1 t -140.19 163.02 33.85 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.482 0.658 . . . . 0.0 111.32 -179.517 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.443 HG23 ' HA ' ' A' ' 65' ' ' ASN . 1.2 t -107.45 146.23 13.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-N 115.04 -0.982 . . . . 0.0 108.74 178.912 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.495 ' CD2' HG11 ' A' ' 63' ' ' VAL . 0.1 OUTLIER -103.87 114.36 28.56 Favored 'General case' 0 CA--C 1.513 -0.454 0 C-N-CA 119.766 -0.774 . . . . 0.0 112.136 -179.662 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' VAL . . . . . 0.697 ' O ' ' HB3' ' A' ' 89' ' ' ASP . 0.9 OUTLIER -120.36 104.19 15.1 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.015 0 N-CA-C 104.288 -2.486 . . . . 0.0 104.288 175.453 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' SER . . . . . 0.608 ' O ' ' HB2' ' A' ' 103' ' ' LEU . 0.9 OUTLIER -141.39 152.51 44.39 Favored 'General case' 0 C--N 1.307 -1.263 0 C-N-CA 119.807 -0.757 . . . . 0.0 112.713 -174.907 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.608 ' HB2' ' O ' ' A' ' 102' ' ' SER . 0.4 OUTLIER 147.7 59.66 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 114.506 -1.224 . . . . 0.0 112.441 176.529 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.472 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -83.86 -6.38 59.41 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.308 -0.86 . . . . 0.0 108.739 177.434 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.608 ' HB3' ' N ' ' A' ' 42' ' ' LEU . 58.7 m -177.92 171.92 1.72 Allowed 'General case' 0 C--O 1.232 0.147 0 CA-C-N 114.553 -1.203 . . . . 0.0 108.105 179.258 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ASP . . . . . 0.536 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -104.74 101.88 11.48 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 119.693 -0.803 . . . . 0.0 112.754 -178.492 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLN . . . . . 0.663 ' NE2' ' HB2' ' A' ' 42' ' ' LEU . 0.7 OUTLIER -169.76 162.99 9.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.273 177.534 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' MET . . . . . 0.488 ' SD ' ' HA ' ' A' ' 56' ' ' ALA . 0.3 OUTLIER -165.77 144.15 5.94 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.426 -0.51 . . . . 0.0 112.142 179.005 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' THR . . . . . 0.485 ' HA ' ' HA ' ' A' ' 24' ' ' THR . 30.2 p -110.11 165.29 11.86 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.719 179.362 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' LEU . . . . . 0.45 ' HB3' ' HB ' ' A' ' 16' ' ' VAL . 6.5 mt -52.46 -59.18 4.74 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.584 179.615 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' GLN . . . . . 0.538 ' HA ' ' CD ' ' A' ' 114' ' ' LYS . 13.6 tp60 -47.67 -65.48 0.56 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.817 0.342 . . . . 0.0 110.634 179.577 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' ASP . . . . . 0.491 ' HA ' HG23 ' A' ' 115' ' ' VAL . 16.5 m-20 -46.63 -45.98 19.49 Favored 'General case' 0 C--O 1.236 0.395 0 CA-C-O 121.477 0.656 . . . . 0.0 110.429 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' ALA . . . . . 0.532 ' O ' HD12 ' A' ' 117' ' ' LEU . . . -51.65 -63.32 1.17 Allowed 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.35 179.256 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . 0.575 ' HE3' ' CG1' ' A' ' 16' ' ' VAL . 0.0 OUTLIER -62.04 -20.05 63.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.281 179.902 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.562 ' CG2' ' CG ' ' A' ' 75' ' ' LYS . 74.2 t -65.06 -65.11 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.886 0 CA-C-O 122.013 0.911 . . . . 0.0 109.967 179.399 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.592 ' O ' ' HB3' ' A' ' 120' ' ' ALA . 0.1 OUTLIER -61.62 -35.58 78.29 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.399 179.693 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' LEU . . . . . 0.535 HD23 ' HB3' ' A' ' 8' ' ' LEU . 0.3 OUTLIER -70.51 -24.24 62.8 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.9 179.36 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' GLU . . . . . 0.487 ' HA ' ' CE1' ' A' ' 9' ' ' HIS . 1.7 tt0 -69.35 -46.85 66.02 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 106.741 -1.578 . . . . 0.0 106.741 177.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' ALA . . . . . 0.479 ' CB ' ' HG ' ' A' ' 68' ' ' LEU . . . -77.52 -22.18 51.57 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 114.695 -1.139 . . . . 0.0 110.236 177.651 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' ALA . . . . . 0.592 ' HB3' ' O ' ' A' ' 116' ' ' LEU . . . -75.06 -56.71 4.46 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.78 179.471 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.528 ' O ' ' N ' ' A' ' 126' ' ' GLY . 0.0 OUTLIER -60.8 -37.43 81.93 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 178.208 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' ARG . . . . . 0.475 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.5 OUTLIER -60.99 -46.37 91.04 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.356 179.97 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -95.29 -19.5 19.93 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -177.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' GLU . . . . . 0.445 ' CG ' ' O ' ' A' ' 120' ' ' ALA . 2.9 mm-40 -95.32 -66.62 0.9 Allowed 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.867 0.691 . . . . 0.0 112.867 -178.393 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 1.2 p -96.07 -65.32 0.98 Allowed 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -178.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' GLY . . . . . 0.528 ' N ' ' O ' ' A' ' 121' ' ' LEU . . . 83.81 73.42 1.25 Allowed Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 110.182 -1.167 . . . . 0.0 110.182 -177.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . 74.55 32.44 0.91 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 -177.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' ARG . . . . . 0.426 ' N ' ' OG ' ' A' ' 6' ' ' SER . 0.0 OUTLIER 77.68 112.92 0.07 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 114.823 -1.08 . . . . 0.0 110.931 -179.598 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . -92.55 19.62 49.58 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.572 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.0 m . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.893 179.983 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.088 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -176.43 75.69 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.861 0.362 . . . . 0.0 110.889 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 58.85 -172.62 0.1 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.802 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 204' ' ' PTR . . . . . 0.411 ' O ' ' N ' ' B' ' 206' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -57.05 82.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.096 -0.502 . . . . 0.0 112.141 -178.833 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 206' ' ' ASP . . . . . 0.411 ' N ' ' O ' ' B' ' 204' ' ' PTR . 0.1 OUTLIER 49.87 175.63 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.814 179.104 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 207' ' ' PRO . . . . . 0.434 ' O ' ' CD1' ' B' ' 208' ' ' PHE . 77.7 Cg_endo -88.76 108.04 0.48 Allowed 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 122.925 2.417 . . . . 0.0 112.467 -179.845 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 208' ' ' PHE . . . . . 0.537 ' HB3' ' NE2' ' A' ' 11' ' ' GLN . 0.7 OUTLIER 35.95 -162.0 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.038 -0.528 . . . . 0.0 112.358 179.58 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 209' ' ' NH2 . . . . . 0.527 ' N ' ' CG ' ' B' ' 208' ' ' PHE . . . . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.649 -0.251 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 2' ' ' ASN . . . . . 0.423 ' HB3' ' CG2' ' A' ' 58' ' ' THR . 0.0 OUTLIER . . . . . 0 CA--C 1.528 0.133 0 CA-C-O 120.678 0.275 . . . . 0.0 110.918 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.798 HD11 ' N ' ' A' ' 30' ' ' ASN . 5.1 mp -73.1 172.89 10.21 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.909 0.385 . . . . 0.0 110.497 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.4 p -88.62 135.68 33.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.077 179.157 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.532 HD21 ' HB3' ' A' ' 62' ' ' HIS . 2.9 mt -37.4 -62.02 0.55 Allowed 'General case' 0 CA--C 1.504 -0.792 0 CA-C-O 121.434 0.635 . . . . 0.0 111.712 -179.621 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -40.44 -65.01 0.45 Allowed 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 114.553 -1.203 . . . . 0.0 111.378 -179.192 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ASP . . . . . 0.543 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 0.7 OUTLIER -61.63 -44.57 96.74 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.982 0.42 . . . . 0.0 109.95 178.873 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.867 ' HB3' HD22 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -45.41 -65.0 0.6 Allowed 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.791 178.87 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 9' ' ' HIS . . . . . 0.66 ' CB ' HD22 ' A' ' 121' ' ' LEU . 15.4 t-80 -52.77 -39.87 62.64 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.603 178.601 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.543 ' HB2' ' O ' ' A' ' 7' ' ' ASP . 8.3 mmt180 -56.94 -62.48 1.71 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.846 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.757 ' HG3' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -64.75 -53.26 49.93 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 120.299 -0.561 . . . . 0.0 111.168 179.894 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.924 ' O ' HG23 ' A' ' 16' ' ' VAL . 8.1 p -53.96 -51.07 49.12 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 C-N-CA 120.63 -0.428 . . . . 0.0 111.343 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.584 ' HA ' ' CE ' ' A' ' 114' ' ' LYS . 21.6 t -63.68 -31.19 72.28 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -179.552 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 20.0 tpp180 -70.99 -35.3 72.05 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 120.236 -0.585 . . . . 0.0 110.966 -178.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.776 HD12 ' HA ' ' A' ' 12' ' ' VAL . 0.1 OUTLIER -75.35 -52.66 10.28 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 119.974 -0.691 . . . . 0.0 110.593 179.841 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.924 HG23 ' O ' ' A' ' 12' ' ' VAL . 1.8 t -60.81 -55.14 26.6 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.96 -179.367 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -61.02 -17.83 54.37 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -178.215 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 15.9 pt20 -170.39 71.44 0.06 Allowed 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.527 -0.469 . . . . 0.0 111.977 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.479 ' HB2' ' HA ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER 170.3 -38.18 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.117 179.382 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.414 ' N ' ' O ' ' A' ' 15' ' ' LEU . 70.1 m -115.33 -24.03 8.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.54 -179.362 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 56.66 55.34 30.45 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.457 -0.877 . . . . 0.0 111.945 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.417 ' HA ' ' CG1' ' A' ' 16' ' ' VAL . 0.3 OUTLIER 59.97 82.9 0.14 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.136 0.493 . . . . 0.0 110.768 -179.544 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.421 ' O ' ' HB ' ' A' ' 109' ' ' THR . 0.1 OUTLIER -133.97 -151.9 0.46 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.703 179.851 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.671 ' HB ' ' HB3' ' A' ' 34' ' ' ASN . 0.2 OUTLIER -103.9 134.37 47.31 Favored 'General case' 0 CA--C 1.52 -0.184 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.179 179.609 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.406 ' CA ' ' HG ' ' A' ' 110' ' ' LEU . . . -104.5 141.01 15.19 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.399 -0.905 . . . . 0.0 112.619 -179.11 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.852 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -104.5 130.27 52.44 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 179.877 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.565 HD13 ' CD1' ' A' ' 55' ' ' PHE . 0.7 OUTLIER -111.12 153.17 26.09 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.296 0.57 . . . . 0.0 112.293 -178.468 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.403 ' HD2' ' NZ ' ' A' ' 26' ' ' LYS . 2.7 mtm180 161.2 61.35 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.188 179.559 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.769 ' C ' HD11 ' A' ' 3' ' ' LEU . . . 79.74 -0.34 82.31 Favored Glycine 0 N--CA 1.45 -0.379 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 -177.777 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.798 ' N ' HD11 ' A' ' 3' ' ' LEU . 0.1 OUTLIER -165.93 165.84 17.87 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 -179.682 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.757 HG12 ' HG3' ' A' ' 11' ' ' GLN . 9.1 p -111.9 137.91 42.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.24 0.543 . . . . 0.0 111.074 178.542 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.852 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -125.39 165.72 17.89 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.783 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -103.93 127.89 51.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.295 0.569 . . . . 0.0 111.717 -179.21 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.671 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 50.3 t30 -116.3 115.93 26.81 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.628 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.68 -28.6 3.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.279 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -48.6 -72.6 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.207 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.541 ' C ' HG22 ' A' ' 38' ' ' THR . 57.9 p -86.95 -103.43 0.07 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.423 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.585 ' O ' HG21 ' A' ' 24' ' ' THR . 0.2 OUTLIER 164.66 -111.69 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.626 ' HB3' HG21 ' A' ' 24' ' ' THR . 0.1 OUTLIER 172.54 -164.61 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 179.98 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.581 ' N ' ' CG ' ' A' ' 39' ' ' PHE . 0.2 OUTLIER 160.34 37.6 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.078 0.551 . . . . 0.0 110.494 179.501 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.556 ' C ' ' HB2' ' A' ' 107' ' ' GLN . . . 77.72 -26.24 2.03 Favored Glycine 0 CA--C 1.526 0.727 0 CA-C-N 115.755 -0.657 . . . . 0.0 113.091 -179.159 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.509 HD13 ' HG3' ' A' ' 40' ' ' GLN . 1.8 mp -32.62 135.03 0.09 Allowed 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.61 HG23 ' HB2' ' A' ' 106' ' ' ASP . 3.4 m -95.39 36.08 1.27 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.422 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.597 HG22 ' O ' ' A' ' 44' ' ' ILE . 5.1 mp 66.02 0.0 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.079 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -74.92 -25.56 59.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.927 0.394 . . . . 0.0 110.761 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.5 t -101.33 -66.01 0.94 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.144 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -170.59 52.25 0.19 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.602 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.662 ' HB1' ' NE2' ' A' ' 107' ' ' GLN . . . -113.34 -178.73 3.45 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.015 0.436 . . . . 0.0 111.11 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.72 126.28 51.97 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.786 179.268 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.809 ' O ' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -46.97 -28.36 1.6 Allowed 'General case' 0 C--O 1.233 0.206 0 CA-C-O 120.98 0.419 . . . . 0.0 110.468 179.848 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 51' ' ' SER . . . . . 0.536 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 82.7 p -59.22 -62.49 1.84 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.935 179.502 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.51 ' CB ' ' HG2' ' A' ' 107' ' ' GLN . 0.4 OUTLIER -42.65 -57.6 2.65 Favored 'General case' 0 C--O 1.231 0.082 0 CA-C-O 121.188 0.518 . . . . 0.0 110.435 179.639 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.433 ' HB3' HD11 ' A' ' 44' ' ' ILE . 0.1 OUTLIER -46.85 -61.9 1.64 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.88 179.151 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.809 HG23 ' O ' ' A' ' 50' ' ' GLU . 30.9 t -50.07 -46.86 24.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.812 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.736 ' O ' HG13 ' A' ' 59' ' ' VAL . 0.4 OUTLIER -58.95 -33.42 70.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.329 179.263 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.497 ' HA ' HG22 ' A' ' 59' ' ' VAL . . . -67.76 -43.91 78.71 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.847 179.628 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.1 mm-40 -67.42 -33.87 76.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.057 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.423 ' CG2' ' HB3' ' A' ' 2' ' ' ASN . 11.8 p -77.46 -41.29 40.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.061 -179.507 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.894 ' O ' HG22 ' A' ' 63' ' ' VAL . 21.0 m -73.49 -31.28 32.42 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.844 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.538 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.659 HD13 ' O ' ' A' ' 102' ' ' SER . 10.1 tp -77.84 -37.89 47.42 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-O 120.906 0.384 . . . . 0.0 110.101 178.939 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 6.3 t -67.73 -53.06 30.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.793 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' HIS . . . . . 0.532 ' HB3' HD21 ' A' ' 5' ' ' LEU . 2.0 m-70 -47.82 -50.17 26.88 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 120.791 0.329 . . . . 0.0 110.199 179.471 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 1.036 HG12 HG11 ' A' ' 66' ' ' VAL . 0.9 OUTLIER -68.38 -74.48 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.35 179.48 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.712 ' H ' HG23 ' A' ' 63' ' ' VAL . . . 60.91 13.95 4.88 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.506 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.457 ' CB ' ' O ' ' A' ' 64' ' ' ALA . 1.2 m-20 159.72 -66.47 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 120.849 0.357 . . . . 0.0 111.644 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 1.036 HG11 HG12 ' A' ' 63' ' ' VAL . 14.8 m 48.11 -127.66 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 115.79 -0.641 . . . . 0.0 112.248 -179.199 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.522 ' O ' ' O ' ' A' ' 98' ' ' SER . 5.9 p -174.54 -18.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 N-CA-C 113.107 0.781 . . . . 0.0 113.107 -179.303 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.822 HD23 ' HB3' ' A' ' 72' ' ' ASP . 3.5 mp 32.81 105.05 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 178.688 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 18.9 p -66.12 -153.42 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 177.612 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -68.64 -34.54 75.9 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.122 0.487 . . . . 0.0 110.114 179.312 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.44 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 0.8 OUTLIER -64.04 -65.77 0.63 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.362 -179.631 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.822 ' HB3' HD23 ' A' ' 68' ' ' LEU . 1.0 OUTLIER -50.92 -32.26 20.14 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.755 0.312 . . . . 0.0 110.936 -179.929 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 85.1 m -62.61 -63.51 1.2 Allowed 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.4 -24.43 59.99 Favored 'General case' 0 C--N 1.333 -0.116 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 177.778 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 1.087 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.2 OUTLIER -57.13 -65.42 0.62 Allowed 'General case' 0 C--O 1.236 0.36 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.514 179.074 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.845 HD21 HD11 ' A' ' 116' ' ' LEU . 0.5 OUTLIER -60.48 -42.22 95.82 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 178.913 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -54.15 -36.45 63.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.801 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -75.66 -60.45 2.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.321 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.58 -32.05 70.02 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.206 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 54.5 m . . . . . 0 C--N 1.328 -0.326 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.346 -179.644 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ASN . . . . . 0.405 ' HA ' ' HB2' ' A' ' 104' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.181 0 CA-C-O 120.446 0.165 . . . . 0.0 110.774 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.522 ' CZ ' ' CG ' ' A' ' 112' ' ' ASP . 2.5 m-85 -96.59 141.8 29.42 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 121.038 0.447 . . . . 0.0 110.757 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.732 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.5 OUTLIER -117.06 140.29 49.67 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 179.732 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.841 HD23 ' HA ' ' A' ' 100' ' ' LEU . 34.0 mt -143.31 154.55 43.89 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -177.018 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.421 ' CG ' HG12 ' A' ' 99' ' ' VAL . 0.0 OUTLIER -143.77 131.9 21.82 Favored 'General case' 0 C--O 1.223 -0.334 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 177.176 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.665 ' O ' HG13 ' A' ' 93' ' ' VAL . 54.2 p -103.96 146.01 29.31 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 -176.701 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.665 HG13 ' O ' ' A' ' 92' ' ' SER . 10.4 m . . . . . 0 CA--C 1.541 0.614 0 CA-C-N 113.616 -1.629 . . . . 0.0 108.683 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.448 ' CB ' HG22 ' A' ' 67' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.225 -0.197 0 CA-C-O 120.697 0.284 . . . . 0.0 110.385 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.522 ' O ' ' O ' ' A' ' 67' ' ' VAL . 4.1 t -140.49 162.88 34.3 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.371 0.605 . . . . 0.0 110.834 -179.581 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.421 HG12 ' CG ' ' A' ' 91' ' ' ARG . 1.2 t -103.18 136.8 34.13 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.957 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 178.658 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.841 ' HA ' HD23 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -104.3 110.37 22.58 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-O 121.911 0.863 . . . . 0.0 113.032 -177.695 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.732 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -118.69 103.61 14.81 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.997 0 N-CA-C 103.878 -2.638 . . . . 0.0 103.878 175.023 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 102' ' ' SER . . . . . 0.659 ' O ' HD13 ' A' ' 60' ' ' LEU . 0.3 OUTLIER -139.75 154.59 47.46 Favored 'General case' 0 C--N 1.309 -1.192 0 C-N-CA 119.015 -1.074 . . . . 0.0 113.732 -174.756 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.548 HD23 ' O ' ' A' ' 102' ' ' SER . 0.0 OUTLIER 166.81 -91.38 0.0 OUTLIER 'General case' 0 N--CA 1.438 -1.063 0 CA-C-N 113.662 -1.608 . . . . 0.0 111.515 176.796 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.574 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 48.6 59.18 4.53 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 -179.532 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.574 ' CB ' ' O ' ' A' ' 104' ' ' ARG . 4.9 t 102.53 157.82 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 -176.479 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.61 ' HB2' HG23 ' A' ' 43' ' ' THR . 0.6 OUTLIER -104.95 100.87 10.47 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 119.211 -0.996 . . . . 0.0 112.799 -178.685 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.662 ' NE2' ' HB1' ' A' ' 48' ' ' ALA . 7.4 tt0 -168.03 122.92 0.97 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.838 -1.074 . . . . 0.0 109.874 177.325 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.491 ' HG2' HG21 ' A' ' 59' ' ' VAL . 0.0 OUTLIER -122.8 164.46 18.33 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.172 0.51 . . . . 0.0 111.531 179.967 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 109' ' ' THR . . . . . 0.524 HG22 HG23 ' A' ' 24' ' ' THR . 1.5 p -121.79 165.4 15.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.771 -179.63 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.815 ' HB3' HG22 ' A' ' 16' ' ' VAL . 5.5 mt -51.86 -49.87 62.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.778 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' GLN . . . . . 0.902 ' O ' HG23 ' A' ' 115' ' ' VAL . 3.4 tp-100 -59.82 -64.05 1.09 Allowed 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.119 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 0.722 ' O ' HD22 ' A' ' 116' ' ' LEU . 24.8 m-20 -48.02 -44.87 31.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.901 179.434 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 0.548 ' HB1' ' CZ ' ' A' ' 55' ' ' PHE . . . -56.4 -54.2 48.42 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.08 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.584 ' CE ' ' HA ' ' A' ' 13' ' ' SER . 0.3 OUTLIER -62.5 -34.68 77.34 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.505 179.413 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 1.087 HG22 ' CG ' ' A' ' 75' ' ' LYS . 84.4 t -55.84 -65.48 0.37 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.827 0 CA-C-O 121.931 0.872 . . . . 0.0 111.299 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.845 HD11 HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -59.93 -37.75 80.4 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.311 -179.106 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.867 HD22 ' HB3' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -73.66 -21.36 60.3 Favored 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 120.505 -0.478 . . . . 0.0 111.621 -179.994 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.486 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 0.1 OUTLIER -69.17 -47.4 65.04 Favored 'General case' 0 CA--C 1.503 -0.83 0 N-CA-C 106.442 -1.688 . . . . 0.0 106.442 177.479 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.436 ' CB ' ' HG ' ' A' ' 68' ' ' LEU . . . -76.12 -25.31 55.26 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 114.747 -1.115 . . . . 0.0 109.909 177.211 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.827 ' HB3' ' HA ' ' A' ' 117' ' ' LEU . . . -69.8 -60.64 2.18 Favored 'General case' 0 CA--C 1.508 -0.666 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.979 179.395 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.66 HD22 ' CB ' ' A' ' 9' ' ' HIS . 0.2 OUTLIER -62.4 -39.39 93.09 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.193 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.58 ' N ' ' HG ' ' A' ' 121' ' ' LEU . 0.1 OUTLIER -52.37 -58.18 7.49 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.186 179.481 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 29.0 mm100 -81.74 -26.37 34.59 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 -178.577 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' GLU . . . . . 0.42 ' CG ' ' O ' ' A' ' 120' ' ' ALA . 3.6 mm-40 -96.06 -66.65 0.89 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.847 1.054 . . . . 0.0 113.847 -178.164 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.268 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -177.66 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 2' ' ' ASN . . . . . 0.518 ' C ' HD12 ' A' ' 3' ' ' LEU . 2.5 p30 . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.915 0.388 . . . . 0.0 111.078 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.714 ' HB2' HD13 ' A' ' 8' ' ' LEU . 2.6 mp -164.05 -75.23 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.278 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.411 ' O ' ' CB ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER 171.07 -170.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.726 -179.842 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.725 HD21 ' HB3' ' A' ' 62' ' ' HIS . 6.5 mt -95.52 -63.26 1.18 Allowed 'General case' 0 CA--C 1.505 -0.765 0 CA-C-O 121.293 0.568 . . . . 0.0 111.558 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.41 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -59.54 -47.19 86.48 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 115.195 -0.911 . . . . 0.0 112.075 -178.162 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -65.59 -55.1 19.49 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.33 0.586 . . . . 0.0 110.021 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.744 HD23 ' CD2' ' A' ' 117' ' ' LEU . 8.6 tp -55.2 -45.7 75.86 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.102 179.019 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' HIS . . . . . 0.448 ' HA ' HG12 ' A' ' 12' ' ' VAL . 76.4 t60 -54.4 -45.66 72.96 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.227 179.154 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.41 ' HG3' ' O ' ' A' ' 6' ' ' SER . 36.9 mtt180 -59.31 -52.88 63.74 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.594 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.522 ' HG3' HG13 ' A' ' 31' ' ' VAL . 3.3 tp-100 -57.31 -57.41 12.74 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 121.149 0.5 . . . . 0.0 110.706 179.461 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.967 HG23 HD13 ' A' ' 110' ' ' LEU . 7.4 p -58.83 -46.11 91.16 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.717 -179.804 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.76 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 35.9 t -55.34 -64.07 0.96 Allowed 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.954 -0.566 . . . . 0.0 112.002 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.464 ' O ' ' CG ' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -60.16 -32.78 71.37 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.056 -179.115 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.522 HD11 ' O ' ' A' ' 31' ' ' VAL . 9.7 mt -59.57 -65.37 0.68 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.925 -179.373 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.797 HG22 ' H ' ' A' ' 22' ' ' ASP . 0.5 OUTLIER -65.53 -24.99 35.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.144 -179.523 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.38 -4.88 47.65 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -178.787 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.464 ' CG ' ' O ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -140.38 23.9 2.31 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 120.392 -0.523 . . . . 0.0 112.382 179.558 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -177.69 -69.85 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.619 ' OG ' ' HB1' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -46.51 -53.06 12.02 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.703 -178.787 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 80.93 37.57 18.66 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.558 -0.83 . . . . 0.0 112.031 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.797 ' H ' HG22 ' A' ' 16' ' ' VAL . 7.7 t70 78.13 21.87 0.84 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.823 0.344 . . . . 0.0 110.715 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.28 -151.97 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.708 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.635 HG23 ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -103.51 165.35 11.09 Favored 'General case' 0 CA--C 1.519 -0.243 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 -179.987 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.641 ' HA3' HD22 ' A' ' 110' ' ' LEU . . . -127.58 156.18 20.4 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.041 -1.076 . . . . 0.0 113.909 -178.721 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.988 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -125.75 123.88 39.8 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.998 -0.601 . . . . 0.0 109.96 179.488 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.839 HD13 HG21 ' A' ' 58' ' ' THR . 2.6 tt -113.15 144.34 42.82 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.419 0.628 . . . . 0.0 111.922 -179.376 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.409 ' HD3' ' HD3' ' A' ' 26' ' ' LYS . 0.0 OUTLIER 169.77 54.23 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.729 179.672 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.612 ' O ' HD21 ' A' ' 3' ' ' LEU . . . 109.17 -19.31 29.88 Favored Glycine 0 N--CA 1.45 -0.433 0 N-CA-C 110.468 -1.053 . . . . 0.0 110.468 -177.673 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.481 ' N ' HD11 ' A' ' 3' ' ' LEU . 0.1 OUTLIER -166.14 165.45 17.67 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 179.481 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.555 HG23 ' CE2' ' A' ' 55' ' ' PHE . 2.1 p -106.74 133.38 51.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 121.348 0.594 . . . . 0.0 110.836 178.877 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.988 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -123.52 166.27 15.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.404 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.619 ' HB1' ' OG ' ' A' ' 20' ' ' SER . . . -102.61 138.42 39.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.543 0.687 . . . . 0.0 112.381 -178.216 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.536 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 9.9 t-20 -114.94 123.5 49.28 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 114.698 -1.137 . . . . 0.0 110.531 -179.603 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.1 mtmp? -135.86 21.96 3.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.068 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -119.02 -24.59 6.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.338 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 4.9 p -118.09 177.55 4.75 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.988 0.423 . . . . 0.0 111.105 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 12.3 p -128.63 115.04 17.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.312 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.635 ' CD1' HG23 ' A' ' 24' ' ' THR . 4.2 p90 -68.45 -84.87 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.591 -179.138 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.553 ' N ' ' CG ' ' A' ' 39' ' ' PHE . 2.6 pm0 63.96 54.45 1.72 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.382 0.673 . . . . 0.0 112.711 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.566 ' O ' ' O ' ' A' ' 42' ' ' LEU . . . 69.2 -50.55 0.56 Allowed Glycine 0 CA--C 1.526 0.72 0 CA-C-N 116.088 -0.505 . . . . 0.0 113.095 179.618 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.821 HD11 ' CB ' ' A' ' 46' ' ' SER . 0.8 OUTLIER 3.94 125.75 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.454 1.101 . . . . 0.0 113.92 179.102 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.679 HG22 ' CG ' ' A' ' 106' ' ' ASP . 0.8 OUTLIER -91.2 56.98 3.28 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.976 -179.617 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.595 HG22 ' O ' ' A' ' 44' ' ' ILE . 1.8 mp 49.55 9.26 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 179.052 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -100.75 -56.78 2.25 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -178.448 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.821 ' CB ' HD11 ' A' ' 42' ' ' LEU . 0.3 OUTLIER -54.5 -26.79 33.65 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.741 -178.883 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 140.51 38.99 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.378 -0.915 . . . . 0.0 112.929 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.736 ' HB1' HE21 ' A' ' 107' ' ' GLN . . . -93.96 -167.04 1.61 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.799 0.333 . . . . 0.0 110.447 179.504 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.467 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 0.7 OUTLIER -128.94 146.86 50.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.574 179.664 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.814 ' O ' HG22 ' A' ' 54' ' ' VAL . 8.5 tt0 -53.14 -24.05 9.62 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.099 0.476 . . . . 0.0 110.706 179.575 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' SER . . . . . 0.585 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -61.7 -65.25 0.72 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.454 -179.441 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.556 ' HB2' ' HG2' ' A' ' 107' ' ' GLN . 0.6 OUTLIER -53.23 -50.52 64.58 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.713 0.292 . . . . 0.0 111.783 -179.221 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.82 ' HD2' HG13 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -55.22 -57.13 13.03 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 111.716 0.265 . . . . 0.0 111.716 -179.35 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.82 HG13 ' HD2' ' A' ' 53' ' ' LYS . 15.7 m -54.36 -47.55 69.42 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 120.662 -0.415 . . . . 0.0 110.383 179.503 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.597 ' O ' HG23 ' A' ' 58' ' ' THR . 0.6 OUTLIER -48.37 -42.72 32.51 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.812 178.785 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.778 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -64.24 -44.95 90.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.316 178.876 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 50.6 mm-40 -56.73 -47.46 79.96 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.13 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.839 HG21 HD13 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -64.02 -64.08 0.98 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.309 -179.702 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.914 HG23 HD12 ' A' ' 117' ' ' LEU . 12.0 p -46.28 -51.73 3.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.971 -179.6 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.507 ' N ' HG13 ' A' ' 59' ' ' VAL . 0.4 OUTLIER -55.6 -49.17 73.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.815 0.341 . . . . 0.0 110.835 179.235 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.8 m -55.57 -60.6 3.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.239 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' HIS . . . . . 0.725 ' HB3' HD21 ' A' ' 5' ' ' LEU . 1.7 m170 -49.51 -37.36 26.31 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 121.094 0.473 . . . . 0.0 110.123 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.892 HG23 ' O ' ' A' ' 59' ' ' VAL . 40.8 t -75.64 -82.19 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.247 179.194 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.493 ' HB3' ' O ' ' A' ' 63' ' ' VAL . . . 72.62 -6.72 1.56 Allowed 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 178.655 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.538 ' OD1' HG13 ' A' ' 99' ' ' VAL . 6.5 m-20 153.46 -61.52 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.394 0.677 . . . . 0.0 109.365 -179.378 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.867 HG12 ' HB3' ' A' ' 123' ' ' GLN . 0.1 OUTLIER 44.23 -100.96 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 CA-C-N 115.243 -0.89 . . . . 0.0 112.842 178.903 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.743 HG22 ' HB3' ' A' ' 97' ' ' ASN . 0.3 OUTLIER 167.38 107.87 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.343 0.289 0 CA-C-O 121.594 0.711 . . . . 0.0 109.833 -179.519 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.842 HD11 ' HB2' ' A' ' 100' ' ' LEU . 0.1 OUTLIER -110.29 112.63 24.71 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.752 -178.071 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.531 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 11.0 p -83.37 178.7 7.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.608 -0.723 . . . . 0.0 110.788 179.291 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -41.0 -31.14 0.16 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.558 -179.696 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -68.97 -57.8 4.98 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.943 0.401 . . . . 0.0 110.396 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.655 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 65.4 m-20 -69.3 -39.87 78.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.722 179.742 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 62.1 m -61.3 -41.23 96.63 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-O 121.296 0.569 . . . . 0.0 109.622 178.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.501 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . . . -71.24 -30.74 66.69 Favored 'General case' 0 CA--C 1.512 -0.506 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 177.744 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 1.074 ' CG ' HG12 ' A' ' 115' ' ' VAL . 0.3 OUTLIER -55.01 -50.36 69.22 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 114.322 -1.308 . . . . 0.0 109.426 177.92 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 1.087 HD13 HD11 ' A' ' 90' ' ' LEU . 1.4 mt -67.29 -56.75 8.49 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.466 179.205 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.608 HD12 ' C ' ' A' ' 77' ' ' LEU . 0.6 OUTLIER -54.57 -26.85 34.85 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.476 179.808 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -72.53 -54.81 8.18 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.232 179.213 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' SER . . . . . 0.411 ' OG ' ' HG3' ' A' ' 111' ' ' GLN . 0.0 OUTLIER -52.65 -36.19 56.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.676 179.551 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 86.0 m . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.788 -179.549 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ASN . . . . . 0.61 ' HA ' ' HB2' ' A' ' 104' ' ' ARG . 56.7 t30 . . . . . 0 C--O 1.238 0.47 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.758 ' CD2' HD22 ' A' ' 76' ' ' LEU . 6.9 p90 -96.73 160.57 14.3 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 121.232 0.539 . . . . 0.0 112.397 -178.587 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.697 ' HB3' ' O ' ' A' ' 101' ' ' VAL . 0.8 OUTLIER -131.9 140.7 49.14 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 178.593 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 1.087 HD11 HD13 ' A' ' 76' ' ' LEU . 8.0 mt -133.94 155.27 50.23 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 -176.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.67 ' O ' ' HB3' ' A' ' 98' ' ' SER . 0.0 OUTLIER -139.96 150.25 44.27 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.293 178.439 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.79 ' O ' HG13 ' A' ' 93' ' ' VAL . 33.7 p -104.47 159.33 15.82 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 121.77 0.795 . . . . 0.0 112.648 -179.02 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.79 HG13 ' O ' ' A' ' 92' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.436 -1.146 0 CA-C-N 113.853 -1.521 . . . . 0.0 108.199 -179.389 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.743 ' HB3' HG22 ' A' ' 67' ' ' VAL . 0.6 OUTLIER . . . . . 0 N--CA 1.438 -1.049 0 N-CA-C 106.86 -1.533 . . . . 0.0 106.86 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.717 ' O ' HD12 ' A' ' 68' ' ' LEU . 3.5 m -147.48 159.85 43.26 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 119.343 -0.943 . . . . 0.0 111.39 -178.274 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.538 HG13 ' OD1' ' A' ' 65' ' ' ASN . 1.2 t -103.56 140.42 21.78 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 179.56 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.924 HD22 HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -103.57 111.07 23.37 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-O 121.764 0.792 . . . . 0.0 112.899 -178.197 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.697 ' O ' ' HB3' ' A' ' 89' ' ' ASP . 0.1 OUTLIER -123.88 103.52 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.194 0 N-CA-C 104.202 -2.518 . . . . 0.0 104.202 175.003 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 102' ' ' SER . . . . . 0.607 ' O ' ' HB2' ' A' ' 103' ' ' LEU . 12.2 p -140.37 142.24 35.54 Favored 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 119.669 -0.813 . . . . 0.0 112.068 -175.73 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.814 HD13 ' O ' ' A' ' 105' ' ' SER . 0.2 OUTLIER 147.74 79.29 0.0 OUTLIER 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.784 177.531 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.61 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -98.31 28.43 4.1 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 177.487 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.814 ' O ' HD13 ' A' ' 103' ' ' LEU . 6.9 m 148.83 179.21 0.0 OUTLIER 'General case' 0 C--N 1.343 0.293 0 CA-C-N 113.749 -1.569 . . . . 0.0 107.047 -178.719 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.679 ' CG ' HG22 ' A' ' 43' ' ' THR . 0.0 OUTLIER -104.14 101.34 11.09 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 119.1 0.864 . . . . 0.0 111.908 -178.973 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.778 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 4.2 mt-30 -169.46 165.05 10.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.308 178.434 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.549 ' HB2' ' HB2' ' A' ' 56' ' ' ALA . 1.8 tpt -165.21 142.46 5.88 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.3 0.572 . . . . 0.0 112.008 178.916 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' THR . . . . . 0.551 HG22 ' CE2' ' A' ' 39' ' ' PHE . 0.5 OUTLIER -104.83 159.55 15.7 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.709 179.112 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.967 HD13 HG23 ' A' ' 12' ' ' VAL . 0.9 OUTLIER -46.44 -55.75 6.96 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.357 0.599 . . . . 0.0 109.977 179.411 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 111' ' ' GLN . . . . . 0.879 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 2.2 tp-100 -53.05 -66.7 0.34 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.791 -179.214 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 0.84 ' O ' HG22 ' A' ' 115' ' ' VAL . 7.5 m-20 -44.61 -37.57 3.7 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.525 0.679 . . . . 0.0 110.746 -179.699 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 0.554 ' HB3' HG21 ' A' ' 12' ' ' VAL . . . -62.63 -44.24 96.79 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.384 179.205 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.879 ' HD2' ' HA ' ' A' ' 111' ' ' GLN . 0.0 OUTLIER -79.28 -21.9 45.41 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.77 -179.578 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 1.074 HG12 ' CG ' ' A' ' 75' ' ' LYS . 13.2 m -69.55 -48.87 63.64 Favored 'Isoleucine or valine' 0 C--O 1.242 0.688 0 CA-C-O 122.165 0.984 . . . . 0.0 109.209 179.164 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.856 ' HB3' HG21 ' A' ' 63' ' ' VAL . 1.2 mp -71.5 -36.82 71.24 Favored 'General case' 0 N--CA 1.433 -1.3 0 CA-C-N 114.148 -1.387 . . . . 0.0 110.068 179.525 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.914 HD12 HG23 ' A' ' 59' ' ' VAL . 0.2 OUTLIER -75.83 -20.12 58.39 Favored 'General case' 0 CA--C 1.51 -0.578 0 C-N-CA 120.421 -0.512 . . . . 0.0 110.767 178.935 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.45 ' HA ' HD23 ' A' ' 121' ' ' LEU . 28.6 tp10 -71.66 -50.23 32.42 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 177.531 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.526 ' HA ' ' HB3' ' A' ' 122' ' ' ARG . . . -72.28 -33.27 67.31 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.863 177.287 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.813 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -60.82 -64.82 0.82 Allowed 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.824 179.367 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.49 HD23 ' O ' ' A' ' 117' ' ' LEU . 0.0 OUTLIER -58.42 -31.5 67.78 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.716 179.077 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.526 ' HB3' ' HA ' ' A' ' 119' ' ' ALA . 0.0 OUTLIER -59.5 -65.15 0.72 Allowed 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.958 -179.798 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.867 ' HB3' HG12 ' A' ' 66' ' ' VAL . 1.4 tm0? -86.71 -4.7 59.21 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 113.376 0.88 . . . . 0.0 113.376 -177.486 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 124' ' ' GLU . . . . . 0.573 ' HG2' HG13 ' A' ' 66' ' ' VAL . 5.0 mm-40 -93.83 -67.34 0.86 Allowed 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 119.895 -0.722 . . . . 0.0 111.614 -179.675 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 9.8 p . . . . . 0 C--N 1.323 -0.558 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.492 -179.832 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.6 p30 . . . . . 0 CA--C 1.531 0.217 0 CA-C-O 120.81 0.338 . . . . 0.0 111.373 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.755 HD11 ' C ' ' A' ' 29' ' ' GLY . 5.7 mp -73.23 -72.5 0.25 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.341 0.591 . . . . 0.0 110.455 179.374 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 167.73 -159.21 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.109 -0.951 . . . . 0.0 109.087 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.78 HD21 ' HB1' ' A' ' 120' ' ' ALA . 0.0 OUTLIER -95.25 -60.98 1.55 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.887 0.375 . . . . 0.0 111.413 179.567 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.8 p -53.74 -45.05 70.41 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.888 -0.597 . . . . 0.0 112.242 -179.238 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ASP . . . . . 0.432 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -73.18 -62.47 1.46 Allowed 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 120.901 0.381 . . . . 0.0 110.192 -179.679 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 1.055 HD23 HD21 ' A' ' 117' ' ' LEU . 6.5 tp -45.05 -45.74 11.04 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.313 179.203 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' HIS . . . . . 0.765 ' CG ' HD22 ' A' ' 121' ' ' LEU . 63.4 t60 -62.16 -48.78 78.58 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.581 178.487 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.441 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 4.1 mmt180 -48.92 -54.92 13.46 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.755 -179.416 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.615 ' OE1' HD22 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -67.5 -54.89 16.24 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -179.353 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.783 HG23 HD23 ' A' ' 110' ' ' LEU . 8.6 p -55.98 -46.87 80.68 Favored 'Isoleucine or valine' 0 C--O 1.242 0.698 0 CA-C-O 121.292 0.568 . . . . 0.0 111.18 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.549 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 9.2 t -58.99 -57.97 10.74 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.965 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -58.13 -25.73 61.77 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.697 -179.863 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.567 HD22 ' HB2' ' A' ' 33' ' ' ALA . 12.9 mt -67.97 -65.37 0.7 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.687 -179.519 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.599 HG23 HD13 ' A' ' 110' ' ' LEU . 1.4 t -73.43 -25.0 20.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 120.148 -0.621 . . . . 0.0 110.977 -179.538 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.426 ' CG ' ' O ' ' A' ' 13' ' ' SER . 7.2 mm-40 -75.96 -23.42 55.37 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.253 179.384 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -154.3 57.87 0.71 Allowed 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 120.73 0.3 . . . . 0.0 111.274 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 175.89 -61.8 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.771 ' OG ' ' HB1' ' A' ' 33' ' ' ALA . 20.4 m -85.44 -77.85 0.28 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.894 0.378 . . . . 0.0 111.97 -178.867 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLY . . . . . 0.565 ' H ' ' HA ' ' A' ' 16' ' ' VAL . . . 118.57 -36.64 3.52 Favored Glycine 0 N--CA 1.449 -0.473 0 N-CA-C 111.553 -0.619 . . . . 0.0 111.553 -179.0 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.405 ' O ' ' O ' ' A' ' 23' ' ' CYS . 0.2 OUTLIER -177.08 5.24 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.719 0.295 . . . . 0.0 111.636 179.895 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.633 ' HB2' HD12 ' A' ' 110' ' ' LEU . 88.5 m -52.65 -165.96 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.495 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.617 ' CB ' ' HB3' ' A' ' 34' ' ' ASN . 0.2 OUTLIER -103.77 164.47 11.66 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.142 179.758 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -109.21 136.26 13.44 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.301 -0.952 . . . . 0.0 113.716 -178.764 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.918 ' HB3' ' HB3' ' A' ' 32' ' ' ALA . 2.1 tmmm? -105.68 116.65 32.31 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 178.834 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.795 HD22 HG12 ' A' ' 54' ' ' VAL . 8.6 tt -104.11 146.77 28.26 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.033 0.444 . . . . 0.0 111.849 -179.05 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.512 ' NH2' HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER 153.81 64.59 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.271 -179.863 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.755 ' C ' HD11 ' A' ' 3' ' ' LEU . . . 89.94 -12.43 67.55 Favored Glycine 0 CA--C 1.519 0.289 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.764 -178.56 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.685 ' N ' HD11 ' A' ' 3' ' ' LEU . 0.2 OUTLIER -165.9 165.16 18.39 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.66 HG21 ' HB ' ' A' ' 12' ' ' VAL . 0.1 OUTLIER -110.37 121.35 63.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 C-N-CA 120.439 -0.504 . . . . 0.0 109.939 177.781 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.918 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . . . -104.07 166.5 10.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.771 -179.217 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.778 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -103.15 104.76 14.94 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.26 0.553 . . . . 0.0 111.72 -178.688 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.617 ' HB3' ' CB ' ' A' ' 24' ' ' THR . 1.1 t-20 -76.25 86.75 3.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.998 179.303 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.91 74.49 2.64 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.836 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 179.62 -36.66 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.46 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.68 ' O ' HG23 ' A' ' 38' ' ' THR . 0.2 OUTLIER -100.72 -166.62 1.33 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.794 179.862 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.68 HG23 ' O ' ' A' ' 37' ' ' THR . 0.9 OUTLIER -168.83 102.22 0.39 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.682 179.882 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.66 ' CZ ' ' HA ' ' A' ' 48' ' ' ALA . 20.6 m-30 -114.92 145.03 42.65 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -178.209 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.477 ' HG2' ' O ' ' A' ' 40' ' ' GLN . 0.0 OUTLIER -153.75 65.23 0.73 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.229 179.857 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.468 ' H ' ' HB3' ' A' ' 107' ' ' GLN . . . 78.31 106.39 0.19 Allowed Glycine 0 CA--C 1.519 0.332 0 CA-C-N 115.352 -0.84 . . . . 0.0 113.084 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.68 ' N ' ' HB3' ' A' ' 105' ' ' SER . 0.0 OUTLIER -154.81 -135.23 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 178.86 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.503 ' H ' HD12 ' A' ' 42' ' ' LEU . 0.1 OUTLIER -170.52 35.28 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 O-C-N 121.859 -0.525 . . . . 0.0 111.493 -179.656 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.743 ' HA ' ' HB3' ' A' ' 48' ' ' ALA . 4.9 mt 63.29 3.49 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -88.63 -56.39 3.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.916 0.389 . . . . 0.0 110.752 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.447 ' HB2' HD11 ' A' ' 42' ' ' LEU . 1.4 t -60.39 -22.59 63.51 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.727 179.636 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 135.5 46.6 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.295 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.872 ' HB2' ' OE1' ' A' ' 107' ' ' GLN . . . -102.68 -169.02 1.6 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.087 0.47 . . . . 0.0 111.457 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.8 142.08 28.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.977 179.315 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.607 ' O ' HG23 ' A' ' 54' ' ' VAL . 10.1 tt0 -44.52 -29.27 0.69 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.818 0.342 . . . . 0.0 111.654 -179.324 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' SER . . . . . 0.416 ' CB ' ' HG2' ' A' ' 26' ' ' LYS . 5.2 m -56.54 -65.18 0.65 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.742 -179.612 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.437 ' HG3' ' O ' ' A' ' 108' ' ' MET . 0.7 OUTLIER -53.77 -63.77 1.04 Allowed 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 111.911 0.338 . . . . 0.0 111.911 -179.164 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.649 ' CE ' HD11 ' A' ' 44' ' ' ILE . 0.7 OUTLIER -44.78 -51.89 8.98 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 120.686 0.279 . . . . 0.0 111.426 -179.802 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.795 HG12 HD22 ' A' ' 27' ' ' LEU . 74.9 t -58.81 -34.32 51.87 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 CA-C-O 121.055 0.455 . . . . 0.0 109.788 179.188 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.699 ' HA ' HD13 ' A' ' 27' ' ' LEU . 0.3 OUTLIER -63.67 -46.37 85.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.737 178.883 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.782 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -57.51 -46.61 83.58 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.455 179.195 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.436 ' OE1' HD11 ' A' ' 103' ' ' LEU . 13.8 mm-40 -62.91 -45.32 93.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.451 179.554 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.461 HG21 HD11 ' A' ' 27' ' ' LEU . 59.5 m -59.86 -57.76 11.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.917 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.96 HG23 HD12 ' A' ' 117' ' ' LEU . 7.7 p -59.04 -48.7 85.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.811 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.81 HD22 ' CD2' ' A' ' 103' ' ' LEU . 12.9 tp -54.83 -34.28 62.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.906 0.384 . . . . 0.0 110.615 179.516 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 49.2 m -72.27 -50.8 24.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.156 -179.584 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' HIS . . . . . 0.605 ' ND1' HD23 ' A' ' 5' ' ' LEU . 0.4 OUTLIER -66.63 -25.09 66.42 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 120.928 0.394 . . . . 0.0 110.733 -179.54 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 1.089 HG13 HG11 ' A' ' 66' ' ' VAL . 7.0 t -98.66 31.2 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.489 179.188 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.57 ' O ' ' HB2' ' A' ' 65' ' ' ASN . . . -68.85 61.73 0.1 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.288 -179.299 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.685 ' O ' HG22 ' A' ' 99' ' ' VAL . 2.0 m-20 142.19 -73.13 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.095 0.558 . . . . 0.0 111.407 179.722 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 1.089 HG11 HG13 ' A' ' 63' ' ' VAL . 29.2 m 39.55 -146.15 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.912 -179.092 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.484 ' O ' ' O ' ' A' ' 98' ' ' SER . 4.1 p -158.51 -24.02 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 N-CA-C 112.284 0.476 . . . . 0.0 112.284 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.737 HD12 ' O ' ' A' ' 98' ' ' SER . 0.7 OUTLIER 36.89 92.6 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 179.093 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 15.7 p -64.34 177.02 0.92 Allowed 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 178.674 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -42.21 -33.2 0.57 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.807 0.337 . . . . 0.0 111.329 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -65.27 -63.81 1.01 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.468 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.675 ' HB3' HD23 ' A' ' 68' ' ' LEU . 48.5 m-20 -59.85 -33.51 71.89 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.859 0.362 . . . . 0.0 110.472 179.509 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.582 HG23 ' HB3' ' A' ' 98' ' ' SER . 2.1 m -56.48 -62.81 1.47 Allowed 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 178.596 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -57.78 -27.48 63.11 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.449 0.642 . . . . 0.0 109.28 177.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 1.085 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.1 OUTLIER -56.99 -65.15 0.67 Allowed 'General case' 0 C--O 1.238 0.469 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.302 178.956 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 1.043 HD21 HD11 ' A' ' 116' ' ' LEU . 0.5 OUTLIER -56.21 -39.06 71.87 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.434 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.96 -49.18 74.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.398 179.522 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -60.69 -58.1 9.89 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.423 -179.626 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.65 -61.6 1.99 Allowed 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.566 -179.388 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.533 HG22 ' O ' ' A' ' 76' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.772 -179.265 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ASN . . . . . 0.467 ' HA ' ' HB2' ' A' ' 104' ' ' ARG . 25.8 t30 . . . . . 0 C--O 1.241 0.645 0 CA-C-O 121.311 0.577 . . . . 0.0 110.632 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.548 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 4.1 m-85 -106.94 142.26 36.85 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.914 -179.01 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.666 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.2 OUTLIER -110.4 150.76 28.35 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 115.299 -0.864 . . . . 0.0 108.982 -179.4 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.925 HD21 HD13 ' A' ' 76' ' ' LEU . 2.0 mt -138.74 156.17 47.61 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -177.569 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.602 ' O ' ' CB ' ' A' ' 98' ' ' SER . 56.2 mmm-85 -128.19 149.8 50.29 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 114.695 -1.138 . . . . 0.0 108.536 177.866 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.79 ' O ' HG13 ' A' ' 93' ' ' VAL . 53.4 p -103.76 154.29 19.73 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.985 0.898 . . . . 0.0 113.065 -178.302 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.79 HG13 ' O ' ' A' ' 92' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.433 -1.316 0 CA-C-N 113.594 -1.639 . . . . 0.0 107.531 -179.31 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.558 ' O ' ' O ' ' A' ' 93' ' ' VAL . 0.2 OUTLIER . . . . . 0 N--CA 1.454 -0.24 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.737 ' O ' HD12 ' A' ' 68' ' ' LEU . 0.6 OUTLIER -146.78 161.86 39.76 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.528 0.68 . . . . 0.0 111.451 179.942 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.685 HG22 ' O ' ' A' ' 65' ' ' ASN . 0.5 OUTLIER -103.87 155.04 5.76 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.176 179.604 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.708 HD22 ' HG ' ' A' ' 116' ' ' LEU . 1.4 tp -103.05 108.89 20.24 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-O 121.937 0.875 . . . . 0.0 112.389 -179.319 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.666 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -122.12 105.19 15.89 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.027 0 N-CA-C 104.073 -2.566 . . . . 0.0 104.073 175.49 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 102' ' ' SER . . . . . 0.742 ' O ' ' HB2' ' A' ' 103' ' ' LEU . 0.1 OUTLIER -144.34 165.15 28.72 Favored 'General case' 0 C--N 1.307 -1.265 0 C-N-CA 119.01 -1.076 . . . . 0.0 113.734 -173.917 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.81 ' CD2' HD22 ' A' ' 60' ' ' LEU . 0.5 OUTLIER 132.57 70.85 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 113.469 -1.696 . . . . 0.0 112.533 176.465 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.467 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -98.32 13.21 32.25 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.757 -1.11 . . . . 0.0 108.132 177.001 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.68 ' HB3' ' N ' ' A' ' 42' ' ' LEU . 5.0 m 160.15 172.07 0.01 OUTLIER 'General case' 0 C--O 1.231 0.099 0 CA-C-N 114.108 -1.406 . . . . 0.0 107.335 -179.151 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.505 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.4 OUTLIER -104.75 101.7 11.3 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 119.61 -0.836 . . . . 0.0 112.194 -178.965 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.872 ' OE1' ' HB2' ' A' ' 48' ' ' ALA . 1.6 mt-30 -169.6 165.23 10.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.776 178.024 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.476 ' HB3' ' HB3' ' A' ' 55' ' ' PHE . 0.0 OUTLIER -165.56 138.14 4.24 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.12 0.486 . . . . 0.0 111.799 178.48 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 109' ' ' THR . . . . . 0.549 ' CG2' HG23 ' A' ' 24' ' ' THR . 0.1 OUTLIER -103.91 159.58 15.53 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.38 178.759 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.783 HD23 HG23 ' A' ' 12' ' ' VAL . 6.8 mt -46.92 -55.55 7.87 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 121.174 -0.211 . . . . 0.0 110.908 -179.481 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' GLN . . . . . 0.894 ' O ' HG23 ' A' ' 115' ' ' VAL . 3.5 tp-100 -46.87 -65.52 0.55 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.691 0.281 . . . . 0.0 110.826 179.708 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 0.907 ' O ' HD22 ' A' ' 116' ' ' LEU . 58.9 m-20 -45.52 -54.14 7.94 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 121.158 0.504 . . . . 0.0 110.867 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 0.479 ' HB3' HG21 ' A' ' 12' ' ' VAL . . . -44.31 -64.94 0.58 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.944 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.583 ' NZ ' ' HB ' ' A' ' 16' ' ' VAL . 0.0 OUTLIER -64.97 -22.08 66.94 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.473 -179.847 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 1.085 HG22 ' CG ' ' A' ' 75' ' ' LYS . 53.1 t -60.06 -64.94 0.51 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.815 0 CA-C-O 121.995 0.902 . . . . 0.0 109.786 179.535 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 1.043 HD11 HD21 ' A' ' 76' ' ' LEU . 0.2 OUTLIER -64.05 -35.83 82.02 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.85 179.67 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 1.055 HD21 HD23 ' A' ' 8' ' ' LEU . 0.4 OUTLIER -70.86 -19.14 62.66 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-O 121.044 0.449 . . . . 0.0 110.812 179.437 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.578 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 6.9 tp10 -75.34 -47.5 27.43 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 106.598 -1.63 . . . . 0.0 106.598 177.778 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.552 ' HB1' ' H ' ' A' ' 68' ' ' LEU . . . -77.93 -18.19 56.37 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 114.606 -1.179 . . . . 0.0 111.08 178.303 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.891 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -82.44 -52.17 7.14 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.186 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.765 HD22 ' CG ' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -63.85 -30.06 71.19 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 178.148 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.578 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 4.3 ttm-85 -71.91 -55.98 6.53 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.422 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -92.7 -29.87 15.84 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 -177.024 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 124' ' ' GLU . . . . . 0.406 ' CB ' ' O ' ' A' ' 120' ' ' ALA . 4.4 mm-40 -75.73 -65.99 0.84 Allowed 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.514 -0.474 . . . . 0.0 112.038 -178.382 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.325 -0.482 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.97 -178.807 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.1 p30 . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.929 0.395 . . . . 0.0 111.278 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.858 HD11 ' HB2' ' A' ' 7' ' ' ASP . 0.0 OUTLIER -91.38 -66.64 0.91 Allowed 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.405 -179.668 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.682 ' N ' HD13 ' A' ' 3' ' ' LEU . 39.9 t 172.81 -169.18 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 179.391 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 1.004 HD21 ' CB ' ' A' ' 120' ' ' ALA . 0.0 OUTLIER -96.7 -65.42 0.97 Allowed 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.661 -0.416 . . . . 0.0 111.406 179.049 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.4 p -51.18 -49.01 61.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.695 -179.078 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ASP . . . . . 0.858 ' HB2' HD11 ' A' ' 3' ' ' LEU . 2.9 m-20 -67.9 -44.59 76.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.904 0.383 . . . . 0.0 110.19 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 1.101 HD23 HD21 ' A' ' 117' ' ' LEU . 18.6 tp -61.53 -64.75 0.84 Allowed 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.279 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' HIS . . . . . 0.735 ' ND1' HD22 ' A' ' 121' ' ' LEU . 25.6 t-80 -45.19 -50.53 11.43 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.392 0.615 . . . . 0.0 109.865 178.817 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.452 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 17.3 mmt85 -56.39 -51.43 68.37 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.298 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 1.139 ' HG3' HG12 ' A' ' 31' ' ' VAL . 4.6 pt20 -71.05 -53.31 15.14 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.728 -179.587 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.883 ' CA ' HG11 ' A' ' 31' ' ' VAL . 10.0 p -55.58 -50.04 69.5 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-O 120.705 0.288 . . . . 0.0 111.455 179.331 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.47 ' N ' HG13 ' A' ' 12' ' ' VAL . 4.6 t -64.51 -43.66 93.35 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.354 179.498 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.452 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -53.79 -43.92 69.69 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -179.441 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.634 HD21 HG13 ' A' ' 31' ' ' VAL . 0.1 OUTLIER -75.36 -51.13 13.88 Favored 'General case' 0 CA--C 1.517 -0.29 0 C-N-CA 119.879 -0.728 . . . . 0.0 111.102 -179.692 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.819 HG13 ' NZ ' ' A' ' 114' ' ' LYS . 8.8 p -73.92 -4.83 5.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 113.569 0.951 . . . . 0.0 113.569 -178.293 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.433 ' HG2' ' CE ' ' A' ' 114' ' ' LYS . 5.9 mm-40 -93.38 -4.71 50.98 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.221 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -153.34 -40.53 0.1 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.694 0.283 . . . . 0.0 111.278 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -89.45 -66.7 0.9 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.751 0.31 . . . . 0.0 111.268 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.767 ' CB ' HD13 ' A' ' 110' ' ' LEU . 0.7 OUTLIER -69.77 -32.74 71.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.853 -179.827 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 76.22 -56.23 3.21 Favored Glycine 0 CA--C 1.52 0.368 0 C-N-CA 120.954 -0.641 . . . . 0.0 113.67 179.118 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.471 ' HA ' ' CG2' ' A' ' 16' ' ' VAL . 0.1 OUTLIER -176.92 8.31 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.701 0.25 . . . . 0.0 111.635 -179.158 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.418 ' O ' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -56.49 -152.88 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.048 -179.599 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.676 HG21 ' HB2' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -103.62 153.16 20.92 Favored 'General case' 0 CA--C 1.52 -0.187 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.34 -179.871 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.455 ' CA ' ' HG ' ' A' ' 110' ' ' LEU . . . -113.17 124.95 6.79 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.337 -0.935 . . . . 0.0 113.459 -178.729 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.698 ' HG3' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -109.01 127.78 54.38 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 178.483 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 1.02 ' HB3' ' HA ' ' A' ' 31' ' ' VAL . 0.4 OUTLIER -164.02 165.91 22.01 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 114.864 1.431 . . . . 0.0 114.864 -178.08 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.0 mpt_? -142.65 -48.03 0.33 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 113.226 -1.806 . . . . 0.0 108.526 177.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.415 ' O ' ' HB2' ' A' ' 3' ' ' LEU . . . -130.74 4.53 5.78 Favored Glycine 0 CA--C 1.524 0.621 0 CA-C-N 115.054 -0.976 . . . . 0.0 110.752 177.468 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.799 ' O ' ' CB ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -166.36 157.41 12.94 Favored 'General case' 0 C--O 1.222 -0.372 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 -179.992 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 1.139 HG12 ' HG3' ' A' ' 11' ' ' GLN . 8.8 p -102.36 131.65 50.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 122.179 0.99 . . . . 0.0 113.22 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.698 ' HB3' ' HG3' ' A' ' 26' ' ' LYS . . . -113.38 166.0 11.91 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 113.407 -1.724 . . . . 0.0 109.411 178.574 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.578 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -103.3 135.5 44.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.306 0.574 . . . . 0.0 111.785 -178.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.428 HD22 ' H ' ' A' ' 37' ' ' THR . 8.6 t-20 -116.02 117.82 31.19 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.679 -179.575 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -123.05 -31.26 3.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.743 179.707 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -61.01 -54.45 44.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.523 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.428 ' H ' HD22 ' A' ' 34' ' ' ASN . 0.0 OUTLIER -83.65 -166.13 1.31 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.355 179.596 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 35.8 p -154.54 101.05 2.31 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.887 0.375 . . . . 0.0 111.441 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.772 ' O ' HG22 ' A' ' 109' ' ' THR . 1.6 m-85 -113.98 127.96 56.18 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.833 179.191 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -118.04 -35.01 3.97 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.265 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.58 ' HA3' ' HB3' ' A' ' 87' ' ' ASN . . . 171.54 -14.89 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.891 -0.671 . . . . 0.0 113.412 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.724 HD21 ' HB2' ' A' ' 48' ' ' ALA . 0.1 OUTLIER -44.75 174.0 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 117.332 0.566 . . . . 0.0 111.834 -179.799 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.521 HG22 ' O ' ' A' ' 43' ' ' THR . 20.8 m -109.72 46.61 1.0 Allowed 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -178.497 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.833 HD11 ' HE3' ' A' ' 53' ' ' LYS . 0.7 OUTLIER 59.94 -5.33 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 179.244 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.443 ' H ' ' C ' ' A' ' 43' ' ' THR . . . -63.76 -64.09 0.99 Allowed 'General case' 0 CA--C 1.522 -0.13 0 CA-C-O 120.969 0.414 . . . . 0.0 110.621 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.5 t -46.44 -41.64 14.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.962 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 151.55 37.16 0.03 OUTLIER Glycine 0 CA--C 1.519 0.314 0 C-N-CA 120.46 -0.876 . . . . 0.0 113.432 179.583 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.931 ' HB1' ' OE1' ' A' ' 52' ' ' GLU . . . -90.82 -171.27 2.97 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 117.151 0.476 . . . . 0.0 111.281 179.75 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.42 ' HG3' ' CZ ' ' A' ' 39' ' ' PHE . 12.4 mtp85 -115.94 -165.97 1.09 Allowed 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.523 -179.545 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.859 ' O ' HG22 ' A' ' 54' ' ' VAL . 0.6 OUTLIER -95.27 -52.45 4.17 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.311 -0.404 . . . . 0.0 112.012 -179.259 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 51' ' ' SER . . . . . 0.545 ' O ' HG23 ' A' ' 54' ' ' VAL . 1.4 p -39.96 -40.33 1.0 Allowed 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.098 0.475 . . . . 0.0 111.312 -179.592 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.931 ' OE1' ' HB1' ' A' ' 48' ' ' ALA . 0.0 OUTLIER -63.02 -66.21 0.57 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.491 179.66 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.833 ' HE3' HD11 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -46.33 -55.62 7.03 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.881 179.936 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.859 HG22 ' O ' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -54.07 -39.83 43.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.184 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.928 ' CE1' HD21 ' A' ' 27' ' ' LEU . 1.3 t80 -52.78 -49.03 66.38 Favored 'General case' 0 C--O 1.231 0.132 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.735 178.42 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.743 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -58.99 -42.81 90.93 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.305 179.119 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -58.69 -43.09 89.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.807 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.598 HG23 ' O ' ' A' ' 54' ' ' VAL . 27.2 p -64.54 -60.36 3.23 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.162 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.947 HG23 HD12 ' A' ' 117' ' ' LEU . 8.9 p -60.72 -47.53 92.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.532 -179.523 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 1.04 HD13 HD23 ' A' ' 103' ' ' LEU . 6.0 tp -58.45 -43.0 88.66 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.67 0.271 . . . . 0.0 111.409 -179.569 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 9.9 t -75.3 -34.61 61.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.289 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' HIS . . . . . 0.614 ' HB3' HD22 ' A' ' 5' ' ' LEU . 0.1 OUTLIER -70.01 -25.22 63.48 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 120.727 0.298 . . . . 0.0 110.323 179.521 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 1.077 HG12 ' HB2' ' A' ' 120' ' ' ALA . 28.0 m -91.93 -55.55 6.06 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.233 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.179 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.551 ' N ' HG23 ' A' ' 63' ' ' VAL . . . 29.88 36.66 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 O-C-N 123.38 0.425 . . . . 0.0 112.009 179.78 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.62 ' O ' HG22 ' A' ' 66' ' ' VAL . 4.5 m-20 160.25 -84.45 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.262 0.468 . . . . 0.0 112.262 -179.031 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.62 HG22 ' O ' ' A' ' 65' ' ' ASN . 22.9 m 50.97 -160.56 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.59 -178.825 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.492 ' O ' ' O ' ' A' ' 98' ' ' SER . 7.3 p -147.34 -15.48 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 -178.946 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.899 HD22 HD11 ' A' ' 76' ' ' LEU . 0.4 OUTLIER 29.58 95.06 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.426 0.899 . . . . 0.0 113.426 178.81 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.408 HG21 ' CZ ' ' A' ' 122' ' ' ARG . 79.4 p -62.53 -161.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 178.619 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.08 -36.52 77.56 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.03 0.443 . . . . 0.0 110.393 179.744 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.474 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 13.7 tt0 -62.72 -65.34 0.7 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.242 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.686 ' O ' HD12 ' A' ' 76' ' ' LEU . 1.3 m-20 -53.26 -36.89 61.62 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.969 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.502 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 85.4 m -57.29 -65.25 0.66 Allowed 'General case' 0 C--O 1.238 0.455 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.644 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.86 -25.97 57.67 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 177.642 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 1.069 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -59.06 -51.43 70.1 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.723 178.715 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.899 HD11 HD22 ' A' ' 68' ' ' LEU . 1.2 mp -64.44 -49.68 70.5 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 178.521 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.529 HD23 ' N ' ' A' ' 77' ' ' LEU . 2.8 mt -57.08 -32.92 66.75 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.426 179.639 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.16 -49.21 58.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.686 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' SER . . . . . 0.411 ' HB3' ' HG2' ' A' ' 111' ' ' GLN . 0.0 OUTLIER -61.17 -30.94 70.71 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.466 179.706 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.534 HG23 ' CZ ' ' A' ' 88' ' ' TYR . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.207 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ASN . . . . . 0.757 HD21 ' N ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--O 1.238 0.469 0 CA-C-O 120.811 0.339 . . . . 0.0 111.428 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.661 ' CD1' HD23 ' A' ' 76' ' ' LEU . 4.4 p90 -104.52 145.99 29.51 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 119.981 -0.687 . . . . 0.0 110.817 179.724 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.718 ' HB3' ' O ' ' A' ' 101' ' ' VAL . 0.5 OUTLIER -109.45 141.56 41.69 Favored 'General case' 0 N--CA 1.436 -1.145 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.184 -179.056 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.821 HD11 ' CB ' ' A' ' 76' ' ' LEU . 66.4 mt -126.36 165.07 19.7 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.916 0.865 . . . . 0.0 113.289 -177.438 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -153.53 130.15 10.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 113.997 -1.456 . . . . 0.0 107.223 178.447 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.704 ' O ' HG13 ' A' ' 93' ' ' VAL . 60.4 p -103.68 145.83 29.48 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 -176.681 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.704 HG13 ' O ' ' A' ' 92' ' ' SER . 3.7 m . . . . . 0 CA--C 1.541 0.599 0 CA-C-N 113.553 -1.658 . . . . 0.0 108.621 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.425 ' HB2' HG22 ' A' ' 67' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.518 -0.267 0 CA-C-O 120.892 0.377 . . . . 0.0 110.551 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.505 ' O ' HD12 ' A' ' 68' ' ' LEU . 11.2 t -142.23 154.18 44.57 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.209 0.528 . . . . 0.0 111.138 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.416 HG13 ' N ' ' A' ' 100' ' ' LEU . 1.0 OUTLIER -103.74 159.91 4.79 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 178.772 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.796 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 0.1 OUTLIER -126.47 113.74 17.23 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -179.152 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.718 ' O ' ' HB3' ' A' ' 89' ' ' ASP . 0.2 OUTLIER -105.08 108.97 26.2 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 N-CA-C 103.213 -2.884 . . . . 0.0 103.213 174.481 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 102' ' ' SER . . . . . 0.781 ' O ' ' HB2' ' A' ' 103' ' ' LEU . 13.8 p -138.54 165.11 27.7 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -173.243 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 1.04 HD23 HD13 ' A' ' 60' ' ' LEU . 0.9 OUTLIER 126.74 82.55 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 112.508 -2.133 . . . . 0.0 112.658 176.61 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.447 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -104.65 19.14 20.94 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.619 -1.173 . . . . 0.0 108.284 177.441 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.691 ' O ' HD13 ' A' ' 103' ' ' LEU . 3.5 m 157.97 175.25 0.01 OUTLIER 'General case' 0 C--O 1.231 0.116 0 N-CA-C 107.14 -1.43 . . . . 0.0 107.14 -179.046 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.421 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.6 OUTLIER -106.69 101.95 11.36 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 119.596 -0.842 . . . . 0.0 112.097 -178.988 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.743 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 1.1 mt-30 -169.04 163.47 11.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.612 178.147 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.597 ' HB2' ' HB2' ' A' ' 56' ' ' ALA . 1.0 OUTLIER -165.71 133.71 3.01 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.395 0.617 . . . . 0.0 112.347 178.76 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 109' ' ' THR . . . . . 0.772 HG22 ' O ' ' A' ' 39' ' ' PHE . 0.8 OUTLIER -103.24 159.8 15.23 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.983 -1.008 . . . . 0.0 109.316 178.823 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.767 HD13 ' CB ' ' A' ' 20' ' ' SER . 17.1 mt -46.91 -62.88 1.2 Allowed 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 121.222 -0.191 . . . . 0.0 110.92 -179.639 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' GLN . . . . . 0.979 ' O ' HG23 ' A' ' 115' ' ' VAL . 2.3 tp-100 -44.38 -62.07 1.3 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.76 0.314 . . . . 0.0 110.499 179.456 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 0.452 ' O ' ' HB ' ' A' ' 115' ' ' VAL . 0.8 OUTLIER -45.42 -47.76 13.67 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 121.373 0.606 . . . . 0.0 110.436 179.529 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 0.591 ' CB ' ' CZ ' ' A' ' 55' ' ' PHE . . . -58.83 -65.74 0.61 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.923 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.819 ' NZ ' HG13 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -52.21 -25.72 9.88 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 121.06 -0.256 . . . . 0.0 110.898 179.825 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 1.069 HG22 ' CG ' ' A' ' 75' ' ' LYS . 88.2 t -64.39 -65.03 0.58 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.767 0 CA-C-O 122.082 0.944 . . . . 0.0 109.636 178.616 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.878 ' HB3' HG11 ' A' ' 63' ' ' VAL . 1.7 mp -63.59 -34.06 76.98 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 114.572 -1.194 . . . . 0.0 109.678 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 1.101 HD21 HD23 ' A' ' 8' ' ' LEU . 0.2 OUTLIER -72.67 -23.08 60.84 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.97 179.691 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.451 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 5.7 tt0 -71.84 -44.17 64.29 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 106.521 -1.659 . . . . 0.0 106.521 177.467 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.546 ' HB1' ' H ' ' A' ' 68' ' ' LEU . . . -77.9 -19.11 55.32 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 114.151 -1.386 . . . . 0.0 110.11 177.68 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 1.077 ' HB2' HG12 ' A' ' 63' ' ' VAL . . . -81.19 -48.07 12.59 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.928 179.557 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.735 HD22 ' ND1' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -68.8 -30.52 69.11 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.697 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.451 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 1.0 OUTLIER -74.08 -50.4 19.78 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.615 -0.72 . . . . 0.0 112.29 -179.404 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.08 -31.98 13.32 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -177.848 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -92.1 -65.61 0.99 Allowed 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -178.759 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' SER . . . . . 0.46 ' CB ' ' HA ' ' A' ' 121' ' ' LEU . 3.9 t . . . . . 0 C--N 1.326 -0.413 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.614 -178.837 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.528 0.117 0 CA-C-O 120.835 0.35 . . . . 0.0 110.846 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.708 ' HB2' HD13 ' A' ' 8' ' ' LEU . 10.5 mp -90.01 164.88 14.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.679 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 51.4 p -60.95 -162.77 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.271 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 1.017 HD21 ' HB1' ' A' ' 120' ' ' ALA . 0.0 OUTLIER -93.5 -61.25 1.59 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.619 0.247 . . . . 0.0 111.391 179.811 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.9 p -47.33 -51.06 20.49 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -179.062 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.99 -55.72 15.31 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 121.164 0.507 . . . . 0.0 110.274 -179.346 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 1.06 HD23 HD21 ' A' ' 117' ' ' LEU . 11.6 tp -52.65 -60.06 3.71 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.425 179.309 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' HIS . . . . . 0.762 ' ND1' HD13 ' A' ' 121' ' ' LEU . 1.7 t-80 -45.63 -56.43 5.2 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.111 178.826 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.5 -43.42 71.78 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.172 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.461 ' HG2' HG12 ' A' ' 31' ' ' VAL . 19.9 tp60 -58.86 -65.35 0.68 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.668 179.361 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.643 HG23 HD23 ' A' ' 110' ' ' LEU . 9.2 p -56.56 -45.8 82.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.965 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.707 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 8.8 t -60.49 -55.09 37.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.454 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.3 ttp180 -63.99 -22.73 67.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.091 -179.61 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.484 ' CD1' HG13 ' A' ' 31' ' ' VAL . 7.6 mt -73.16 -63.01 1.27 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.72 -179.535 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.706 HG23 ' HB2' ' A' ' 20' ' ' SER . 0.8 OUTLIER -70.3 -27.0 30.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.3 -179.538 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.403 ' HB2' ' O ' ' A' ' 13' ' ' SER . 8.1 mm-40 -78.14 -16.6 57.79 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.167 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -144.78 42.25 1.33 Allowed 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.84 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 173.56 -69.01 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 179.561 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.721 ' CB ' HD13 ' A' ' 110' ' ' LEU . 14.9 m -70.8 -31.75 68.6 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -178.088 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLY . . . . . 0.458 ' C ' HG22 ' A' ' 16' ' ' VAL . . . 78.04 -57.8 3.96 Favored Glycine 0 CA--C 1.521 0.462 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.933 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.638 ' N ' HG22 ' A' ' 16' ' ' VAL . 0.4 OUTLIER -177.3 30.42 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 120.831 0.348 . . . . 0.0 111.05 -179.879 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -74.81 -157.96 0.07 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.938 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.548 ' HB ' ' HB3' ' A' ' 34' ' ' ASN . 4.2 m -103.53 145.17 30.43 Favored 'General case' 0 C--O 1.231 0.108 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.432 ' HA2' ' O ' ' A' ' 32' ' ' ALA . . . -104.62 134.01 11.8 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.332 -0.937 . . . . 0.0 113.706 -178.46 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 1.0 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -104.96 128.87 53.42 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.932 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.875 HD22 HG21 ' A' ' 58' ' ' THR . 0.9 OUTLIER -104.82 146.55 28.83 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.378 0.608 . . . . 0.0 112.139 -178.863 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.496 HH21 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER 169.22 55.47 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 114.924 -1.035 . . . . 0.0 108.965 179.839 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.509 ' O ' HD11 ' A' ' 3' ' ' LEU . . . 87.52 -5.48 84.95 Favored Glycine 0 CA--C 1.52 0.348 0 N-CA-C 111.231 -0.747 . . . . 0.0 111.231 -177.954 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -165.46 165.07 19.42 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 179.838 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.484 HG13 ' CD1' ' A' ' 15' ' ' LEU . 0.7 OUTLIER -112.76 120.96 64.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 121.432 0.634 . . . . 0.0 111.213 179.411 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 1.0 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -110.51 166.34 11.07 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.273 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.671 ' HB2' ' OG ' ' A' ' 20' ' ' SER . . . -103.58 137.43 41.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.221 0.534 . . . . 0.0 111.952 -178.81 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.548 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 2.3 t-20 -119.04 121.33 39.61 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.302 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 14.3 ttpp -121.78 -28.72 4.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.146 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -51.17 -77.19 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.961 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.482 HG22 HD22 ' A' ' 34' ' ' ASN . 7.9 t -77.45 -176.51 4.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.465 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 78.2 p -136.42 107.69 6.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.85 0.357 . . . . 0.0 111.235 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.635 ' CD1' HG23 ' A' ' 109' ' ' THR . 0.0 OUTLIER -61.18 -178.77 0.12 Allowed 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.19 179.62 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.472 ' N ' ' CG ' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -171.64 22.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.772 0.32 . . . . 0.0 111.568 179.6 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.52 ' O ' ' CB ' ' A' ' 105' ' ' SER . . . 79.16 -17.0 8.03 Favored Glycine 0 C--O 1.228 -0.255 0 CA-C-O 119.754 -0.47 . . . . 0.0 113.176 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.642 HD12 ' H ' ' A' ' 43' ' ' THR . 0.1 OUTLIER -48.08 178.15 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 117.235 0.517 . . . . 0.0 111.361 -179.935 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.678 ' C ' HD12 ' A' ' 44' ' ' ILE . 29.3 m -118.21 57.49 0.84 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.753 0.311 . . . . 0.0 111.67 -179.043 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.678 HD12 ' C ' ' A' ' 43' ' ' THR . 3.3 mp 69.93 -58.76 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.714 179.592 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.489 ' C ' ' O ' ' A' ' 44' ' ' ILE . . . -18.54 -77.27 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.61 ' HB2' HD13 ' A' ' 42' ' ' LEU . 58.8 m -43.86 -59.36 2.29 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.429 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 168.8 51.6 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.427 -0.892 . . . . 0.0 113.061 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.531 ' HB2' ' CD2' ' A' ' 42' ' ' LEU . . . -110.99 172.7 6.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.893 0.377 . . . . 0.0 111.053 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.476 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 2.2 tpm_? -91.49 158.5 16.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.713 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.707 ' O ' HG23 ' A' ' 54' ' ' VAL . 0.8 OUTLIER -71.92 -22.96 61.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.046 0.451 . . . . 0.0 110.494 179.507 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 51' ' ' SER . . . . . 0.536 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 59.9 p -63.3 -62.81 1.44 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.256 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.585 ' HB2' ' HG2' ' A' ' 107' ' ' GLN . 1.5 pm0 -44.86 -60.69 1.92 Allowed 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.592 0.234 . . . . 0.0 111.414 -179.753 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.579 ' HG2' HD11 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -52.35 -50.71 61.79 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.702 -0.226 . . . . 0.0 110.997 179.931 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.941 ' O ' HG23 ' A' ' 58' ' ' THR . 73.5 t -57.55 -39.43 69.32 Favored 'Isoleucine or valine' 0 C--O 1.231 0.105 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.645 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.518 ' O ' HG12 ' A' ' 59' ' ' VAL . 0.3 OUTLIER -61.48 -45.15 95.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.581 178.756 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.641 ' HB2' ' C ' ' A' ' 107' ' ' GLN . . . -55.11 -45.82 75.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.577 179.337 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -64.3 -41.96 96.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.045 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.941 HG23 ' O ' ' A' ' 54' ' ' VAL . 9.9 p -61.56 -57.78 10.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.882 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 1.044 HG23 HD12 ' A' ' 117' ' ' LEU . 8.7 p -65.24 -49.72 77.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.08 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.819 HD13 HD23 ' A' ' 103' ' ' LEU . 6.2 tp -50.79 -40.2 54.63 Favored 'General case' 0 C--O 1.231 0.125 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.394 179.497 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 70.2 m -67.83 -53.49 26.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.331 179.773 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' HIS . . . . . 0.482 ' HB3' ' CD2' ' A' ' 5' ' ' LEU . 0.3 OUTLIER -60.83 -20.63 62.04 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 121.079 0.466 . . . . 0.0 110.299 179.598 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 1.086 HG13 HG11 ' A' ' 66' ' ' VAL . 3.4 t -109.61 55.07 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.491 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.493 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . -81.04 39.6 0.51 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.44 -179.549 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.621 ' HA ' HG13 ' A' ' 99' ' ' VAL . 3.9 m-20 153.63 -65.38 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 122.652 0.381 . . . . 0.0 111.123 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 1.086 HG11 HG13 ' A' ' 63' ' ' VAL . 35.5 m 42.36 -171.09 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -179.699 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.748 HG13 ' HG3' ' A' ' 123' ' ' GLN . 16.8 m -145.2 67.64 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 CA-C-O 121.133 0.492 . . . . 0.0 110.877 -178.806 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.713 ' N ' ' O ' ' A' ' 98' ' ' SER . 0.7 OUTLIER -60.24 107.73 0.69 Allowed 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.995 -179.391 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.651 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 7.2 p -80.17 177.62 8.82 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.244 179.197 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -35.42 -37.05 0.08 Allowed 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.952 0.406 . . . . 0.0 111.401 -179.645 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.467 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 4.8 tp10 -68.38 -65.11 0.74 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.023 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.699 ' HB3' HD23 ' A' ' 68' ' ' LEU . 65.0 m-20 -58.75 -32.26 69.1 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.414 -179.622 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -64.46 -57.82 8.17 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.626 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.528 ' HA ' ' CG ' ' A' ' 77' ' ' LEU . . . -56.24 -27.88 56.54 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 177.019 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 1.073 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.4 OUTLIER -61.78 -49.08 77.81 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 114.334 -1.303 . . . . 0.0 110.976 179.184 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.765 HD13 HD23 ' A' ' 90' ' ' LEU . 0.3 OUTLIER -68.27 -52.63 31.63 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.775 0.322 . . . . 0.0 110.729 179.572 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.528 ' CG ' ' HA ' ' A' ' 74' ' ' ALA . 3.8 pp -60.61 -26.86 67.31 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.095 -179.718 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.461 ' HB2' ' O ' ' A' ' 74' ' ' ALA . 22.9 tt0 -75.87 -47.96 23.33 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.16 0.505 . . . . 0.0 110.4 179.311 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 3.1 t -61.1 -33.24 73.04 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.94 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.5 HG22 ' HA ' ' A' ' 77' ' ' LEU . 14.2 t . . . . . 0 C--N 1.331 -0.205 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.614 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ASN . . . . . 0.541 HD21 ' N ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--O 1.234 0.289 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.642 ' CE1' ' HE3' ' A' ' 108' ' ' MET . 25.8 m-85 -100.64 139.94 35.61 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 120.399 -0.52 . . . . 0.0 110.924 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.761 ' CG ' HG13 ' A' ' 101' ' ' VAL . 1.0 OUTLIER -117.3 149.77 39.9 Favored 'General case' 0 N--CA 1.428 -1.529 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 -179.267 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.767 HD12 ' N ' ' A' ' 90' ' ' LEU . 0.0 OUTLIER -149.36 161.72 41.5 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 121.693 0.758 . . . . 0.0 112.696 -178.883 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.42 ' O ' ' HB3' ' A' ' 98' ' ' SER . 2.6 ptm180 -140.95 135.29 31.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.501 -1.227 . . . . 0.0 108.062 178.301 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.561 ' O ' HG13 ' A' ' 93' ' ' VAL . 26.4 p -104.9 146.49 28.94 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.85 1.055 . . . . 0.0 113.85 -177.604 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.561 HG13 ' O ' ' A' ' 92' ' ' SER . 6.7 m . . . . . 0 N--CA 1.446 -0.643 0 CA-C-N 113.889 -1.505 . . . . 0.0 108.536 178.633 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.651 ' HA ' ' HA ' ' A' ' 69' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.434 -1.226 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.713 ' O ' ' N ' ' A' ' 68' ' ' LEU . 3.0 m -148.42 157.16 43.3 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.914 -178.766 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.621 HG13 ' HA ' ' A' ' 65' ' ' ASN . 2.5 t -104.08 150.17 7.41 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.043 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.714 HD13 ' CG ' ' A' ' 116' ' ' LEU . 0.1 OUTLIER -103.91 127.77 51.43 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 122.059 0.933 . . . . 0.0 113.198 -178.505 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.761 HG13 ' CG ' ' A' ' 89' ' ' ASP . 1.5 p -131.7 104.12 8.04 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 N-CA-C 104.295 -2.483 . . . . 0.0 104.295 174.821 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' SER . . . . . 0.688 ' O ' HD23 ' A' ' 103' ' ' LEU . 32.8 p -148.22 165.28 31.42 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 118.785 -1.166 . . . . 0.0 113.653 -174.621 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.872 HD13 ' O ' ' A' ' 105' ' ' SER . 0.2 OUTLIER 157.2 -83.34 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 113.661 -1.609 . . . . 0.0 111.73 176.509 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.501 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 52.4 28.12 5.53 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -179.162 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.872 ' O ' HD13 ' A' ' 103' ' ' LEU . 13.3 m 140.04 165.96 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 -178.086 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.421 ' HB3' ' HB2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -104.85 101.92 11.49 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 119.677 -0.809 . . . . 0.0 112.853 -178.093 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.641 ' C ' ' HB2' ' A' ' 56' ' ' ALA . 0.2 OUTLIER -168.61 164.73 12.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.41 177.694 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.642 ' HE3' ' CE1' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -165.58 141.91 5.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.118 0.485 . . . . 0.0 111.885 179.293 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 109' ' ' THR . . . . . 0.635 HG23 ' CD1' ' A' ' 39' ' ' PHE . 0.8 OUTLIER -104.32 165.22 11.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.258 179.47 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.721 HD13 ' CB ' ' A' ' 20' ' ' SER . 3.4 mt -49.19 -58.04 5.69 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.692 0.282 . . . . 0.0 110.502 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' GLN . . . . . 0.953 ' O ' HG23 ' A' ' 115' ' ' VAL . 3.6 tp-100 -50.42 -64.77 0.71 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.849 0.357 . . . . 0.0 110.839 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 0.475 ' O ' ' HB ' ' A' ' 115' ' ' VAL . 0.8 OUTLIER -44.34 -46.67 9.41 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.17 0.51 . . . . 0.0 110.95 179.847 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 0.603 ' HB3' HG21 ' A' ' 12' ' ' VAL . . . -55.6 -62.45 1.68 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.424 179.416 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.707 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 3.8 ptpp? -57.83 -27.01 62.8 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.037 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 1.073 HG22 ' CG ' ' A' ' 75' ' ' LYS . 99.4 t -61.05 -62.66 1.01 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.728 0 CA-C-O 122.149 0.976 . . . . 0.0 110.25 179.569 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.936 ' HB3' HG21 ' A' ' 63' ' ' VAL . 0.1 OUTLIER -68.64 -32.7 72.75 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.156 -179.199 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 1.06 HD21 HD23 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -73.37 -22.9 60.17 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 120.901 0.382 . . . . 0.0 110.49 179.359 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.565 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 2.2 tp10 -72.49 -43.44 63.66 Favored 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 106.243 -1.762 . . . . 0.0 106.243 177.09 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.467 ' HB1' ' HB ' ' A' ' 66' ' ' VAL . . . -75.46 -22.55 57.19 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 114.309 -1.314 . . . . 0.0 109.881 177.424 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 1.017 ' HB1' HD21 ' A' ' 5' ' ' LEU . . . -79.45 -49.93 11.57 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.503 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.762 HD13 ' ND1' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -63.91 -38.32 90.64 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.86 179.806 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.565 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -79.72 -33.93 40.47 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -179.285 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.748 ' HG3' HG13 ' A' ' 67' ' ' VAL . 12.1 tm0? -95.12 -19.43 20.12 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -177.826 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -93.6 -68.76 0.78 Allowed 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 119.743 -0.783 . . . . 0.0 111.976 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 2.0 t . . . . . 0 C--N 1.326 -0.445 0 CA-C-O 121.649 0.737 . . . . 0.0 111.31 179.271 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 3.4 p30 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.775 0.322 . . . . 0.0 110.868 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.833 ' HB2' HD13 ' A' ' 8' ' ' LEU . 4.7 mp -78.18 -175.29 4.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.623 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -103.04 153.13 20.57 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.01 179.201 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.756 ' HA ' HD23 ' A' ' 117' ' ' LEU . 75.4 mt -47.02 -61.83 1.69 Allowed 'General case' 0 CA--C 1.509 -0.607 0 CA-C-O 121.499 0.666 . . . . 0.0 110.993 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.546 ' HA ' HD13 ' A' ' 121' ' ' LEU . 5.2 t -42.77 -61.6 1.22 Allowed 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.278 -179.282 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -69.57 -56.74 6.48 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.971 0.415 . . . . 0.0 110.867 -179.42 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 1.056 HD23 HD21 ' A' ' 117' ' ' LEU . 23.5 tp -45.54 -45.84 13.66 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.751 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' HIS . . . . . 0.748 ' CG ' HD22 ' A' ' 121' ' ' LEU . 56.4 t-80 -66.06 -40.27 90.77 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.424 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.4 -53.74 41.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.776 -1.102 . . . . 0.0 111.198 179.646 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.98 ' HG3' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -69.16 -55.39 10.79 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 120.791 0.329 . . . . 0.0 111.235 -179.795 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.875 HG22 HD13 ' A' ' 110' ' ' LEU . 3.8 p -51.9 -49.63 36.59 Favored 'Isoleucine or valine' 0 C--O 1.242 0.694 0 CA-C-O 121.22 0.533 . . . . 0.0 110.659 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.785 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 52.9 m -62.73 -41.89 99.4 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.557 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.475 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -67.25 -17.7 64.91 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.385 179.629 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.841 HD12 ' HA ' ' A' ' 12' ' ' VAL . 6.1 mt -83.14 -61.43 1.86 Allowed 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -179.795 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.566 ' CG2' ' HB3' ' A' ' 110' ' ' LEU . 0.9 OUTLIER -69.38 -34.27 61.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 C-N-CA 120.015 -0.674 . . . . 0.0 111.34 -179.068 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.45 ' HB2' ' O ' ' A' ' 13' ' ' SER . 3.5 mm-40 -69.62 -16.16 63.33 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.176 -179.507 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.475 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 2.8 pt20 -163.57 56.86 0.17 Allowed 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 120.854 -0.338 . . . . 0.0 111.44 179.301 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 176.52 -63.1 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.454 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.609 ' OG ' ' HB1' ' A' ' 33' ' ' ALA . 0.5 OUTLIER -79.08 -80.47 0.12 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.374 -179.324 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLY . . . . . 0.556 ' H ' HG22 ' A' ' 16' ' ' VAL . . . 113.28 -18.7 20.69 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.481 -179.599 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.63 ' O ' ' O ' ' A' ' 23' ' ' CYS . 21.9 p-10 166.46 -14.98 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.355 0.262 . . . . 0.0 111.388 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.63 ' O ' ' O ' ' A' ' 22' ' ' ASP . 58.0 m -42.13 -164.75 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.368 0.667 . . . . 0.0 112.718 -179.386 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.562 ' HA ' ' HA ' ' A' ' 109' ' ' THR . 20.4 m -103.75 162.15 13.33 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.781 -179.387 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.678 ' HA2' HD23 ' A' ' 110' ' ' LEU . . . -105.12 135.7 12.71 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.495 -0.86 . . . . 0.0 113.912 -178.666 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.945 ' HB3' ' HB3' ' A' ' 32' ' ' ALA . 1.3 tmmm? -104.92 119.52 39.21 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 178.865 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.65 HD23 ' N ' ' A' ' 28' ' ' ARG . 1.6 tt -104.63 165.25 11.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.665 -178.881 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.65 ' N ' HD23 ' A' ' 27' ' ' LEU . 0.0 OUTLIER 140.1 56.2 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.618 1.167 . . . . 0.0 109.492 -179.862 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.729 ' C ' HD11 ' A' ' 3' ' ' LEU . . . 88.53 -4.94 85.15 Favored Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.877 -0.678 . . . . 0.0 111.764 -178.894 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.538 ' N ' HD11 ' A' ' 3' ' ' LEU . 0.1 OUTLIER -165.7 165.46 18.6 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 -179.95 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.98 HG12 ' HG3' ' A' ' 11' ' ' GLN . 3.7 p -112.58 136.65 48.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.251 0.548 . . . . 0.0 110.911 178.86 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.945 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . . . -129.3 167.43 17.72 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.629 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.609 ' HB1' ' OG ' ' A' ' 20' ' ' SER . . . -102.77 121.3 42.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.235 0.541 . . . . 0.0 111.588 -178.752 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.526 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 2.4 t30 -105.05 115.7 30.72 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.542 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.02 -25.78 15.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.391 -179.848 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.54 ' O ' ' HB ' ' A' ' 37' ' ' THR . 14.0 mm-40 -42.93 -82.21 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.717 -179.314 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.865 HG23 HG23 ' A' ' 38' ' ' THR . 7.5 t 172.0 -168.79 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.879 0.371 . . . . 0.0 110.945 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.865 HG23 HG23 ' A' ' 37' ' ' THR . 2.8 p 62.77 121.04 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.96 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.713 ' O ' ' HB3' ' A' ' 107' ' ' GLN . 11.3 p90 169.15 -31.67 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.688 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.57 ' NE2' ' O ' ' A' ' 40' ' ' GLN . 0.0 OUTLIER -54.78 67.99 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.602 -0.727 . . . . 0.0 112.478 -178.704 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.605 ' N ' ' O ' ' A' ' 39' ' ' PHE . . . 36.01 87.15 0.01 OUTLIER Glycine 0 C--N 1.332 0.31 0 CA-C-N 116.018 -0.537 . . . . 0.0 113.621 179.032 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.627 HD23 ' HB2' ' A' ' 48' ' ' ALA . 0.1 OUTLIER -141.8 169.99 16.55 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 179.168 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.596 ' C ' HD12 ' A' ' 44' ' ' ILE . 0.7 OUTLIER -103.28 41.31 1.28 Allowed 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 -177.698 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.921 HG23 ' O ' ' A' ' 48' ' ' ALA . 3.4 mp 53.54 5.14 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 179.012 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.433 ' H ' ' C ' ' A' ' 43' ' ' THR . . . -74.41 -41.29 61.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.928 0.394 . . . . 0.0 110.846 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.583 ' H ' HD11 ' A' ' 42' ' ' LEU . 0.5 OUTLIER -72.31 -32.18 66.34 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.477 179.664 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.447 ' O ' HG21 ' A' ' 38' ' ' THR . . . 142.62 34.33 0.1 OUTLIER Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.618 -0.801 . . . . 0.0 113.381 179.57 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.921 ' O ' HG23 ' A' ' 44' ' ' ILE . . . -85.89 149.78 24.98 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 117.118 0.459 . . . . 0.0 111.049 179.624 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 7.4 mtm180 -81.45 159.89 24.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.738 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.609 ' O ' HG23 ' A' ' 54' ' ' VAL . 0.2 OUTLIER -67.32 -21.38 65.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.952 179.873 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 51' ' ' SER . . . . . 0.469 ' HB2' ' HA ' ' A' ' 26' ' ' LYS . 1.0 OUTLIER -61.0 -65.1 0.75 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.379 -179.585 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.462 ' N ' ' OG ' ' A' ' 51' ' ' SER . 0.0 OUTLIER -49.08 -65.84 0.5 Allowed 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.977 0.417 . . . . 0.0 110.809 -179.824 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.643 ' HA ' ' HA ' ' A' ' 107' ' ' GLN . 0.0 OUTLIER -43.82 -51.25 7.51 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.094 179.872 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.609 HG23 ' O ' ' A' ' 50' ' ' GLU . 53.4 t -61.13 -31.14 49.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.083 0.468 . . . . 0.0 110.244 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.734 ' HB3' ' HB3' ' A' ' 108' ' ' MET . 0.3 OUTLIER -66.61 -48.0 70.9 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.615 179.649 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.798 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -60.45 -45.87 92.11 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.966 0.412 . . . . 0.0 110.201 179.33 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 21.1 mm-40 -55.26 -55.55 30.09 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.604 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -67.38 -30.54 70.35 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.005 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.768 HG11 HD23 ' A' ' 116' ' ' LEU . 0.9 OUTLIER -60.56 -57.09 13.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.258 -179.556 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 1.009 HD21 ' CE2' ' A' ' 88' ' ' TYR . 42.3 mt -75.49 -34.71 60.89 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 121.339 0.59 . . . . 0.0 111.335 -179.666 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 45.5 m -57.83 -42.12 83.71 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.18 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' HIS . . . . . 0.486 ' HB3' HD21 ' A' ' 5' ' ' LEU . 0.1 OUTLIER -75.62 -50.27 16.02 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-O 120.751 0.31 . . . . 0.0 110.611 179.94 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.922 HG12 ' CB ' ' A' ' 120' ' ' ALA . 11.6 m -60.06 -50.37 80.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.943 0.401 . . . . 0.0 110.55 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.522 ' N ' HG23 ' A' ' 63' ' ' VAL . . . 34.92 34.71 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.56 -0.745 . . . . 0.0 112.148 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.72 ' O ' HG22 ' A' ' 66' ' ' VAL . 0.5 OUTLIER 163.47 -81.12 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -179.679 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.834 HG13 ' HB ' ' A' ' 63' ' ' VAL . 11.3 m 54.63 -160.15 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 122.725 0.41 . . . . 0.0 110.911 -177.564 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.573 HG22 ' CB ' ' A' ' 97' ' ' ASN . 9.9 p -151.72 -28.02 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.72 HD22 ' CD1' ' A' ' 76' ' ' LEU . 0.3 OUTLIER 32.27 95.24 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.976 -0.556 . . . . 0.0 112.407 179.193 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.668 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 14.5 p -66.11 -117.67 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.69 179.701 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.455 ' N ' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER -95.06 -38.94 10.4 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.062 0.458 . . . . 0.0 110.963 179.974 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -64.0 -61.12 2.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.089 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.717 ' HB3' HD23 ' A' ' 68' ' ' LEU . 0.8 OUTLIER -59.27 -30.26 68.16 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.21 -179.646 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.455 HG22 ' HB3' ' A' ' 98' ' ' SER . 0.9 OUTLIER -63.39 -59.05 5.2 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 178.323 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -57.52 -24.75 57.78 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.292 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 1.006 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.1 OUTLIER -62.25 -56.88 14.2 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 114.742 -1.117 . . . . 0.0 110.066 178.773 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.727 HD21 HD13 ' A' ' 100' ' ' LEU . 0.4 OUTLIER -59.23 -38.58 80.32 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.33 0.586 . . . . 0.0 109.438 178.613 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.9 -48.7 79.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.078 -0.965 . . . . 0.0 111.35 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.8 mm-40 -72.42 -42.42 65.11 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.311 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 4.7 p -68.91 -27.63 65.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.272 -179.704 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 81.2 m . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.573 -179.626 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ASN . . . . . 0.414 HD22 ' N ' ' A' ' 41' ' ' GLY . 14.2 p30 . . . . . 0 C--O 1.238 0.5 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 1.009 ' CE2' HD21 ' A' ' 60' ' ' LEU . 2.4 m-85 -99.62 148.95 23.78 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 120.329 -0.548 . . . . 0.0 111.485 -179.331 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.686 ' O ' ' O ' ' A' ' 101' ' ' VAL . 0.0 OUTLIER -119.68 148.64 43.14 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.509 -179.116 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.689 HD12 ' N ' ' A' ' 90' ' ' LEU . 0.0 OUTLIER -148.9 150.61 33.25 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.307 0.575 . . . . 0.0 112.18 -179.335 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 18.0 tpt180 -121.94 141.65 51.1 Favored 'General case' 0 C--O 1.221 -0.435 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.074 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.805 ' O ' HG13 ' A' ' 93' ' ' VAL . 55.4 p -104.71 145.85 29.78 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.879 1.066 . . . . 0.0 113.879 -177.866 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.805 HG13 ' O ' ' A' ' 92' ' ' SER . 3.6 m . . . . . 0 CA--C 1.539 0.553 0 CA-C-N 113.297 -1.774 . . . . 0.0 107.908 179.204 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.668 ' HA ' ' HA ' ' A' ' 69' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.346 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.526 ' O ' ' O ' ' A' ' 67' ' ' VAL . 1.5 t -137.39 165.4 26.32 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.431 0.634 . . . . 0.0 111.165 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -103.68 147.63 9.67 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 179.225 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.733 HD23 HG21 ' A' ' 63' ' ' VAL . 7.6 tp -103.77 105.76 16.06 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 121.909 0.862 . . . . 0.0 113.302 -177.646 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.686 ' O ' ' O ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -123.14 120.57 60.77 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 N-CA-C 103.743 -2.688 . . . . 0.0 103.743 175.467 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 102' ' ' SER . . . . . 0.716 ' OG ' HD11 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -157.96 166.17 33.27 Favored 'General case' 0 C--N 1.305 -1.341 0 C-N-CA 117.529 -1.669 . . . . 0.0 114.395 -173.895 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.984 HD23 HD12 ' A' ' 60' ' ' LEU . 0.1 OUTLIER 161.9 -90.16 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.105 0 CA-C-N 113.502 -1.681 . . . . 0.0 111.835 175.59 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.555 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 53.75 27.61 7.2 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 -179.416 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.555 ' CB ' ' O ' ' A' ' 104' ' ' ARG . 17.6 m 133.99 160.5 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.552 1.141 . . . . 0.0 108.1 -178.543 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.569 ' O ' ' HG3' ' A' ' 107' ' ' GLN . 1.0 OUTLIER -104.82 101.0 10.62 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 120.038 -0.665 . . . . 0.0 112.243 -178.703 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.798 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 5.5 mt-30 -169.85 159.82 8.16 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.415 177.392 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.734 ' HB3' ' HB3' ' A' ' 55' ' ' PHE . 2.4 tpt -158.56 153.73 25.47 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.629 0.604 . . . . 0.0 112.629 179.683 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' THR . . . . . 0.7 HG22 ' CD1' ' A' ' 39' ' ' PHE . 0.1 OUTLIER -115.47 165.29 13.15 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.857 178.662 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.875 HD13 HG22 ' A' ' 12' ' ' VAL . 0.2 OUTLIER -50.94 -55.78 15.58 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.696 0.284 . . . . 0.0 111.288 -179.933 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 111' ' ' GLN . . . . . 0.743 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 3.3 tp-100 -49.17 -65.96 0.48 Allowed 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.355 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 0.782 ' O ' HD22 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -49.57 -56.94 8.14 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.025 0.44 . . . . 0.0 110.83 -179.224 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 0.622 ' HB1' ' CZ ' ' A' ' 55' ' ' PHE . . . -40.44 -54.57 2.44 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.843 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.785 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -67.31 -33.34 75.07 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.099 179.708 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 1.006 HG22 ' CG ' ' A' ' 75' ' ' LYS . 54.9 t -54.36 -61.69 0.91 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.746 0 CA-C-O 121.756 0.788 . . . . 0.0 110.72 179.697 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.782 HD22 ' O ' ' A' ' 112' ' ' ASP . 0.1 OUTLIER -62.26 -43.2 99.37 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.177 -179.534 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 1.056 HD21 HD23 ' A' ' 8' ' ' LEU . 0.7 OUTLIER -66.99 -19.08 65.66 Favored 'General case' 0 CA--C 1.51 -0.565 0 C-N-CA 120.764 -0.375 . . . . 0.0 111.156 179.624 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.744 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 10.1 tt0 -70.7 -54.18 12.81 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 106.095 -1.817 . . . . 0.0 106.095 176.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.511 ' O ' ' HB2' ' A' ' 123' ' ' GLN . . . -69.83 -18.86 63.47 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.478 -1.237 . . . . 0.0 110.675 177.819 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.922 ' CB ' HG12 ' A' ' 63' ' ' VAL . . . -79.88 -62.72 1.6 Allowed 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 121.151 0.5 . . . . 0.0 110.432 179.543 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.748 HD22 ' CG ' ' A' ' 9' ' ' HIS . 0.1 OUTLIER -60.01 -24.78 64.76 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.525 -179.619 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.744 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -87.01 -41.69 13.68 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -179.903 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.511 ' HB2' ' O ' ' A' ' 119' ' ' ALA . 1.1 tm0? -84.8 -29.76 25.14 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -178.463 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -95.24 -65.97 0.94 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.543 0.571 . . . . 0.0 112.543 -178.873 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.325 -0.468 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.423 -178.17 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' ASN . . . . . 0.626 ' CG ' HD21 ' A' ' 27' ' ' LEU . 30.4 t30 . . . . . 0 CA--C 1.528 0.118 0 CA-C-O 120.874 0.369 . . . . 0.0 110.679 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.719 HD11 ' C ' ' A' ' 29' ' ' GLY . 0.3 OUTLIER -66.57 172.28 4.3 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.374 -179.487 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 53.5 p -74.0 -151.34 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.877 179.165 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.838 HD23 ' CE1' ' A' ' 9' ' ' HIS . 1.1 mt -95.27 -66.56 0.9 Allowed 'General case' 0 CA--C 1.504 -0.826 0 CA-C-O 121.531 0.681 . . . . 0.0 111.757 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.458 ' O ' ' HG2' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -35.73 -46.78 0.46 Allowed 'General case' 0 N--CA 1.435 -1.223 0 CA-C-N 115.205 -0.907 . . . . 0.0 112.914 -178.422 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -78.97 -42.49 26.68 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -179.584 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.858 HD23 HD21 ' A' ' 117' ' ' LEU . 11.2 tp -64.23 -35.47 80.93 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.545 0.688 . . . . 0.0 110.868 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' HIS . . . . . 1.006 ' CD2' HD23 ' A' ' 117' ' ' LEU . 3.4 m170 -79.62 -43.1 23.52 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.727 -1.124 . . . . 0.0 110.873 -178.917 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.492 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 5.2 mmt85 -60.2 -37.57 80.66 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 178.375 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.836 ' HG2' HG13 ' A' ' 31' ' ' VAL . 5.9 tt0 -65.59 -65.91 0.61 Allowed 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.455 178.665 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.757 ' O ' HG12 ' A' ' 16' ' ' VAL . 7.4 p -55.08 -48.11 76.39 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.517 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.504 ' N ' HG13 ' A' ' 12' ' ' VAL . 83.9 p -54.81 -60.05 3.9 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.383 -179.454 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.492 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -53.97 -48.19 70.58 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -178.698 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.942 ' CD1' HD22 ' A' ' 110' ' ' LEU . 0.2 OUTLIER -60.28 -57.75 11.43 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 119.61 -0.836 . . . . 0.0 111.084 -179.267 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.828 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 9.9 p -69.28 -11.67 15.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -178.627 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.729 ' HG2' ' HE3' ' A' ' 114' ' ' LYS . 3.8 mm-40 -95.6 -4.36 44.68 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -148.83 -47.17 0.15 Allowed 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -87.81 -61.33 1.74 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -178.888 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.828 ' HB2' ' HA ' ' A' ' 16' ' ' VAL . 4.6 m -73.76 -47.24 40.5 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.037 -0.529 . . . . 0.0 112.318 -178.479 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 85.07 -39.85 2.99 Favored Glycine 0 CA--C 1.519 0.308 0 C-N-CA 120.519 -0.848 . . . . 0.0 111.782 -178.679 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.754 ' O ' HD12 ' A' ' 110' ' ' LEU . 7.5 t70 -170.59 -66.44 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.569 ' O ' ' O ' ' A' ' 22' ' ' ASP . 0.1 OUTLIER 28.46 -159.22 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.624 0.769 . . . . 0.0 112.506 178.945 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.746 ' HA ' HG22 ' A' ' 109' ' ' THR . 0.1 OUTLIER -104.03 156.08 18.15 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.063 -0.718 . . . . 0.0 109.063 179.005 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.444 ' H ' ' HA ' ' A' ' 109' ' ' THR . . . -104.68 119.69 6.33 Favored Glycine 0 N--CA 1.443 -0.85 0 C-N-CA 120.172 -1.013 . . . . 0.0 113.184 -178.551 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.99 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -104.58 115.5 30.46 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 178.67 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.626 HD21 ' CG ' ' A' ' 2' ' ' ASN . 2.8 tt -110.09 151.8 26.77 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.574 0.702 . . . . 0.0 112.605 -177.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.462 ' HG2' ' C ' ' A' ' 27' ' ' LEU . 4.9 ptp180 160.78 52.49 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 114.63 -1.168 . . . . 0.0 108.888 179.7 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.719 ' C ' HD11 ' A' ' 3' ' ' LEU . . . 100.76 -6.81 57.27 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.137 -178.24 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.414 ' HA ' ' NE2' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -166.36 165.55 17.14 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 179.868 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.836 HG13 ' HG2' ' A' ' 11' ' ' GLN . 0.2 OUTLIER -116.77 122.53 70.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.227 0.537 . . . . 0.0 110.432 178.709 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.99 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -120.22 167.1 12.6 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.008 -179.387 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.753 ' HB2' ' OG ' ' A' ' 20' ' ' SER . . . -102.2 127.72 49.02 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.274 0.559 . . . . 0.0 111.542 -179.024 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.425 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 4.4 t-20 -111.89 132.53 54.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.643 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.1 -22.04 3.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.228 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -57.72 -23.52 52.29 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.427 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 4.6 t -154.97 155.04 33.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.062 0.458 . . . . 0.0 110.626 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 23.2 p -81.84 -122.63 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.609 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.551 ' CZ ' HG23 ' A' ' 109' ' ' THR . 0.2 OUTLIER -176.32 -85.48 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 121.351 -0.14 . . . . 0.0 111.131 179.962 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.537 ' O ' ' C ' ' A' ' 41' ' ' GLY . 0.0 OUTLIER 56.06 88.68 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 122.45 0.3 . . . . 0.0 111.141 179.667 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.537 ' C ' ' O ' ' A' ' 40' ' ' GLN . . . 14.4 98.41 0.0 OUTLIER Glycine 0 C--N 1.346 1.108 0 O-C-N 123.498 0.499 . . . . 0.0 112.738 -179.193 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.819 HD11 ' HB2' ' A' ' 46' ' ' SER . 6.2 tp -151.08 159.9 44.22 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.481 -0.192 . . . . 0.0 110.481 -178.157 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.447 ' C ' ' H ' ' A' ' 45' ' ' ALA . 0.0 OUTLIER -107.37 33.1 4.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.942 0.401 . . . . 0.0 111.282 -179.457 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.747 HD12 ' HB3' ' A' ' 48' ' ' ALA . 0.9 OUTLIER 59.13 -0.54 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.13 179.777 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.447 ' H ' ' C ' ' A' ' 43' ' ' THR . . . -77.97 -40.94 37.74 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.914 0.388 . . . . 0.0 110.719 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.819 ' HB2' HD11 ' A' ' 42' ' ' LEU . 0.5 OUTLIER -71.25 -31.16 67.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.712 179.81 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 143.92 52.92 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.989 179.634 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.747 ' HB3' HD12 ' A' ' 44' ' ' ILE . . . -121.09 -173.72 2.67 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.739 0.304 . . . . 0.0 111.256 179.795 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 14.7 ttm180 -109.74 139.4 44.84 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.091 -179.868 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.71 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 12.2 mt-10 -56.66 -18.1 11.08 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.412 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' SER . . . . . 0.658 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 0.8 OUTLIER -71.97 -56.98 4.71 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.316 -179.91 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.424 ' HB3' ' HG2' ' A' ' 107' ' ' GLN . 41.4 mt-10 -48.25 -44.23 33.19 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.033 0.444 . . . . 0.0 110.796 179.641 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.71 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -65.59 -58.69 5.15 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.507 -179.971 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.568 HG22 ' O ' ' A' ' 50' ' ' GLU . 14.1 m -49.27 -45.2 18.03 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-O 121.051 0.453 . . . . 0.0 110.352 179.823 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.783 ' CE1' ' HB1' ' A' ' 113' ' ' ALA . 0.2 OUTLIER -55.38 -53.62 53.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.827 178.649 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.696 ' HB2' ' C ' ' A' ' 107' ' ' GLN . . . -48.28 -45.85 35.16 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.577 179.176 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -64.07 -45.82 87.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.887 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.423 ' OG1' ' HA ' ' A' ' 55' ' ' PHE . 0.6 OUTLIER -64.35 -53.68 44.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.289 -179.528 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.857 HG23 HD12 ' A' ' 117' ' ' LEU . 4.6 p -60.66 -38.28 78.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.064 179.544 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.559 HD13 ' O ' ' A' ' 102' ' ' SER . 7.2 tp -61.23 -39.14 89.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.845 0.355 . . . . 0.0 110.268 178.843 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 33.8 m -69.53 -60.42 2.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.905 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' HIS . . . . . 0.541 ' HB3' HD21 ' A' ' 5' ' ' LEU . 14.2 m-70 -52.94 -27.67 19.97 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.837 0.351 . . . . 0.0 111.226 -179.387 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 1.103 HG21 ' HB3' ' A' ' 116' ' ' LEU . 3.8 t -102.41 46.78 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.045 -179.918 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.629 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . -76.56 57.77 1.27 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.412 -179.681 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.629 ' CB ' ' O ' ' A' ' 64' ' ' ALA . 26.0 t-20 132.31 -63.68 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.21 0.604 . . . . 0.0 111.381 179.632 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 1.089 HG11 HG13 ' A' ' 63' ' ' VAL . 35.4 m 42.47 -137.28 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.602 -179.455 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.51 ' O ' ' O ' ' A' ' 98' ' ' SER . 2.8 p -158.89 -31.95 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 121.027 0.441 . . . . 0.0 111.926 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.719 HD12 ' O ' ' A' ' 98' ' ' SER . 0.7 OUTLIER 40.85 95.67 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.647 179.226 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 22.0 p -66.78 -165.38 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.91 -34.15 71.36 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.017 0.437 . . . . 0.0 110.697 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -68.19 -51.33 46.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.63 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.692 ' O ' HD12 ' A' ' 76' ' ' LEU . 3.3 m-20 -60.46 -42.12 95.54 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.779 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 70.6 m -61.89 -44.64 96.39 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-O 121.103 0.478 . . . . 0.0 110.122 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.516 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . . . -68.81 -28.98 67.24 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 178.055 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 1.024 ' CG ' HG12 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -56.4 -57.52 11.95 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 114.061 -1.427 . . . . 0.0 109.834 178.354 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 1.014 HD22 HD21 ' A' ' 90' ' ' LEU . 5.9 mp -62.64 -53.43 54.66 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.164 179.244 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.661 HD12 ' C ' ' A' ' 77' ' ' LEU . 0.3 OUTLIER -54.52 -32.12 57.54 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.72 -179.763 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.476 ' NE2' ' OE1' ' A' ' 111' ' ' GLN . 0.6 OUTLIER -67.87 -65.03 0.74 Allowed 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.917 0.389 . . . . 0.0 109.994 179.115 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.03 -22.46 60.73 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.743 179.282 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 31.4 m . . . . . 0 C--N 1.332 -0.174 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.967 179.984 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 37.3 p-10 . . . . . 0 C--O 1.236 0.385 0 CA-C-O 120.761 0.315 . . . . 0.0 111.176 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.632 ' CG ' ' HB2' ' A' ' 102' ' ' SER . 2.8 m-85 -103.13 139.69 38.32 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.835 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.763 ' CG ' HG13 ' A' ' 101' ' ' VAL . 0.7 OUTLIER -109.63 146.24 35.11 Favored 'General case' 0 N--CA 1.436 -1.134 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -178.985 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 1.014 HD21 HD22 ' A' ' 76' ' ' LEU . 36.7 mt -136.01 153.58 51.33 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 113.364 0.875 . . . . 0.0 113.364 -177.449 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.444 ' O ' ' CB ' ' A' ' 98' ' ' SER . 25.2 ttp180 -130.71 142.65 50.43 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 114.69 -1.141 . . . . 0.0 108.193 178.031 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.455 ' O ' HG13 ' A' ' 93' ' ' VAL . 3.8 p -104.66 140.64 37.74 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 113.796 1.036 . . . . 0.0 113.796 -178.084 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.455 HG13 ' O ' ' A' ' 92' ' ' SER . 27.8 m . . . . . 0 N--CA 1.443 -0.82 0 CA-C-N 113.833 -1.53 . . . . 0.0 107.769 178.376 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.556 HD21 ' N ' ' A' ' 97' ' ' ASN . 0.1 OUTLIER . . . . . 0 CA--C 1.521 -0.169 0 N-CA-C 110.221 -0.289 . . . . 0.0 110.221 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.719 ' O ' HD12 ' A' ' 68' ' ' LEU . 0.9 OUTLIER -140.73 164.01 31.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.485 0.659 . . . . 0.0 111.308 -179.927 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.533 HG22 ' O ' ' A' ' 65' ' ' ASN . 0.5 OUTLIER -104.19 151.21 6.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 178.954 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.93 HD13 ' CD1' ' A' ' 116' ' ' LEU . 1.0 OUTLIER -103.94 111.54 24.13 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -178.995 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.763 HG13 ' CG ' ' A' ' 89' ' ' ASP . 1.4 p -124.27 104.68 14.26 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 104.352 -2.462 . . . . 0.0 104.352 175.143 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' SER . . . . . 0.632 ' HB2' ' CG ' ' A' ' 88' ' ' TYR . 9.0 p -148.92 165.35 31.84 Favored 'General case' 0 C--N 1.311 -1.106 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -173.987 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.541 HD13 ' O ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 158.62 -91.08 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.077 0 CA-C-N 113.07 -1.877 . . . . 0.0 111.864 176.03 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.512 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 56.87 23.07 7.72 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 -178.641 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.541 ' O ' HD13 ' A' ' 103' ' ' LEU . 5.1 m 138.9 168.22 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.859 1.264 . . . . 0.0 108.154 -178.52 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.428 ' O ' ' O ' ' A' ' 42' ' ' LEU . 1.3 m-20 -104.89 102.59 12.11 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.082 -0.647 . . . . 0.0 112.348 -179.076 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.702 HE21 ' HB1' ' A' ' 48' ' ' ALA . 4.5 mt-30 -168.1 157.47 9.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.699 177.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.492 ' HG2' ' HB2' ' A' ' 113' ' ' ALA . 0.0 OUTLIER -165.64 145.03 6.4 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.21 0.529 . . . . 0.0 112.293 179.268 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 109' ' ' THR . . . . . 0.746 HG22 ' HA ' ' A' ' 24' ' ' THR . 0.7 OUTLIER -104.26 163.47 12.39 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 178.256 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.942 HD22 ' CD1' ' A' ' 15' ' ' LEU . 5.2 mt -52.8 -61.39 2.32 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 120.165 -0.614 . . . . 0.0 109.838 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 111' ' ' GLN . . . . . 0.799 ' O ' HG13 ' A' ' 115' ' ' VAL . 2.5 tp60 -40.15 -63.38 0.62 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 120.713 0.292 . . . . 0.0 110.603 179.145 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 1.023 ' O ' HG22 ' A' ' 115' ' ' VAL . 8.0 m-20 -51.5 -58.51 6.1 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 121.265 0.555 . . . . 0.0 110.154 179.384 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 0.805 ' O ' HD13 ' A' ' 117' ' ' LEU . . . -48.4 -39.87 23.93 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.12 0.486 . . . . 0.0 110.108 178.798 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.729 ' HE3' ' HG2' ' A' ' 17' ' ' GLN . 0.0 OUTLIER -72.22 -26.97 62.24 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.877 179.729 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 1.024 HG12 ' CG ' ' A' ' 75' ' ' LYS . 10.8 m -70.48 -51.82 34.44 Favored 'Isoleucine or valine' 0 C--O 1.249 1.038 0 CA-C-O 121.406 0.622 . . . . 0.0 111.892 -179.079 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 1.103 ' HB3' HG21 ' A' ' 63' ' ' VAL . 0.5 OUTLIER -70.0 -37.84 75.82 Favored 'General case' 0 N--CA 1.439 -1.017 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 179.433 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 1.006 HD23 ' CD2' ' A' ' 9' ' ' HIS . 5.1 mp -65.6 -32.28 73.77 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.905 178.89 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 26.4 tp10 -62.17 -53.24 58.14 Favored 'General case' 0 C--N 1.31 -1.112 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 178.51 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.579 ' HB1' ' H ' ' A' ' 68' ' ' LEU . . . -74.47 -16.56 60.85 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 119.382 -0.927 . . . . 0.0 110.741 177.953 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.985 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -77.99 -61.51 1.98 Allowed 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.409 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.681 ' HB3' ' ND1' ' A' ' 9' ' ' HIS . 0.4 OUTLIER -56.55 -34.71 67.36 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 118.736 -1.186 . . . . 0.0 108.785 178.111 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.493 ' N ' ' HG ' ' A' ' 121' ' ' LEU . 0.1 OUTLIER -55.03 -65.28 0.61 Allowed 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 114.918 -1.037 . . . . 0.0 112.223 179.797 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.77 -13.25 24.27 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -177.977 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 124' ' ' GLU . . . . . 0.596 ' HB2' ' O ' ' A' ' 120' ' ' ALA . 5.0 mm-40 -97.68 -67.06 0.86 Allowed 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 -177.449 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 125' ' ' SER . . . . . 0.677 ' HB2' ' HA ' ' A' ' 121' ' ' LEU . 10.1 t . . . . . 0 CA--C 1.5 -0.981 0 CA-C-N 114.293 -1.321 . . . . 0.0 112.496 -176.458 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 2' ' ' ASN . . . . . 0.659 HD22 HD22 ' A' ' 8' ' ' LEU . 38.0 t30 . . . . . 0 C--O 1.231 0.111 0 CA-C-O 121.043 0.449 . . . . 0.0 110.885 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.578 HD12 ' OD1' ' A' ' 2' ' ' ASN . 0.0 OUTLIER -79.88 -76.02 0.23 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.098 179.579 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.503 ' O ' ' CB ' ' A' ' 8' ' ' LEU . 36.1 t -178.48 -151.72 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.766 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.567 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 23.1 mt -96.04 -64.7 1.03 Allowed 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 121.365 0.602 . . . . 0.0 111.453 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.448 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 0.9 OUTLIER -36.19 -59.16 0.64 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.766 -1.106 . . . . 0.0 112.958 -178.288 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ASP . . . . . 0.408 ' O ' ' HB3' ' A' ' 10' ' ' ARG . 0.7 OUTLIER -73.32 -54.32 8.66 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 120.757 0.313 . . . . 0.0 110.733 -179.387 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.983 HD23 HD21 ' A' ' 117' ' ' LEU . 46.0 tp -42.5 -51.19 5.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.254 0.549 . . . . 0.0 110.166 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' HIS . . . . . 0.74 ' CG ' HD22 ' A' ' 121' ' ' LEU . 9.6 t60 -64.34 -46.53 83.07 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 177.836 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.448 ' HB2' ' O ' ' A' ' 6' ' ' SER . 0.0 OUTLIER -50.84 -57.15 9.15 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.21 -1.359 . . . . 0.0 111.741 -179.545 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.663 ' HG3' HG22 ' A' ' 31' ' ' VAL . 2.3 pt20 -65.41 -51.37 60.78 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -179.145 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.876 HG23 HD23 ' A' ' 110' ' ' LEU . 8.9 p -58.75 -46.22 90.82 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-O 121.206 0.527 . . . . 0.0 110.614 179.765 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.845 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 24.5 t -56.56 -49.2 75.53 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.329 179.649 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.8 ttt85 -63.82 -30.5 71.59 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.952 0.405 . . . . 0.0 110.533 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.721 HD12 ' HA ' ' A' ' 12' ' ' VAL . 6.4 mt -67.56 -65.47 0.68 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.353 -179.422 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.499 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 0.9 OUTLIER -68.04 -27.7 38.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -178.566 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.401 ' HB2' ' O ' ' A' ' 13' ' ' SER . 1.8 mm-40 -87.09 -9.95 54.12 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.672 -179.523 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -151.94 38.44 0.59 Allowed 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 120.821 -0.351 . . . . 0.0 111.925 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 179.35 -67.69 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 179.733 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.565 ' CB ' HD13 ' A' ' 110' ' ' LEU . 15.3 m -72.33 -40.34 67.5 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -178.219 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLY . . . . . 0.432 ' H ' ' HA ' ' A' ' 16' ' ' VAL . . . 82.3 -50.42 4.32 Favored Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.374 -0.917 . . . . 0.0 112.192 -179.06 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -175.93 30.69 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.74 0.305 . . . . 0.0 111.412 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.46 ' HB2' ' HB3' ' A' ' 20' ' ' SER . 1.0 OUTLIER -79.22 -163.14 0.46 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.503 179.734 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.626 ' HA ' HG22 ' A' ' 109' ' ' THR . 40.5 m -104.13 149.44 25.23 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.413 ' CA ' ' HG ' ' A' ' 110' ' ' LEU . . . -107.21 145.29 16.0 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.2 -1.0 . . . . 0.0 113.639 -178.803 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.657 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 0.0 OUTLIER -108.86 123.6 49.31 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 178.939 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.759 HD23 ' N ' ' A' ' 28' ' ' ARG . 6.6 tt -104.27 163.52 12.36 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -178.304 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.759 ' N ' HD23 ' A' ' 27' ' ' LEU . 0.1 OUTLIER 145.86 58.67 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.425 1.09 . . . . 0.0 109.368 179.966 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.477 ' HA2' ' HG ' ' A' ' 3' ' ' LEU . . . 75.91 6.7 82.84 Favored Glycine 0 C--N 1.335 0.524 0 C-N-CA 120.109 -1.043 . . . . 0.0 110.727 -177.939 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -166.12 165.9 17.43 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 -179.52 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.765 ' CG1' HD12 ' A' ' 8' ' ' LEU . 0.7 OUTLIER -131.89 118.09 36.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.522 0.677 . . . . 0.0 111.215 178.763 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.647 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -104.92 166.07 10.63 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.901 -179.38 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.547 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -103.9 116.36 32.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.239 0.542 . . . . 0.0 111.344 -179.528 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.404 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 5.9 t30 -97.74 120.59 38.4 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.718 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.0 ttpp -114.15 -25.47 8.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.986 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -60.01 -55.0 39.45 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.818 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.57 -169.44 2.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.548 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.492 ' O ' ' HB3' ' A' ' 39' ' ' PHE . 29.7 p -132.67 -43.17 0.91 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.465 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.649 ' CD1' HG23 ' A' ' 109' ' ' THR . 0.0 OUTLIER 91.2 175.02 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.269 0.628 . . . . 0.0 110.746 -179.545 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.576 ' HB3' ' O ' ' A' ' 39' ' ' PHE . 0.1 OUTLIER 150.08 62.82 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.878 0.871 . . . . 0.0 109.803 -179.667 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.772 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . 67.27 -88.78 0.16 Allowed Glycine 0 CA--C 1.522 0.511 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.072 -178.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.75 HD23 ' HB2' ' A' ' 48' ' ' ALA . 13.6 tp 42.86 172.07 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 117.41 0.605 . . . . 0.0 111.915 179.257 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -127.85 34.79 4.57 Favored 'General case' 0 C--N 1.329 -0.285 0 O-C-N 121.81 -0.556 . . . . 0.0 111.655 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.972 HD13 ' HB3' ' A' ' 48' ' ' ALA . 30.2 mm 56.61 7.34 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 179.487 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -91.6 -31.23 15.97 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.723 0.297 . . . . 0.0 111.456 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.62 ' HB2' HD11 ' A' ' 42' ' ' LEU . 0.3 OUTLIER -91.78 -53.26 4.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.22 -179.828 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.74 ' H ' HD21 ' A' ' 42' ' ' LEU . . . 177.52 71.36 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.585 -0.816 . . . . 0.0 112.799 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.972 ' HB3' HD13 ' A' ' 44' ' ' ILE . . . -135.31 161.67 34.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.674 0.273 . . . . 0.0 110.775 179.731 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 29.4 mtt180 -93.83 134.22 36.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.115 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.619 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 7.0 mt-10 -51.29 -27.0 8.27 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.164 0.507 . . . . 0.0 110.732 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' SER . . . . . 0.507 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 31.1 p -69.82 -57.87 4.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.346 179.542 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.465 ' OE1' ' NE2' ' A' ' 107' ' ' GLN . 40.3 mt-10 -44.28 -50.69 8.85 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.183 179.666 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.619 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -65.04 -51.73 59.92 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.425 -179.815 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 50' ' ' GLU . 53.7 t -56.6 -37.48 52.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.959 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.84 ' CE1' ' HB1' ' A' ' 113' ' ' ALA . 0.2 OUTLIER -59.96 -47.61 85.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.179 -0.918 . . . . 0.0 109.429 178.746 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.752 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -54.79 -64.55 0.8 Allowed 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.83 178.75 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.4 ' O ' ' CB ' ' A' ' 61' ' ' SER . 2.6 mm-40 -39.87 -48.73 2.35 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.814 179.25 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.485 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 0.9 OUTLIER -65.19 -54.05 35.53 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.557 179.787 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.872 HG23 HD12 ' A' ' 117' ' ' LEU . 0.6 OUTLIER -48.42 -41.15 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 N-CA-C 112.562 0.579 . . . . 0.0 112.562 -178.74 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.739 ' CD1' HD21 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -93.36 -17.06 23.98 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.414 -0.515 . . . . 0.0 110.674 179.875 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.485 ' HB2' ' HA ' ' A' ' 58' ' ' THR . 1.8 m -66.57 -63.21 1.12 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.702 178.847 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' HIS . . . . . 0.503 ' CE1' ' HA ' ' A' ' 59' ' ' VAL . 4.7 p-80 -64.19 -43.34 95.38 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 121.159 0.504 . . . . 0.0 109.674 179.572 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.855 HG22 ' HB2' ' A' ' 120' ' ' ALA . 4.8 t -54.77 -60.03 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.555 178.35 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.532 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 40.45 26.06 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 115.374 -0.83 . . . . 0.0 113.152 178.673 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.681 ' H ' HG12 ' A' ' 63' ' ' VAL . 7.3 t30 149.92 -68.89 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 122.788 0.435 . . . . 0.0 110.848 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.769 ' CG2' HG13 ' A' ' 63' ' ' VAL . 23.4 m 45.24 -162.5 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.723 ' HB ' ' HB3' ' A' ' 97' ' ' ASN . 10.7 m -142.16 77.05 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.099 0 CA-C-O 121.012 0.434 . . . . 0.0 110.432 -178.666 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 1.094 HD22 HD11 ' A' ' 76' ' ' LEU . 0.2 OUTLIER -70.93 80.73 0.65 Allowed 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.971 -179.026 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 69.0 p -48.11 166.61 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 178.363 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -39.81 -35.02 0.3 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.043 0.449 . . . . 0.0 111.753 -179.491 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.444 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 3.2 tp10 -64.19 -48.2 76.85 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.189 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.682 ' O ' HD12 ' A' ' 76' ' ' LEU . 81.0 m-20 -70.96 -52.13 21.64 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.447 179.612 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.668 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 89.9 m -45.68 -39.41 7.91 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.136 0.493 . . . . 0.0 110.207 178.69 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.461 ' HA ' ' HG ' ' A' ' 77' ' ' LEU . . . -73.65 -41.85 62.17 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 178.203 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.951 ' HB3' ' CG2' ' A' ' 115' ' ' VAL . 0.1 OUTLIER -50.29 -44.97 54.14 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 113.684 -1.598 . . . . 0.0 108.636 176.971 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 1.094 HD11 HD22 ' A' ' 68' ' ' LEU . 2.1 mp -64.24 -54.14 38.13 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.561 178.282 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.668 ' HG ' ' O ' ' A' ' 73' ' ' THR . 5.1 mt -49.18 -39.87 31.05 Favored 'General case' 0 C--N 1.34 0.192 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 179.273 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 16.1 mt-30 -59.96 -53.33 59.1 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.75 178.969 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' SER . . . . . 0.542 ' CB ' ' HG3' ' A' ' 111' ' ' GLN . 0.0 OUTLIER -49.26 -49.25 44.24 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.297 179.337 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.808 -179.144 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ASN . . . . . 0.473 ' O ' ' HB2' ' A' ' 104' ' ' ARG . 5.6 p-10 . . . . . 0 C--O 1.233 0.232 0 CA-C-O 120.884 0.373 . . . . 0.0 110.565 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.636 ' HE2' HD12 ' A' ' 90' ' ' LEU . 0.3 OUTLIER -80.64 132.57 35.62 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-O 121.216 0.531 . . . . 0.0 112.053 -179.474 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.792 ' O ' ' O ' ' A' ' 101' ' ' VAL . 0.5 OUTLIER -105.96 125.83 51.46 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 104.891 -2.263 . . . . 0.0 104.891 176.611 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.636 HD12 ' HE2' ' A' ' 88' ' ' TYR . 3.1 mt -122.17 134.49 54.72 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 115.45 1.648 . . . . 0.0 115.45 -174.276 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.8 ttt-85 -129.04 104.49 7.6 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 104.628 -2.36 . . . . 0.0 104.628 175.273 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.434 ' CB ' ' HB3' ' A' ' 98' ' ' SER . 2.7 m -104.21 165.35 11.11 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 115.842 1.793 . . . . 0.0 115.842 -174.119 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.704 HG23 ' HA ' ' A' ' 98' ' ' SER . 0.2 OUTLIER . . . . . 0 C--N 1.324 -0.517 0 CA-C-N 111.733 -2.485 . . . . 0.0 107.023 178.23 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.723 ' HB3' ' HB ' ' A' ' 67' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.216 -0.704 0 CA-C-O 121.236 0.541 . . . . 0.0 112.34 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.704 ' HA ' HG23 ' A' ' 93' ' ' VAL . 3.9 m -155.25 142.34 19.25 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.239 178.714 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.433 HG13 ' HA ' ' A' ' 65' ' ' ASN . 84.1 t -104.12 133.45 48.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.835 -177.755 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 1.053 HD11 ' HB3' ' A' ' 102' ' ' SER . 3.3 tm? -104.42 120.9 42.29 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 113.848 1.055 . . . . 0.0 113.848 -178.205 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.792 ' O ' ' O ' ' A' ' 89' ' ' ASP . 1.5 p -124.07 103.91 13.29 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 N-CA-C 103.686 -2.709 . . . . 0.0 103.686 174.299 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' SER . . . . . 1.053 ' HB3' HD11 ' A' ' 100' ' ' LEU . 1.2 t -144.2 165.58 27.44 Favored 'General case' 0 CA--C 1.492 -1.255 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -173.934 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.739 HD21 ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER 161.86 -81.71 0.0 OUTLIER 'General case' 0 N--CA 1.428 -1.549 0 CA-C-N 112.669 -2.059 . . . . 0.0 110.744 175.78 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.574 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 46.66 31.46 1.4 Allowed 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.341 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.584 ' HB3' ' N ' ' A' ' 42' ' ' LEU . 58.3 m 129.68 164.82 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.597 1.159 . . . . 0.0 108.453 -178.219 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.553 ' HB3' ' HB2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -104.96 102.19 11.72 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -177.737 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.772 ' HB2' ' O ' ' A' ' 41' ' ' GLY . 7.9 mt-30 -169.43 162.59 10.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.84 177.26 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.556 ' HB2' ' HB2' ' A' ' 56' ' ' ALA . 1.2 tpt -164.76 147.34 8.47 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.363 -0.535 . . . . 0.0 112.002 178.495 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' THR . . . . . 0.649 HG23 ' CD1' ' A' ' 39' ' ' PHE . 0.3 OUTLIER -109.25 164.84 12.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.348 179.474 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.876 HD23 HG23 ' A' ' 12' ' ' VAL . 1.0 OUTLIER -50.44 -53.9 26.1 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.199 0.523 . . . . 0.0 110.17 179.316 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 111' ' ' GLN . . . . . 0.832 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 1.9 tp-100 -51.22 -65.94 0.47 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.281 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 0.6 ' HA ' HG12 ' A' ' 115' ' ' VAL . 1.2 t0 -50.14 -47.48 54.19 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-O 121.542 0.687 . . . . 0.0 110.782 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 0.862 ' HA ' HG21 ' A' ' 59' ' ' VAL . . . -53.47 -50.16 65.93 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.86 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.845 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -70.67 -33.58 71.09 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.797 -178.648 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.951 ' CG2' ' HB3' ' A' ' 75' ' ' LYS . 4.0 p -62.45 -52.18 63.08 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.104 0 C-N-CA 119.082 -1.047 . . . . 0.0 110.229 179.524 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.731 HD22 HG13 ' A' ' 59' ' ' VAL . 3.1 mp -64.2 -39.77 94.69 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-N 114.44 -1.255 . . . . 0.0 110.182 -178.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.983 HD21 HD23 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -74.26 -16.67 60.94 Favored 'General case' 0 CA--C 1.511 -0.52 0 C-N-CA 120.369 -0.532 . . . . 0.0 111.161 178.99 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.715 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 0.0 OUTLIER -72.17 -47.96 46.94 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 106.152 -1.795 . . . . 0.0 106.152 176.77 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.423 ' O ' ' HB2' ' A' ' 123' ' ' GLN . . . -72.46 -28.19 62.77 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.846 177.102 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.855 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -68.89 -62.35 1.42 Allowed 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.948 179.571 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.74 HD22 ' CG ' ' A' ' 9' ' ' HIS . 0.1 OUTLIER -60.47 -37.57 81.44 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.718 -179.502 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.715 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.1 OUTLIER -70.17 -34.46 73.02 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -179.836 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.606 ' HB2' HG22 ' A' ' 67' ' ' VAL . 0.0 OUTLIER -90.95 -26.63 19.17 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.554 0.575 . . . . 0.0 112.554 -178.542 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -95.68 -66.26 0.92 Allowed 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 -178.799 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.327 -0.383 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -178.081 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 5.4 p30 . . . . . 0 N--CA 1.461 0.095 0 CA-C-O 121.009 0.433 . . . . 0.0 111.137 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 1.008 HD11 HD13 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -95.48 -94.98 0.18 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.383 179.048 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.433 ' O ' ' HB2' ' A' ' 8' ' ' LEU . 40.6 t -141.96 -168.74 2.76 Favored 'General case' 0 C--N 1.335 -0.062 0 CA-C-O 120.742 0.306 . . . . 0.0 110.592 179.459 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.884 HD23 HD23 ' A' ' 117' ' ' LEU . 0.8 OUTLIER -95.51 -66.18 0.93 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.457 0.646 . . . . 0.0 111.397 -179.914 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.58 -37.55 87.95 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.492 -178.698 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ASP . . . . . 0.512 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 0.5 OUTLIER -66.12 -52.25 50.3 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 178.469 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 1.008 HD13 HD11 ' A' ' 3' ' ' LEU . 42.5 tp -49.24 -54.22 17.82 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.113 178.328 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' HIS . . . . . 0.598 ' CG ' HD22 ' A' ' 121' ' ' LEU . 42.7 t-80 -53.45 -41.44 66.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.883 178.884 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.512 ' HB2' ' O ' ' A' ' 7' ' ' ASP . 3.1 mmt85 -56.47 -57.76 10.93 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.691 -179.506 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.814 ' HG3' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -64.81 -49.95 68.65 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 120.444 -0.502 . . . . 0.0 111.624 -179.313 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.957 HG23 HD23 ' A' ' 110' ' ' LEU . 9.8 p -60.08 -47.9 90.06 Favored 'Isoleucine or valine' 0 C--O 1.24 0.578 0 CA-C-O 121.119 0.485 . . . . 0.0 110.803 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.658 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 53.0 m -63.59 -49.35 73.7 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.28 179.305 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.443 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 13.3 mtp180 -61.76 -23.5 66.21 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.414 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.622 HD12 ' HA ' ' A' ' 12' ' ' VAL . 8.7 mt -72.61 -61.89 1.64 Allowed 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 121.009 0.433 . . . . 0.0 110.656 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.711 HG13 ' C ' ' A' ' 21' ' ' GLY . 23.1 t -70.24 -30.92 45.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.242 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.437 ' CG ' ' O ' ' A' ' 13' ' ' SER . 0.4 OUTLIER -71.71 -19.09 62.1 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.132 -179.51 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.443 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 1.8 pt20 -155.63 50.4 0.55 Allowed 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.697 178.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -178.75 -66.5 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.814 0.34 . . . . 0.0 111.885 179.511 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.462 ' HB2' ' HA ' ' A' ' 16' ' ' VAL . 1.8 m -77.27 -81.37 0.09 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.536 -178.895 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLY . . . . . 0.711 ' C ' HG13 ' A' ' 16' ' ' VAL . . . 124.55 -45.25 1.19 Allowed Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 121.081 -0.581 . . . . 0.0 111.802 -179.591 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 179.94 32.08 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.101 0.477 . . . . 0.0 110.141 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.418 ' HB3' ' O ' ' A' ' 34' ' ' ASN . 21.4 m -80.36 -163.3 0.54 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.202 -179.586 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.753 HG21 ' CD2' ' A' ' 39' ' ' PHE . 20.5 m -104.56 142.34 34.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.946 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -105.3 139.91 14.86 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.437 -0.887 . . . . 0.0 113.49 -178.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.919 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -110.59 135.38 51.32 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 179.193 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.58 HD23 ' N ' ' A' ' 28' ' ' ARG . 4.4 tt -104.89 160.58 14.9 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -178.938 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.58 ' N ' HD23 ' A' ' 27' ' ' LEU . 0.0 OUTLIER 158.75 55.31 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.202 -179.947 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.431 ' O ' HD23 ' A' ' 3' ' ' LEU . . . 76.7 2.74 77.18 Favored Glycine 0 C--N 1.334 0.426 0 N-CA-C 110.632 -0.987 . . . . 0.0 110.632 -177.561 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -166.18 165.47 17.58 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.814 HG12 ' HG3' ' A' ' 11' ' ' GLN . 1.7 p -116.35 128.92 73.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 121.4 0.619 . . . . 0.0 111.205 178.851 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.919 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -115.56 165.68 12.75 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.076 -0.965 . . . . 0.0 110.416 179.759 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.591 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -104.0 137.99 41.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.199 0.524 . . . . 0.0 111.855 -179.327 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.526 HD21 HG23 ' A' ' 37' ' ' THR . 2.9 t30 -122.27 113.81 19.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.319 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.86 -23.53 10.52 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.258 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -50.92 -45.02 60.29 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.891 0.377 . . . . 0.0 110.742 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.579 HG21 ' CE1' ' A' ' 39' ' ' PHE . 10.2 t -128.2 -158.12 0.86 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.259 179.404 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 26.0 p -155.11 100.93 2.21 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.953 0.406 . . . . 0.0 111.036 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.867 ' O ' HG23 ' A' ' 109' ' ' THR . 10.9 m-85 -86.26 131.85 34.13 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.682 0.754 . . . . 0.0 111.911 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.654 ' H ' ' NE2' ' A' ' 107' ' ' GLN . 0.1 OUTLIER -160.03 81.88 0.71 Allowed 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.519 -1.218 . . . . 0.0 109.811 179.728 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.41 ' H ' ' CB ' ' A' ' 107' ' ' GLN . . . 69.32 101.34 0.04 OUTLIER Glycine 0 CA--C 1.525 0.662 0 CA-C-N 115.954 -0.566 . . . . 0.0 113.179 -179.705 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.743 ' HB2' ' NE2' ' A' ' 107' ' ' GLN . 0.0 OUTLIER -159.71 -144.34 0.11 Allowed 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 110.256 -0.275 . . . . 0.0 110.256 179.096 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.587 ' H ' HD12 ' A' ' 42' ' ' LEU . 0.2 OUTLIER -162.19 21.95 0.1 Allowed 'General case' 0 CA--C 1.529 0.145 0 O-C-N 121.832 -0.543 . . . . 0.0 112.088 -179.515 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.655 ' HA ' ' HB3' ' A' ' 48' ' ' ALA . 1.8 mp 66.44 4.45 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 179.512 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.62 -57.15 3.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.902 0.382 . . . . 0.0 111.184 -179.799 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.0 p -61.63 -59.6 4.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.989 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -179.78 76.81 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.327 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.677 ' HB1' ' OE2' ' A' ' 52' ' ' GLU . . . -138.4 -158.61 0.87 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.552 0.215 . . . . 0.0 111.151 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.415 ' O ' ' OE2' ' A' ' 52' ' ' GLU . 9.6 mtm180 -140.5 -174.54 3.99 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 120.874 0.369 . . . . 0.0 111.253 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.764 ' O ' HG23 ' A' ' 54' ' ' VAL . 21.7 tt0 -85.29 -30.83 23.44 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.979 0.418 . . . . 0.0 111.212 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' SER . . . . . 0.592 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 0.3 OUTLIER -59.14 -65.31 0.69 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.842 -179.999 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.677 ' OE2' ' HB1' ' A' ' 48' ' ' ALA . 0.1 OUTLIER -35.59 -65.38 0.25 Allowed 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.662 179.947 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.502 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -51.08 -52.31 44.75 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.522 179.822 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.764 HG23 ' O ' ' A' ' 50' ' ' GLU . 94.6 t -55.91 -35.35 40.18 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 CA-C-O 121.007 0.432 . . . . 0.0 109.941 179.104 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.675 ' O ' HG12 ' A' ' 59' ' ' VAL . 0.2 OUTLIER -70.86 -45.23 64.81 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.409 179.299 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.567 ' HB2' ' HB2' ' A' ' 108' ' ' MET . . . -61.77 -46.93 87.44 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.39 179.48 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 -62.82 -44.04 97.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.648 179.618 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.505 ' OG1' HD13 ' A' ' 27' ' ' LEU . 16.7 p -64.53 -56.54 13.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.933 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 1.082 HG23 HD12 ' A' ' 117' ' ' LEU . 12.3 p -60.4 -44.18 95.55 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.59 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.808 HD13 HD23 ' A' ' 103' ' ' LEU . 4.7 tp -55.96 -42.77 76.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.903 0.383 . . . . 0.0 110.226 179.293 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 62.7 m -61.83 -58.77 6.68 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.832 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 10.8 m-70 -55.16 -32.74 62.38 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.136 0.493 . . . . 0.0 110.312 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 1.09 HG13 HG11 ' A' ' 66' ' ' VAL . 3.6 t -100.26 59.2 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.282 179.393 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.492 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . -83.4 34.67 0.48 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.61 -179.509 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.522 ' HA ' HG22 ' A' ' 99' ' ' VAL . 7.4 t-20 153.82 -61.78 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 122.855 0.462 . . . . 0.0 110.379 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 1.09 HG11 HG13 ' A' ' 63' ' ' VAL . 18.8 m 40.77 -163.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 1.006 HG22 ' HB2' ' A' ' 123' ' ' GLN . 29.3 m -148.44 75.23 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.437 -1.112 0 CA-C-O 120.939 0.399 . . . . 0.0 111.131 -178.777 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.929 ' CD2' HD11 ' A' ' 76' ' ' LEU . 0.3 OUTLIER -65.0 98.73 0.31 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.874 -179.849 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.832 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 1.4 p -66.92 -172.3 0.18 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.61 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.72 -34.62 12.41 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 120.97 0.414 . . . . 0.0 110.702 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.591 ' O ' ' HE2' ' A' ' 75' ' ' LYS . 0.1 OUTLIER -72.28 -65.72 0.74 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.41 179.776 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.866 ' O ' HD12 ' A' ' 76' ' ' LEU . 0.6 OUTLIER -52.84 -33.98 51.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.45 179.583 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.787 HG23 ' O ' ' A' ' 68' ' ' LEU . 11.7 p -62.55 -55.87 23.25 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 178.02 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.67 -24.39 61.15 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 108.609 -0.885 . . . . 0.0 108.609 177.065 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 1.087 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -62.52 -65.2 0.72 Allowed 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.733 -1.122 . . . . 0.0 109.981 178.716 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.929 HD11 ' CD2' ' A' ' 68' ' ' LEU . 4.3 mp -50.73 -39.94 53.09 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 178.464 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.86 -64.17 0.92 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.706 178.875 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -58.52 -52.39 65.84 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.832 -179.438 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' SER . . . . . 0.486 ' CB ' ' HG2' ' A' ' 111' ' ' GLN . 1.3 t -53.83 -27.65 30.96 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.485 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 89.0 m . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.321 -179.326 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ASN . . . . . 0.515 ' HA ' ' HB2' ' A' ' 104' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.079 0 CA-C-O 120.394 0.14 . . . . 0.0 111.187 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.511 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 5.0 m-85 -92.4 138.43 31.52 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 120.257 -0.577 . . . . 0.0 111.026 -179.623 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.788 ' CG ' HG13 ' A' ' 101' ' ' VAL . 1.2 t0 -120.23 148.01 44.22 Favored 'General case' 0 N--CA 1.436 -1.129 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -179.129 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.768 HD12 ' N ' ' A' ' 90' ' ' LEU . 0.0 OUTLIER -147.72 165.44 30.49 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -177.966 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.594 ' O ' ' CB ' ' A' ' 98' ' ' SER . 10.9 ttm105 -137.4 158.72 43.8 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 114.414 -1.266 . . . . 0.0 108.869 178.705 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.794 ' O ' HG13 ' A' ' 93' ' ' VAL . 56.8 p -104.42 159.35 15.8 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.714 0.769 . . . . 0.0 112.567 -179.013 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.794 HG13 ' O ' ' A' ' 92' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.44 -0.948 0 CA-C-N 113.931 -1.486 . . . . 0.0 108.17 -179.057 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.832 ' HA ' ' HA ' ' A' ' 69' ' ' THR . 0.8 OUTLIER . . . . . 0 N--CA 1.45 -0.429 0 N-CA-C 109.959 -0.386 . . . . 0.0 109.959 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.594 ' CB ' ' O ' ' A' ' 91' ' ' ARG . 0.2 OUTLIER -140.79 164.53 29.97 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.493 0.663 . . . . 0.0 110.878 179.663 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.522 HG22 ' HA ' ' A' ' 65' ' ' ASN . 0.5 OUTLIER -104.2 145.61 12.73 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.328 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.713 HD13 ' CD1' ' A' ' 116' ' ' LEU . 0.3 OUTLIER -103.55 104.88 15.0 Favored 'General case' 0 CA--C 1.507 -0.695 0 C-N-CA 119.431 -0.908 . . . . 0.0 112.557 -179.131 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.788 HG13 ' CG ' ' A' ' 89' ' ' ASP . 1.3 p -116.35 103.24 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.186 0 N-CA-C 103.256 -2.868 . . . . 0.0 103.256 173.896 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' SER . . . . . 0.638 ' O ' HD23 ' A' ' 103' ' ' LEU . 0.1 OUTLIER -144.85 163.6 33.59 Favored 'General case' 0 C--N 1.303 -1.452 0 C-N-CA 119.131 -1.028 . . . . 0.0 112.597 -174.613 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.808 HD23 HD13 ' A' ' 60' ' ' LEU . 0.1 OUTLIER 159.45 -82.3 0.0 OUTLIER 'General case' 0 N--CA 1.435 -1.197 0 CA-C-N 113.801 -1.545 . . . . 0.0 111.39 176.967 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.569 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 46.28 32.98 1.65 Allowed 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.999 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.659 ' HB3' ' N ' ' A' ' 42' ' ' LEU . 52.7 m 129.55 162.96 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.674 1.19 . . . . 0.0 108.104 -178.021 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.412 ' HB3' ' HB3' ' A' ' 53' ' ' LYS . 0.7 OUTLIER -104.84 102.11 11.67 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 119.838 -0.745 . . . . 0.0 112.394 -178.865 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.743 ' NE2' ' HB2' ' A' ' 42' ' ' LEU . 1.3 mt-30 -168.29 127.98 1.24 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.397 177.698 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.567 ' HB2' ' HB2' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -130.85 143.29 50.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.353 0.597 . . . . 0.0 112.324 -179.575 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 109' ' ' THR . . . . . 0.867 HG23 ' O ' ' A' ' 39' ' ' PHE . 0.3 OUTLIER -104.55 165.12 11.27 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.432 179.378 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.957 HD23 HG23 ' A' ' 12' ' ' VAL . 0.3 OUTLIER -53.75 -59.53 4.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.779 0.323 . . . . 0.0 110.673 179.983 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 111' ' ' GLN . . . . . 0.867 ' O ' HG23 ' A' ' 115' ' ' VAL . 1.7 tp-100 -49.26 -59.57 3.57 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 121.1 0.476 . . . . 0.0 110.986 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 0.878 ' O ' HD22 ' A' ' 116' ' ' LEU . 1.3 m-20 -50.68 -47.47 58.86 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.139 0.495 . . . . 0.0 110.59 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 0.599 ' HB1' ' CE1' ' A' ' 55' ' ' PHE . . . -49.94 -60.04 3.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.692 179.426 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.663 ' NZ ' HG22 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -66.13 -21.5 66.34 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.153 179.87 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 1.087 HG22 ' CG ' ' A' ' 75' ' ' LYS . 46.0 t -62.62 -61.64 1.55 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.82 0 CA-C-O 121.876 0.846 . . . . 0.0 109.839 179.521 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.9 ' CB ' HG21 ' A' ' 63' ' ' VAL . 0.0 OUTLIER -63.99 -39.8 94.94 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 114.8 -1.091 . . . . 0.0 109.879 179.837 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 1.082 HD12 HG23 ' A' ' 59' ' ' VAL . 0.2 OUTLIER -71.06 -18.63 62.55 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.946 179.86 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.563 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 2.7 tt0 -71.99 -54.09 10.98 Favored 'General case' 0 N--CA 1.441 -0.923 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 176.815 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -71.33 -22.56 61.91 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 114.679 -1.146 . . . . 0.0 111.028 177.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.783 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -76.01 -54.42 6.89 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.214 179.754 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.598 HD22 ' CG ' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -63.71 -27.94 69.56 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.83 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.563 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -73.18 -43.7 61.01 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.917 -0.583 . . . . 0.0 112.064 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 1.006 ' HB2' HG22 ' A' ' 67' ' ' VAL . 1.5 tt0 -95.11 -25.79 16.29 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 113.496 0.924 . . . . 0.0 113.496 -178.169 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 124' ' ' GLU . . . . . 0.402 ' CG ' ' O ' ' A' ' 120' ' ' ALA . 2.5 mm-40 -85.24 -66.41 0.9 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 -177.551 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 4.7 p . . . . . 0 C--N 1.325 -0.473 0 CA-C-O 120.989 0.423 . . . . 0.0 112.079 -178.652 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' ASN . . . . . 0.408 ' HB3' ' CG2' ' A' ' 58' ' ' THR . 5.4 p30 . . . . . 0 CA--C 1.528 0.118 0 CA-C-O 120.732 0.301 . . . . 0.0 110.776 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 1.115 ' O ' HD22 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -138.57 103.11 4.78 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 121.221 0.534 . . . . 0.0 111.225 179.816 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.612 ' O ' ' O ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER 40.15 175.1 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.707 0.765 . . . . 0.0 112.853 179.679 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.739 HD22 ' HA ' ' A' ' 121' ' ' LEU . 0.3 OUTLIER -95.93 -65.84 0.95 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.718 179.308 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.418 ' HB2' HD13 ' A' ' 121' ' ' LEU . 1.0 OUTLIER -60.18 -33.05 71.67 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.677 -1.147 . . . . 0.0 111.706 -179.113 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ASP . . . . . 0.566 ' C ' HE21 ' A' ' 11' ' ' GLN . 69.9 m-20 -65.48 -50.49 65.13 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 178.706 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.888 HD23 HD11 ' A' ' 117' ' ' LEU . 22.3 tp -55.32 -44.58 75.95 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.887 179.252 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' HIS . . . . . 0.504 ' HB2' ' HB3' ' A' ' 117' ' ' LEU . 29.5 t-80 -64.82 -41.32 95.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.557 0.694 . . . . 0.0 110.0 179.238 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -57.91 -50.13 74.38 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.996 -179.34 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.671 ' HG3' ' CG1' ' A' ' 31' ' ' VAL . 0.7 OUTLIER -66.63 -56.67 9.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.487 -179.581 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.969 ' HA ' HD12 ' A' ' 15' ' ' LEU . 10.8 p -53.74 -48.32 61.17 Favored 'Isoleucine or valine' 0 C--O 1.242 0.704 0 CA-C-O 121.322 0.582 . . . . 0.0 111.142 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.679 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 62.7 m -62.52 -40.46 96.84 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.256 -179.798 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.466 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 1.2 tpm_? -64.69 -30.89 71.92 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.979 0.418 . . . . 0.0 110.095 -179.797 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.969 HD12 ' HA ' ' A' ' 12' ' ' VAL . 4.6 mt -71.33 -65.08 0.8 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.844 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.721 ' CG2' ' HB3' ' A' ' 110' ' ' LEU . 50.2 t -58.77 -45.95 91.02 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.403 0 C-N-CA 120.556 -0.458 . . . . 0.0 111.434 -179.003 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.45 ' CG ' ' O ' ' A' ' 13' ' ' SER . 6.1 mm-40 -62.7 -12.69 25.29 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.604 -178.9 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.466 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 3.6 pt20 -170.59 60.18 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.163 0 CA-C-O 120.786 0.326 . . . . 0.0 111.56 178.678 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.534 ' N ' ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER 177.79 -58.72 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 179.817 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.1 m -87.93 -79.63 0.29 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.853 0.359 . . . . 0.0 111.748 -178.729 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLY . . . . . 0.414 ' O ' ' CB ' ' A' ' 22' ' ' ASP . . . 107.64 54.11 0.65 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.726 -179.689 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.582 ' H ' HG13 ' A' ' 16' ' ' VAL . 0.0 OUTLIER 83.2 0.43 1.13 Allowed 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 179.338 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -60.73 -167.03 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 110.37 -0.233 . . . . 0.0 110.37 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.514 ' HA ' HG22 ' A' ' 109' ' ' THR . 12.7 m -104.47 138.31 41.05 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.528 ' CA ' ' HG ' ' A' ' 110' ' ' LEU . . . -114.57 156.24 15.79 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.209 -0.996 . . . . 0.0 113.236 -179.067 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.905 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -114.73 151.04 34.35 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.35 -0.241 . . . . 0.0 110.35 179.407 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.769 ' O ' HD23 ' A' ' 27' ' ' LEU . 5.9 tt -130.18 106.93 8.93 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.141 0.496 . . . . 0.0 112.037 -179.588 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.612 ' HG2' ' HD2' ' A' ' 26' ' ' LYS . 0.2 OUTLIER -134.33 52.28 2.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.584 -0.734 . . . . 0.0 109.253 178.457 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.413 ' O ' ' HG ' ' A' ' 3' ' ' LEU . . . 83.79 4.22 88.94 Favored Glycine 0 C--N 1.332 0.358 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 -176.774 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.453 ' O ' ' NZ ' ' A' ' 26' ' ' LYS . 0.2 OUTLIER -166.07 166.7 17.0 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 106.701 -1.592 . . . . 0.0 106.701 -179.512 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.847 HG13 HD11 ' A' ' 15' ' ' LEU . 11.3 p -113.54 137.96 44.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 C-N-CA 120.003 -0.679 . . . . 0.0 112.281 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.905 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -126.74 164.88 20.35 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.654 178.656 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -104.51 148.19 26.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.139 0.495 . . . . 0.0 111.623 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 42.2 t30 -135.97 117.52 14.85 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.301 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.14 3.33 9.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.4 -179.774 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -61.46 -53.08 61.14 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.951 0.405 . . . . 0.0 110.537 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.537 ' C ' HG22 ' A' ' 38' ' ' THR . 0.0 OUTLIER -128.04 -89.37 0.53 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.193 179.626 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.596 ' O ' ' HB3' ' A' ' 39' ' ' PHE . 0.1 OUTLIER 166.01 -105.45 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 110.259 -0.275 . . . . 0.0 110.259 179.457 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.7 ' CD1' HG23 ' A' ' 109' ' ' THR . 0.1 OUTLIER 169.25 -164.46 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 179.63 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.565 ' HB3' ' O ' ' A' ' 39' ' ' PHE . 0.1 OUTLIER 150.86 55.44 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.371 0.669 . . . . 0.0 110.441 179.833 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.559 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . 67.1 -65.39 0.21 Allowed Glycine 0 CA--C 1.523 0.578 0 C-N-CA 120.995 -0.621 . . . . 0.0 112.616 -179.379 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.804 ' O ' ' HB3' ' A' ' 105' ' ' SER . 0.4 OUTLIER 24.28 -138.83 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.203 0.601 . . . . 0.0 112.58 179.444 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.521 HG23 ' O ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -172.64 22.43 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 O-C-N 121.849 -0.532 . . . . 0.0 112.065 -179.934 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.709 HD12 ' N ' ' A' ' 44' ' ' ILE . 1.3 mp 63.37 2.42 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 120.822 0.344 . . . . 0.0 111.687 179.561 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.93 -22.15 25.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.839 0.352 . . . . 0.0 111.003 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.45 ' CB ' HD21 ' A' ' 42' ' ' LEU . 0.3 OUTLIER -101.8 -30.91 11.01 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.397 -179.705 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 177.94 -30.03 0.07 OUTLIER Glycine 0 CA--C 1.519 0.342 0 C-N-CA 120.169 -1.015 . . . . 0.0 113.556 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.718 ' HB2' ' NE2' ' A' ' 107' ' ' GLN . . . -48.32 173.46 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 117.1 0.45 . . . . 0.0 111.488 -179.584 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.438 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 23.0 mtp85 -121.89 173.24 7.63 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.527 -179.592 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.87 ' O ' HG22 ' A' ' 54' ' ' VAL . 0.8 OUTLIER -66.81 -29.97 70.05 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.115 0.483 . . . . 0.0 110.54 179.762 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 51' ' ' SER . . . . . 0.536 ' CB ' ' CB ' ' A' ' 26' ' ' LYS . 0.3 OUTLIER -49.75 -65.18 0.61 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.461 179.548 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.505 ' HB2' ' HG2' ' A' ' 107' ' ' GLN . 0.2 OUTLIER -52.56 -62.21 1.79 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.264 -179.15 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.593 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -46.68 -59.14 3.22 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 -178.563 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.87 HG22 ' O ' ' A' ' 50' ' ' GLU . 15.9 m -51.91 -47.36 41.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.46 0 CA-C-O 120.887 0.375 . . . . 0.0 110.732 -179.783 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.567 ' HE2' HG23 ' A' ' 31' ' ' VAL . 0.1 OUTLIER -57.29 -46.68 82.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.553 179.156 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.691 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -54.69 -50.99 66.94 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-O 120.85 0.357 . . . . 0.0 110.681 179.52 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -57.92 -40.24 79.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.4 179.599 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.47 HG22 ' CD2' ' A' ' 62' ' ' HIS . 0.9 OUTLIER -67.28 -63.98 0.95 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.978 179.791 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.919 ' O ' HG22 ' A' ' 63' ' ' VAL . 14.4 p -53.36 -40.88 42.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.793 0.33 . . . . 0.0 110.342 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.852 HD13 ' CD2' ' A' ' 103' ' ' LEU . 0.5 OUTLIER -64.09 -38.8 92.37 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.758 179.464 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 61.3 m -72.69 -44.86 61.23 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.167 179.688 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' HIS . . . . . 0.47 ' CD2' HG22 ' A' ' 58' ' ' THR . 53.3 m-70 -51.72 -54.4 28.74 Favored 'General case' 0 CA--C 1.521 -0.163 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.126 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 1.041 HG12 HG11 ' A' ' 66' ' ' VAL . 0.0 OUTLIER -54.11 -78.8 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.806 179.266 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.61 ' H ' HG23 ' A' ' 63' ' ' VAL . . . 60.96 17.0 7.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.354 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.557 ' O ' HG22 ' A' ' 66' ' ' VAL . 1.3 m-20 153.1 -68.22 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 122.765 0.426 . . . . 0.0 110.943 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 1.041 HG11 HG12 ' A' ' 63' ' ' VAL . 23.1 m 49.01 -164.95 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.054 -179.473 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.813 ' HB ' ' HB3' ' A' ' 97' ' ' ASN . 15.8 m -152.26 50.26 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.169 0 CA-C-O 121.129 0.49 . . . . 0.0 110.842 -178.52 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.886 HD22 ' CD1' ' A' ' 76' ' ' LEU . 1.0 OUTLIER -43.33 103.93 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.343 -179.485 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.403 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 15.7 p -71.67 -164.82 0.13 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.773 178.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.1 -34.91 68.8 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.912 0.386 . . . . 0.0 110.808 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -70.69 -50.07 40.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.076 0.465 . . . . 0.0 110.434 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.833 ' HB3' HD23 ' A' ' 68' ' ' LEU . 66.7 m-20 -66.71 -36.25 82.05 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.641 179.774 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 38.8 m -65.87 -40.78 91.94 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.05 0.452 . . . . 0.0 109.812 178.928 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.13 -27.11 62.41 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 177.543 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 1.035 ' HG3' HG12 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -57.1 -59.72 4.67 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 114.044 -1.434 . . . . 0.0 109.642 178.228 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.907 HD21 HD21 ' A' ' 100' ' ' LEU . 3.2 mp -61.65 -49.89 74.71 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 178.707 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -44.07 -58.45 2.82 Favored 'General case' 0 CA--C 1.523 -0.086 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.263 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -61.07 -44.42 97.4 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.401 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -62.1 -22.44 65.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.96 179.649 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.278 -179.66 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ASN . . . . . 0.564 HD21 ' N ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER . . . . . 0 C--O 1.235 0.337 0 CA-C-O 120.635 0.255 . . . . 0.0 111.302 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.429 ' OH ' ' HG3' ' A' ' 108' ' ' MET . 24.8 m-85 -98.43 139.45 34.15 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 120.841 0.353 . . . . 0.0 110.376 179.545 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.686 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.4 OUTLIER -112.87 144.74 41.91 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 179.301 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.73 HD21 HD22 ' A' ' 100' ' ' LEU . 14.7 mt -137.62 132.46 33.05 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 114.618 1.34 . . . . 0.0 114.618 -176.399 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.558 ' HB3' ' HB ' ' A' ' 99' ' ' VAL . 4.1 ttp180 -104.78 165.48 11.04 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 105.291 -2.114 . . . . 0.0 105.291 175.137 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.608 ' HA ' ' HA ' ' A' ' 98' ' ' SER . 9.7 p -134.33 164.15 28.05 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 116.235 1.939 . . . . 0.0 116.235 -177.258 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.676 ' C ' ' O ' ' A' ' 97' ' ' ASN . 1.5 t . . . . . 0 C--O 1.237 0.429 0 CA-C-N 111.5 -2.591 . . . . 0.0 107.142 178.148 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.813 ' HB3' ' HB ' ' A' ' 67' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.433 -1.325 0 CA-C-O 121.842 0.83 . . . . 0.0 113.019 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.624 ' CA ' HG23 ' A' ' 93' ' ' VAL . 1.6 m -152.92 149.91 28.72 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 114.434 -1.257 . . . . 0.0 107.758 178.699 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.558 ' HB ' ' HB3' ' A' ' 91' ' ' ARG . 38.9 t -104.07 156.1 5.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 C-N-CA 120.634 -0.427 . . . . 0.0 111.787 -177.259 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.907 HD21 HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -109.2 128.14 54.8 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -177.899 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.686 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 17.7 t -141.3 104.31 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.929 0 N-CA-C 104.712 -2.329 . . . . 0.0 104.712 174.935 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' SER . . . . . 0.53 ' O ' HD23 ' A' ' 103' ' ' LEU . 0.1 OUTLIER -145.78 165.23 29.45 Favored 'General case' 0 C--N 1.311 -1.082 0 C-N-CA 118.495 -1.282 . . . . 0.0 113.788 -174.909 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.852 ' CD2' HD13 ' A' ' 60' ' ' LEU . 0.0 OUTLIER 154.51 -89.36 0.0 OUTLIER 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 113.456 -1.702 . . . . 0.0 111.358 176.896 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.533 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 59.07 21.33 9.26 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 -179.52 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.804 ' HB3' ' O ' ' A' ' 42' ' ' LEU . 5.4 m 140.92 173.26 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.432 1.093 . . . . 0.0 108.612 -178.767 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.81 102.22 11.78 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 119.986 -0.685 . . . . 0.0 112.545 -178.834 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.718 ' NE2' ' HB2' ' A' ' 48' ' ' ALA . 2.2 tt0 -168.15 165.06 13.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.4 177.621 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.744 ' CE ' ' HB2' ' A' ' 113' ' ' ALA . 2.1 ttp -165.75 147.45 7.2 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.062 0.458 . . . . 0.0 111.916 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' THR . . . . . 0.7 HG23 ' CD1' ' A' ' 39' ' ' PHE . 0.6 OUTLIER -114.7 161.38 18.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.794 178.867 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.721 ' HB3' ' CG2' ' A' ' 16' ' ' VAL . 18.2 mt -50.35 -59.22 4.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.89 0.376 . . . . 0.0 110.61 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' GLN . . . . . 0.904 ' O ' HG13 ' A' ' 115' ' ' VAL . 2.9 tp-100 -45.13 -64.63 0.67 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.935 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 0.855 ' O ' HG22 ' A' ' 115' ' ' VAL . 0.4 OUTLIER -51.31 -38.14 51.4 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-O 121.526 0.679 . . . . 0.0 110.405 179.516 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 0.744 ' HB2' ' CE ' ' A' ' 108' ' ' MET . . . -55.05 -52.36 63.44 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.116 179.672 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.796 ' HZ2' HG22 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -79.63 -20.57 46.47 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.824 -178.866 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 1.035 HG12 ' HG3' ' A' ' 75' ' ' LYS . 9.0 m -65.17 -50.63 72.94 Favored 'Isoleucine or valine' 0 C--O 1.244 0.767 0 CA-C-O 122.129 0.966 . . . . 0.0 109.243 179.173 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.943 HD12 HG23 ' A' ' 115' ' ' VAL . 7.5 mp -69.31 -45.67 68.98 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 114.298 -1.319 . . . . 0.0 109.548 178.915 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.888 HD11 HD23 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -68.89 -15.2 63.43 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.805 179.328 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.648 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 8.6 tp10 -74.03 -51.74 14.91 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 106.295 -1.742 . . . . 0.0 106.295 177.101 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.497 ' HB2' ' OD2' ' A' ' 72' ' ' ASP . . . -72.34 -28.8 63.27 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.572 177.973 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.778 ' HA ' HG12 ' A' ' 66' ' ' VAL . . . -69.27 -55.16 11.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.98 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.739 ' HA ' HD22 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -64.24 -48.93 73.92 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.262 -179.73 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.648 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -59.28 -39.88 84.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.906 -179.833 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.584 ' HG3' HG13 ' A' ' 67' ' ' VAL . 12.0 tm0? -84.84 -34.04 22.74 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -178.381 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -96.48 -68.4 0.8 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -177.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.22 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -178.219 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' ASN . . . . . 0.512 ' HA ' HD21 ' A' ' 27' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.465 0.309 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.494 HD11 ' CA ' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -159.69 -46.37 0.05 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.831 0.348 . . . . 0.0 110.983 -179.752 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 169.59 138.65 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.423 -179.855 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 1.07 HD21 ' HB1' ' A' ' 120' ' ' ALA . 0.0 OUTLIER -55.97 -65.46 0.6 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.739 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p -49.98 -42.8 49.72 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.092 0.405 . . . . 0.0 112.092 -179.025 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ASP . . . . . 0.422 ' O ' ' NE2' ' A' ' 11' ' ' GLN . 1.4 m-20 -73.42 -60.51 2.21 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 121.116 0.484 . . . . 0.0 110.009 179.724 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.932 HD23 HD11 ' A' ' 117' ' ' LEU . 12.4 tp -47.0 -44.18 20.03 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.394 179.157 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' HIS . . . . . 0.734 ' CG ' HD22 ' A' ' 121' ' ' LEU . 38.4 t-80 -65.26 -44.84 86.8 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.644 0.735 . . . . 0.0 109.35 178.477 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.8 mmt85 -54.78 -54.67 39.08 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.772 -1.104 . . . . 0.0 111.584 -179.383 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.627 ' HG3' HG22 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -65.95 -48.14 72.32 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 120.951 -0.3 . . . . 0.0 111.757 -179.274 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.035 HG23 HD23 ' A' ' 110' ' ' LEU . 9.6 p -63.52 -49.6 81.89 Favored 'Isoleucine or valine' 0 C--O 1.243 0.725 0 CA-C-O 121.056 0.455 . . . . 0.0 111.266 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.654 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 72.8 m -56.41 -57.88 10.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.38 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.456 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 30.8 ttm180 -59.69 -35.47 74.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.149 0.5 . . . . 0.0 110.628 -179.645 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.573 ' CD1' HG23 ' A' ' 31' ' ' VAL . 10.6 mt -56.92 -65.33 0.63 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.866 -0.606 . . . . 0.0 112.155 -179.487 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.635 HG22 ' HB3' ' A' ' 20' ' ' SER . 1.4 t -70.93 -26.44 27.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 C-N-CA 120.276 -0.57 . . . . 0.0 110.724 -179.429 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.47 ' CG ' ' O ' ' A' ' 13' ' ' SER . 8.1 mm-40 -72.83 -21.87 60.89 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.367 179.596 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.456 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 11.7 pt20 -161.66 60.85 0.26 Allowed 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.767 0.317 . . . . 0.0 111.189 179.323 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 176.39 -61.62 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.778 179.64 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.652 ' OG ' ' HB1' ' A' ' 33' ' ' ALA . 0.4 OUTLIER -78.43 -81.28 0.1 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.78 0.324 . . . . 0.0 111.647 -179.229 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 106.06 60.32 0.61 Allowed Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.327 -179.519 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.8 t70 68.76 28.4 5.53 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.783 0.325 . . . . 0.0 111.142 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -91.02 -162.92 0.96 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.369 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.691 HG23 HG22 ' A' ' 109' ' ' THR . 0.0 OUTLIER -103.96 165.24 11.17 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 179.579 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.521 ' HA2' ' O ' ' A' ' 32' ' ' ALA . . . -133.67 153.02 20.67 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.013 -1.089 . . . . 0.0 113.276 -179.182 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.736 ' HG3' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -116.9 131.38 56.97 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 179.491 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.512 HD21 ' HA ' ' A' ' 2' ' ' ASN . 1.9 tt -105.93 146.75 29.6 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.168 0.509 . . . . 0.0 111.777 -179.526 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.584 ' NH2' HG11 ' A' ' 54' ' ' VAL . 0.0 OUTLIER 171.31 53.94 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.032 -179.935 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 86.27 -0.65 87.34 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 110.261 -1.135 . . . . 0.0 110.261 -177.287 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -165.95 165.49 18.05 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 179.683 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.627 HG22 ' HG3' ' A' ' 11' ' ' GLN . 0.9 OUTLIER -121.02 116.62 50.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 C-N-CA 120.151 -0.62 . . . . 0.0 111.351 179.794 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.736 ' HB3' ' HG3' ' A' ' 26' ' ' LYS . . . -104.74 166.99 10.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.596 -179.694 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.652 ' HB1' ' OG ' ' A' ' 20' ' ' SER . . . -102.8 138.42 39.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.345 0.593 . . . . 0.0 111.872 -178.778 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 17.5 t30 -118.98 118.08 30.52 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.487 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.74 -29.79 5.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.226 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -59.38 -44.33 92.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.924 0.392 . . . . 0.0 110.911 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 30.6 p -121.33 -174.86 2.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.711 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 45.3 p -124.0 -115.64 0.29 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.14 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.56 ' CG ' ' N ' ' A' ' 40' ' ' GLN . 0.4 OUTLIER -171.47 -84.81 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.529 179.712 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.56 ' N ' ' CG ' ' A' ' 39' ' ' PHE . 0.1 OUTLIER 80.74 32.26 0.15 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 122.726 0.41 . . . . 0.0 112.001 179.872 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.512 ' CA ' ' HB3' ' A' ' 105' ' ' SER . . . 71.55 -20.11 0.83 Allowed Glycine 0 CA--C 1.526 0.746 0 C-N-CA 121.286 -0.483 . . . . 0.0 113.447 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.902 HD11 ' HB2' ' A' ' 46' ' ' SER . 7.0 tp -25.95 140.33 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.292 0.637 . . . . 0.0 112.635 179.175 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -99.15 30.47 3.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.392 -179.799 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.624 HD11 ' HD2' ' A' ' 53' ' ' LYS . 1.2 mp 67.5 3.24 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 179.79 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.71 -27.97 23.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.692 0.282 . . . . 0.0 111.475 -179.549 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.902 ' HB2' HD11 ' A' ' 42' ' ' LEU . 0.3 OUTLIER -91.32 -36.21 13.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.511 -179.632 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 156.13 48.49 0.01 OUTLIER Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.368 -0.92 . . . . 0.0 113.163 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.721 ' HB1' HE21 ' A' ' 107' ' ' GLN . . . -119.15 -172.46 2.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.851 0.358 . . . . 0.0 110.749 179.566 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -119.69 129.32 54.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.132 179.268 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.917 ' O ' HG22 ' A' ' 54' ' ' VAL . 2.6 mt-10 -43.42 -30.06 0.51 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.96 0.41 . . . . 0.0 111.043 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' SER . . . . . 0.648 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -51.32 -59.92 3.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.303 179.769 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.618 ' CB ' ' HG2' ' A' ' 107' ' ' GLN . 3.3 mm-40 -53.57 -40.07 65.31 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.348 0.594 . . . . 0.0 109.886 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.624 ' HD2' HD11 ' A' ' 44' ' ' ILE . 0.1 OUTLIER -62.79 -65.49 0.68 Allowed 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.941 179.254 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.94 ' O ' HG23 ' A' ' 58' ' ' THR . 0.5 OUTLIER -51.37 -40.65 24.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 CA-C-O 120.862 0.363 . . . . 0.0 110.319 179.919 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.583 ' CZ ' ' HB1' ' A' ' 113' ' ' ALA . 0.8 OUTLIER -56.76 -44.86 82.2 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 178.586 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.716 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -56.61 -60.21 3.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.145 0.498 . . . . 0.0 109.794 178.56 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.452 ' O ' ' CB ' ' A' ' 61' ' ' SER . 2.0 mm-40 -46.95 -37.38 8.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.323 179.547 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.94 HG23 ' O ' ' A' ' 54' ' ' VAL . 26.3 p -66.87 -50.78 61.41 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.608 -179.423 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 1.007 ' CG1' HD12 ' A' ' 117' ' ' LEU . 0.1 OUTLIER -62.2 -46.33 96.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 120.187 -0.605 . . . . 0.0 112.349 -179.065 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.664 HD11 HD21 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -73.86 -28.48 61.6 Favored 'General case' 0 CA--C 1.515 -0.404 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.412 -179.313 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.452 ' CB ' ' O ' ' A' ' 57' ' ' GLN . 7.0 t -65.26 -54.58 27.22 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.019 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' HIS . . . . . 0.49 ' HB3' ' CD2' ' A' ' 5' ' ' LEU . 1.5 m170 -69.06 -20.86 64.11 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 177.894 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 1.07 HG22 ' HB2' ' A' ' 120' ' ' ALA . 94.3 t -110.73 60.19 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.039 178.833 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.408 ' O ' ' ND2' ' A' ' 65' ' ' ASN . . . -80.77 21.94 0.63 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.137 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.408 ' ND2' ' O ' ' A' ' 64' ' ' ALA . 0.4 OUTLIER 164.95 -53.08 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.908 0.385 . . . . 0.0 110.387 -179.55 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.94 ' CG1' HG13 ' A' ' 63' ' ' VAL . 27.2 m 43.49 -134.87 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.895 179.727 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.526 ' O ' ' O ' ' A' ' 98' ' ' SER . 3.5 p -156.4 -31.74 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 C-N-CA 120.586 -0.446 . . . . 0.0 111.835 -179.836 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 1.077 HD22 HD11 ' A' ' 76' ' ' LEU . 1.1 mt 37.84 98.73 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.434 -0.803 . . . . 0.0 113.052 178.914 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 33.9 p -73.46 -179.0 3.26 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.236 -0.654 . . . . 0.0 109.236 178.169 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.49 -34.09 3.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.998 0.428 . . . . 0.0 110.964 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -64.92 -63.06 1.2 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.929 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.92 ' O ' HD12 ' A' ' 76' ' ' LEU . 0.6 OUTLIER -55.86 -39.3 71.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.761 -179.899 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.67 -59.84 4.29 Favored 'General case' 0 C--O 1.241 0.625 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.794 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.507 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . . . -56.9 -28.86 62.43 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 177.579 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 1.083 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -60.91 -54.82 40.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.651 -1.159 . . . . 0.0 110.412 179.057 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 1.077 HD11 HD22 ' A' ' 68' ' ' LEU . 4.0 mp -60.71 -54.09 49.46 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.674 179.651 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.631 HD12 ' N ' ' A' ' 78' ' ' GLN . 3.7 pp -57.88 -29.2 64.85 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 120.462 -0.495 . . . . 0.0 110.583 -179.738 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.631 ' N ' HD12 ' A' ' 77' ' ' LEU . 44.4 tt0 -66.26 -59.41 3.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.985 0.421 . . . . 0.0 110.215 179.063 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 84.1 p -57.91 -28.25 64.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.799 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 4.3 m . . . . . 0 C--N 1.331 -0.238 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.284 -179.964 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 30.6 p30 . . . . . 0 C--O 1.236 0.346 0 CA-C-O 120.718 0.294 . . . . 0.0 111.556 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.515 ' CG ' ' HB3' ' A' ' 102' ' ' SER . 0.9 OUTLIER -99.06 141.75 31.42 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.226 -179.499 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.664 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.0 OUTLIER -113.42 139.55 48.82 Favored 'General case' 0 N--CA 1.436 -1.157 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 179.945 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.682 HD11 ' CB ' ' A' ' 76' ' ' LEU . 22.8 mt -137.37 147.18 45.31 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 112.909 0.707 . . . . 0.0 112.909 -177.583 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.439 ' O ' ' CB ' ' A' ' 98' ' ' SER . 25.9 mtm180 -125.32 142.69 51.35 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 177.797 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.534 ' O ' HG13 ' A' ' 93' ' ' VAL . 4.0 p -105.3 139.13 40.41 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 113.49 0.922 . . . . 0.0 113.49 -178.567 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.534 HG13 ' O ' ' A' ' 92' ' ' SER . 20.5 m . . . . . 0 N--CA 1.444 -0.774 0 CA-C-N 113.674 -1.603 . . . . 0.0 107.641 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.45 ' HB3' ' O ' ' A' ' 67' ' ' VAL . 0.1 OUTLIER . . . . . 0 C--O 1.226 -0.17 0 N-CA-C 110.545 -0.168 . . . . 0.0 110.545 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.526 ' O ' ' O ' ' A' ' 67' ' ' VAL . 0.9 OUTLIER -135.78 165.43 25.62 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.523 0.678 . . . . 0.0 111.384 -179.895 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.415 ' N ' ' O ' ' A' ' 91' ' ' ARG . 0.6 OUTLIER -103.52 148.92 7.88 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.227 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.903 ' HB2' HD11 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -103.72 108.34 19.59 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 -177.699 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.664 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -127.04 106.18 15.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 N-CA-C 104.735 -2.32 . . . . 0.0 104.735 175.378 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 102' ' ' SER . . . . . 0.569 ' OG ' ' N ' ' A' ' 89' ' ' ASP . 37.2 m -151.49 164.66 36.3 Favored 'General case' 0 C--N 1.309 -1.184 0 C-N-CA 117.922 -1.511 . . . . 0.0 114.776 -174.57 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.664 HD21 HD11 ' A' ' 60' ' ' LEU . 0.0 OUTLIER 157.16 -90.92 0.0 OUTLIER 'General case' 0 N--CA 1.435 -1.2 0 CA-C-N 112.877 -1.965 . . . . 0.0 111.745 175.635 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.665 ' O ' ' HB2' ' A' ' 105' ' ' SER . 0.0 OUTLIER 60.74 12.36 3.69 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 120.692 -0.403 . . . . 0.0 109.97 -179.218 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.665 ' HB2' ' O ' ' A' ' 104' ' ' ARG . 0.3 OUTLIER 157.94 162.25 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 -178.948 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.572 ' HB3' ' HG3' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -107.3 101.03 10.44 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 119.482 -0.887 . . . . 0.0 112.793 -179.08 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.721 HE21 ' HB1' ' A' ' 48' ' ' ALA . 2.2 tt0 -169.12 164.33 11.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.714 177.033 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.496 ' HB2' ' HB2' ' A' ' 56' ' ' ALA . 0.7 OUTLIER -165.16 147.88 8.1 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 179.68 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 109' ' ' THR . . . . . 0.691 HG22 HG23 ' A' ' 24' ' ' THR . 2.3 p -107.92 165.22 11.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.751 179.04 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 1.035 HD23 HG23 ' A' ' 12' ' ' VAL . 2.6 mt -56.21 -53.2 59.93 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.716 -0.393 . . . . 0.0 110.18 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 111' ' ' GLN . . . . . 0.874 ' O ' HG23 ' A' ' 115' ' ' VAL . 1.1 tp60 -49.22 -65.57 0.54 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.985 0.422 . . . . 0.0 110.089 179.431 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 0.889 ' O ' HD22 ' A' ' 116' ' ' LEU . 0.6 OUTLIER -48.71 -43.34 37.2 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.883 179.201 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 0.712 ' HB3' HG21 ' A' ' 12' ' ' VAL . . . -52.51 -62.7 1.47 Allowed 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.928 179.361 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.654 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -62.65 -26.98 68.91 Favored 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.75 179.975 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 1.083 HG22 ' CG ' ' A' ' 75' ' ' LYS . 59.1 t -56.89 -65.3 0.41 Allowed 'Isoleucine or valine' 0 C--O 1.248 0.99 0 CA-C-O 122.252 1.025 . . . . 0.0 110.495 179.101 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.889 HD22 ' O ' ' A' ' 112' ' ' ASP . 0.0 OUTLIER -60.33 -41.43 93.53 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 114.554 -1.203 . . . . 0.0 109.349 -179.7 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 1.035 HD23 HD13 ' A' ' 5' ' ' LEU . 0.2 OUTLIER -67.41 -18.39 65.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.001 179.169 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.654 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 0.9 OUTLIER -73.23 -44.59 59.29 Favored 'General case' 0 CA--C 1.503 -0.845 0 N-CA-C 106.721 -1.585 . . . . 0.0 106.721 177.968 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.509 ' HB1' ' H ' ' A' ' 68' ' ' LEU . . . -78.04 -28.6 49.05 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.106 177.88 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 1.07 ' HB1' HD21 ' A' ' 5' ' ' LEU . . . -69.37 -53.99 16.75 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.46 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.734 HD22 ' CG ' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -65.08 -44.47 88.79 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.765 179.869 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.654 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -56.62 -46.2 81.07 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.638 179.819 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.401 ' N ' ' HG2' ' A' ' 122' ' ' ARG . 19.9 mm100 -86.96 -28.94 22.41 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -177.846 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 124' ' ' GLU . . . . . 0.462 ' CG ' ' O ' ' A' ' 120' ' ' ALA . 0.5 OUTLIER -96.04 -67.03 0.87 Allowed 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 113.761 1.023 . . . . 0.0 113.761 -177.992 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.478 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -177.275 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 2' ' ' ASN . . . . . 0.428 ' CB ' HG21 ' A' ' 58' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.116 0 CA-C-O 121.021 0.439 . . . . 0.0 110.88 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 1.023 HD11 HD13 ' A' ' 8' ' ' LEU . 0.2 OUTLIER -106.91 -176.01 2.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.238 179.133 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -59.66 -176.91 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.905 0.384 . . . . 0.0 111.109 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 1.096 HD21 ' HB1' ' A' ' 120' ' ' ALA . 0.1 OUTLIER -90.72 -62.77 1.38 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.218 179.718 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.456 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 93.0 p -44.14 -38.51 3.72 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.773 -179.41 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.42 -47.61 32.72 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.878 0.37 . . . . 0.0 110.138 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 1.084 HD23 HD21 ' A' ' 117' ' ' LEU . 26.9 tp -60.4 -48.71 80.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.117 179.313 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' HIS . . . . . 0.882 ' ND1' HD22 ' A' ' 121' ' ' LEU . 35.9 t-80 -61.99 -40.59 96.15 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 178.654 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.456 ' HB2' ' O ' ' A' ' 6' ' ' SER . 7.8 mtp180 -60.32 -55.13 37.35 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.34 179.815 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.67 ' HG3' ' CG1' ' A' ' 31' ' ' VAL . 2.6 pt20 -60.56 -55.42 33.55 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.643 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.793 ' O ' HG23 ' A' ' 16' ' ' VAL . 14.6 p -56.63 -51.71 62.79 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 CA-C-O 120.854 0.359 . . . . 0.0 111.371 179.774 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.624 ' HA ' ' HE2' ' A' ' 114' ' ' LYS . 44.1 t -65.05 -23.85 67.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 0.0 112.021 -179.669 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -77.54 -40.67 41.76 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 120.721 -0.392 . . . . 0.0 111.429 -179.014 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.884 HD13 HD21 ' A' ' 110' ' ' LEU . 0.0 OUTLIER -72.0 -46.84 55.73 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 119.472 -0.891 . . . . 0.0 109.224 179.343 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.933 HG22 ' HB3' ' A' ' 110' ' ' LEU . 42.0 t -57.84 -55.85 19.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.529 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.444 ' HG2' ' HE3' ' A' ' 114' ' ' LYS . 0.0 OUTLIER -70.5 -6.48 36.41 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.154 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.455 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 7.3 pt20 -171.87 64.47 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.586 -0.446 . . . . 0.0 111.883 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.455 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 1.9 tt0 174.58 -59.62 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.112 179.467 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.72 ' CB ' HD13 ' A' ' 110' ' ' LEU . 58.5 m -102.06 -42.32 6.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.402 -179.348 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 94.15 -46.7 2.22 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.643 -0.789 . . . . 0.0 111.766 -179.158 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.422 ' O ' ' O ' ' A' ' 23' ' ' CYS . 0.0 OUTLIER -176.71 12.5 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 111.636 0.236 . . . . 0.0 111.636 179.794 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.944 ' O ' HG22 ' A' ' 109' ' ' THR . 48.2 m -57.06 -154.08 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.935 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.746 HG21 ' CD2' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -104.28 151.13 23.78 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 121.068 0.461 . . . . 0.0 111.061 -179.727 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -104.81 135.97 12.83 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.651 -0.785 . . . . 0.0 113.481 -178.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.986 ' HB3' ' HB3' ' A' ' 32' ' ' ALA . 2.5 tmtm? -104.7 120.65 41.84 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.098 -0.705 . . . . 0.0 109.098 179.078 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.562 HD13 ' HA ' ' A' ' 55' ' ' PHE . 0.4 OUTLIER -104.42 145.86 29.67 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.44 0.638 . . . . 0.0 112.578 -178.488 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 162.23 63.97 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.621 179.692 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.694 ' O ' HD23 ' A' ' 3' ' ' LEU . . . 76.03 -4.45 46.53 Favored Glycine 0 C--N 1.336 0.569 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.098 -177.98 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -166.36 166.23 16.72 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.827 ' CG1' HD11 ' A' ' 15' ' ' LEU . 13.9 p -111.04 143.71 20.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.193 0.52 . . . . 0.0 111.592 178.667 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.986 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . . . -124.9 165.32 18.28 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.538 178.625 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -104.82 115.3 30.07 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -178.991 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.579 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 13.1 t-20 -102.55 136.67 41.95 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.659 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.1 ptmt -154.43 36.32 0.42 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.044 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -115.4 -23.06 9.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.265 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.515 ' C ' HG23 ' A' ' 38' ' ' THR . 3.4 m -125.99 -47.72 1.64 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.997 0.427 . . . . 0.0 110.88 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.515 HG23 ' C ' ' A' ' 37' ' ' THR . 2.5 p 82.83 86.46 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 122.046 0.927 . . . . 0.0 111.469 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.746 ' CD2' HG21 ' A' ' 24' ' ' THR . 2.0 m-85 -82.02 131.85 35.25 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 113.952 -1.477 . . . . 0.0 110.575 179.348 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -115.74 -34.57 4.78 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.439 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.547 ' O ' ' HB2' ' A' ' 105' ' ' SER . . . 151.98 50.75 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 N-CA-C 111.372 -0.691 . . . . 0.0 111.372 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.797 HD11 ' H ' ' A' ' 46' ' ' SER . 0.0 OUTLIER -108.14 -173.8 2.37 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.962 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.661 ' H ' HD12 ' A' ' 42' ' ' LEU . 94.1 m -119.08 67.43 0.79 Allowed 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -178.016 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.798 ' HA ' ' HB3' ' A' ' 48' ' ' ALA . 1.0 OUTLIER 45.76 5.97 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 178.591 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.511 ' N ' ' O ' ' A' ' 43' ' ' THR . . . -72.0 -57.35 4.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.693 0.282 . . . . 0.0 111.584 -179.145 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.797 ' H ' HD11 ' A' ' 42' ' ' LEU . 0.2 OUTLIER -58.31 -61.31 2.67 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.867 0.365 . . . . 0.0 110.687 -179.773 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -179.69 31.06 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.672 179.775 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.798 ' HB3' ' HA ' ' A' ' 44' ' ' ILE . . . -80.58 -166.91 1.18 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.014 0.435 . . . . 0.0 111.216 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.537 ' N ' ' OE2' ' A' ' 52' ' ' GLU . 3.2 mmt180 -137.82 -159.15 0.93 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.165 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.918 ' O ' HG22 ' A' ' 54' ' ' VAL . 3.6 mp0 -95.17 -30.71 13.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.594 0.235 . . . . 0.0 111.606 -179.803 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' SER . . . . . 0.512 ' CB ' ' HG2' ' A' ' 26' ' ' LYS . 0.6 OUTLIER -62.04 -45.41 93.67 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.283 -0.417 . . . . 0.0 112.051 -179.228 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.537 ' OE2' ' N ' ' A' ' 49' ' ' ARG . 0.8 OUTLIER -59.28 -65.24 0.7 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.029 0.443 . . . . 0.0 110.294 179.94 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.697 ' HE2' HD11 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -46.44 -59.44 2.96 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.604 179.648 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.918 HG22 ' O ' ' A' ' 50' ' ' GLU . 11.7 m -49.09 -44.12 16.08 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-O 120.988 0.423 . . . . 0.0 110.308 179.561 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.588 ' HE2' HG23 ' A' ' 31' ' ' VAL . 0.4 OUTLIER -53.5 -53.14 55.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.805 178.768 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.735 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -55.07 -46.44 75.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.811 179.447 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -66.12 -42.25 89.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.221 0.534 . . . . 0.0 110.561 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.428 HG21 ' CB ' ' A' ' 2' ' ' ASN . 93.0 m -60.01 -47.54 85.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.956 -179.858 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.813 ' CG2' HD12 ' A' ' 117' ' ' LEU . 11.1 p -69.96 -38.03 74.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.853 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.624 HD13 ' O ' ' A' ' 102' ' ' SER . 4.0 tp -59.29 -37.59 78.06 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 121.146 0.498 . . . . 0.0 109.766 179.551 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 15.5 t -72.2 -52.96 14.08 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.032 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' HIS . . . . . 0.545 ' HB3' HD22 ' A' ' 5' ' ' LEU . 7.2 m-70 -55.49 -35.06 65.15 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 121.092 0.472 . . . . 0.0 110.322 179.573 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 1.031 HG13 ' CG1' ' A' ' 66' ' ' VAL . 57.0 t -83.7 -69.97 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.176 179.172 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.493 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 42.82 28.67 0.14 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.605 178.9 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.529 ' H ' HG12 ' A' ' 63' ' ' VAL . 0.7 OUTLIER 157.37 -75.97 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.782 0 CA-C-O 120.709 0.29 . . . . 0.0 111.647 179.853 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 1.031 ' CG1' HG13 ' A' ' 63' ' ' VAL . 35.4 m 46.52 -139.25 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.614 -179.475 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.506 ' O ' ' O ' ' A' ' 98' ' ' SER . 3.5 p -158.05 -20.84 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -179.199 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.659 HD23 ' HB3' ' A' ' 72' ' ' ASP . 2.0 mp 36.68 90.13 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 179.705 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 30.5 p -67.18 -173.69 0.29 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 179.006 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.506 ' NE2' ' N ' ' A' ' 71' ' ' GLU . 0.0 OUTLIER -49.5 -30.49 8.43 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.954 0.406 . . . . 0.0 110.749 179.99 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.506 ' N ' ' NE2' ' A' ' 70' ' ' GLN . 0.6 OUTLIER -65.09 -65.04 0.72 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.691 179.661 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.659 ' HB3' HD23 ' A' ' 68' ' ' LEU . 0.9 OUTLIER -54.95 -35.06 63.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.978 -179.942 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.0 m -59.36 -61.69 2.44 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 109.125 -0.695 . . . . 0.0 109.125 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.529 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . . . -56.86 -26.24 58.24 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 121.501 0.667 . . . . 0.0 109.241 177.744 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 1.057 ' CG ' HG22 ' A' ' 115' ' ' VAL . 1.0 OUTLIER -62.18 -62.32 1.85 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.718 -1.128 . . . . 0.0 111.005 179.4 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 1.025 HD13 HD21 ' A' ' 90' ' ' LEU . 0.6 OUTLIER -59.33 -49.52 77.5 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.691 179.891 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.632 HD12 ' C ' ' A' ' 77' ' ' LEU . 1.5 pp -61.16 -29.43 69.78 Favored 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.222 179.653 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.1 -56.95 11.28 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 178.73 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.13 -29.2 67.23 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.289 179.113 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 51.6 m . . . . . 0 C--N 1.331 -0.214 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.181 179.945 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ASN . . . . . 0.576 ' ND2' ' O ' ' A' ' 103' ' ' LEU . 5.1 t-20 . . . . . 0 C--O 1.251 1.162 0 CA-C-O 121.051 0.453 . . . . 0.0 111.006 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 1.315 ' HA ' ' OG ' ' A' ' 102' ' ' SER . 95.0 m-85 -99.13 125.42 44.66 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 115.608 -0.724 . . . . 0.0 112.179 -178.353 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.787 ' CG ' HG13 ' A' ' 101' ' ' VAL . 0.7 OUTLIER -104.64 136.54 43.98 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 -179.966 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 1.025 HD21 HD13 ' A' ' 76' ' ' LEU . 30.6 mt -129.48 155.08 46.3 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 -176.352 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.716 ' HB2' HG12 ' A' ' 99' ' ' VAL . 0.0 OUTLIER -132.31 161.71 32.86 Favored 'General case' 0 C--O 1.215 -0.746 0 CA-C-N 114.703 -1.135 . . . . 0.0 108.558 177.585 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.794 ' O ' HG13 ' A' ' 93' ' ' VAL . 22.9 p -103.64 158.64 16.23 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.882 0.849 . . . . 0.0 112.676 -178.87 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.794 HG13 ' O ' ' A' ' 92' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.437 -1.117 0 CA-C-N 113.695 -1.593 . . . . 0.0 107.884 -179.141 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.576 ' O ' ' O ' ' A' ' 93' ' ' VAL . 0.5 OUTLIER . . . . . 0 N--CA 1.454 -0.264 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.689 ' CB ' ' O ' ' A' ' 91' ' ' ARG . 0.2 OUTLIER -139.27 164.98 28.39 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.294 0.569 . . . . 0.0 110.784 179.772 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.716 HG12 ' HB2' ' A' ' 91' ' ' ARG . 0.5 OUTLIER -104.2 152.25 6.57 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.292 179.636 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.679 HD13 ' CD1' ' A' ' 116' ' ' LEU . 7.5 tp -103.19 105.24 15.48 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 121.638 0.732 . . . . 0.0 112.56 -178.598 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.787 HG13 ' CG ' ' A' ' 89' ' ' ASP . 1.6 p -123.68 110.04 24.8 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.96 0 N-CA-C 104.982 -2.229 . . . . 0.0 104.982 175.761 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' SER . . . . . 1.315 ' OG ' ' HA ' ' A' ' 88' ' ' TYR . 2.5 t -166.85 166.79 15.42 Favored 'General case' 0 CA--C 1.495 -1.171 0 N-CA-C 115.27 1.582 . . . . 0.0 115.27 -174.178 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.637 ' O ' ' C ' ' A' ' 104' ' ' ARG . 0.1 OUTLIER 168.99 -45.41 0.01 OUTLIER 'General case' 0 N--CA 1.435 -1.215 0 CA-C-N 113.721 -1.581 . . . . 0.0 112.09 174.032 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.637 ' C ' ' O ' ' A' ' 103' ' ' LEU . 0.0 OUTLIER 16.1 81.25 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.671 0 O-C-N 123.58 0.55 . . . . 0.0 110.044 178.457 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.636 ' O ' HD13 ' A' ' 103' ' ' LEU . 0.7 OUTLIER 86.02 -166.43 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 -176.28 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.615 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -132.42 101.74 5.46 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 119.989 -0.684 . . . . 0.0 110.629 179.368 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.735 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 1.5 mt-30 -169.13 165.51 11.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.441 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.699 ' SD ' HG11 ' A' ' 59' ' ' VAL . 0.7 OUTLIER -159.87 143.09 14.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.488 0.661 . . . . 0.0 112.588 178.505 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 109' ' ' THR . . . . . 0.944 HG22 ' O ' ' A' ' 23' ' ' CYS . 0.2 OUTLIER -104.31 164.77 11.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.572 -1.195 . . . . 0.0 109.048 178.31 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.933 ' HB3' HG22 ' A' ' 16' ' ' VAL . 2.4 mt -57.32 -51.77 68.03 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.708 0.289 . . . . 0.0 111.044 -179.368 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 111' ' ' GLN . . . . . 0.909 ' O ' HG23 ' A' ' 115' ' ' VAL . 2.9 tp-100 -54.7 -61.45 2.3 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.576 179.364 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 0.833 ' O ' HD22 ' A' ' 116' ' ' LEU . 11.7 m-20 -44.07 -53.81 6.04 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-O 121.074 0.464 . . . . 0.0 111.295 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 0.602 ' HB3' HG21 ' A' ' 12' ' ' VAL . . . -49.92 -60.27 3.08 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.188 179.33 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.638 ' HD2' HG11 ' A' ' 16' ' ' VAL . 0.2 OUTLIER -54.02 -32.49 54.45 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.414 179.473 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 1.057 HG22 ' CG ' ' A' ' 75' ' ' LYS . 48.1 t -61.99 -65.36 0.51 Allowed 'Isoleucine or valine' 0 C--O 1.241 0.63 0 CA-C-O 121.737 0.78 . . . . 0.0 111.912 -178.518 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.833 HD22 ' O ' ' A' ' 112' ' ' ASP . 0.3 OUTLIER -63.32 -34.12 77.0 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.298 -178.941 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 1.084 HD21 HD23 ' A' ' 8' ' ' LEU . 0.6 OUTLIER -73.15 -21.92 60.61 Favored 'General case' 0 CA--C 1.512 -0.498 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.549 178.898 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.567 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 6.5 tp10 -70.17 -46.89 63.7 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 106.267 -1.753 . . . . 0.0 106.267 177.134 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.545 ' HB2' ' OD2' ' A' ' 72' ' ' ASP . . . -74.36 -24.25 59.14 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.085 -1.416 . . . . 0.0 110.236 177.852 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 1.096 ' HB1' HD21 ' A' ' 5' ' ' LEU . . . -77.01 -50.72 12.49 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.471 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.882 HD22 ' ND1' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -62.68 -38.88 92.09 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.715 179.383 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.567 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.1 OUTLIER -73.7 -38.34 64.89 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.313 -179.558 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 29.6 mm100 -89.89 -24.88 21.24 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -178.033 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 124' ' ' GLU . . . . . 0.405 ' HG3' HD23 ' A' ' 5' ' ' LEU . 20.5 mm-40 -84.72 -66.97 0.83 Allowed 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.415 -179.245 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 9.5 t . . . . . 0 C--N 1.324 -0.507 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.363 -179.926 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 6.5 p30 . . . . . 0 CA--C 1.529 0.162 0 CA-C-O 120.734 0.302 . . . . 0.0 110.765 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.861 HD22 ' OE1' ' A' ' 11' ' ' GLN . 5.4 mp -85.49 -99.29 0.06 Allowed 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.735 179.773 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.418 ' O ' ' CB ' ' A' ' 8' ' ' LEU . 1.4 m -168.33 161.05 11.84 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 179.672 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.807 HD21 ' HB3' ' A' ' 62' ' ' HIS . 21.7 mt -56.82 -65.08 0.68 Allowed 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 121.37 0.605 . . . . 0.0 111.002 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.8 t -46.71 -45.4 19.47 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-N 115.165 -0.925 . . . . 0.0 112.091 -178.941 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.23 -64.5 1.12 Allowed 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.805 0.336 . . . . 0.0 110.65 -179.682 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.8 HD23 ' CD2' ' A' ' 117' ' ' LEU . 5.6 tp -44.27 -42.35 6.57 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.258 179.351 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' HIS . . . . . 0.481 ' HA ' HG12 ' A' ' 12' ' ' VAL . 37.6 t-80 -70.51 -44.19 68.13 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.325 178.364 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.404 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 11.3 mmt180 -55.67 -53.66 53.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.768 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.861 ' OE1' HD22 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -63.46 -54.78 31.19 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 120.885 -0.326 . . . . 0.0 111.253 -179.88 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.941 ' HA ' HD12 ' A' ' 15' ' ' LEU . 13.2 p -54.19 -48.58 66.1 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 CA-C-O 121.189 0.519 . . . . 0.0 110.942 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.632 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 60.8 m -62.96 -33.78 76.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.484 -0.78 . . . . 0.0 112.101 -179.519 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.404 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -74.28 -29.0 61.46 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.318 -179.295 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.941 HD12 ' HA ' ' A' ' 12' ' ' VAL . 0.5 OUTLIER -75.84 -50.77 14.16 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.517 179.628 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.873 ' CG2' ' HB3' ' A' ' 110' ' ' LEU . 69.6 t -66.71 -54.42 25.6 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.408 0 CA-C-O 121.202 0.525 . . . . 0.0 111.519 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 13' ' ' SER . 0.3 OUTLIER -63.23 -8.59 8.61 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.767 -178.46 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -141.88 25.12 1.98 Allowed 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 120.996 -0.282 . . . . 0.0 111.594 179.322 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.453 ' N ' ' O ' ' A' ' 15' ' ' LEU . 3.8 tt0 179.73 -69.93 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.944 ' CB ' HD13 ' A' ' 110' ' ' LEU . 0.7 OUTLIER -83.44 68.83 9.89 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.992 0.425 . . . . 0.0 111.917 -178.161 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -36.41 -34.55 0.09 OUTLIER Glycine 0 CA--C 1.521 0.441 0 CA-C-N 115.73 -0.668 . . . . 0.0 114.009 -179.732 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -166.57 9.04 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -179.508 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.55 ' HB2' ' HB3' ' A' ' 20' ' ' SER . 96.2 m -53.72 -171.26 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.708 0.289 . . . . 0.0 110.819 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.594 HG21 ' HB3' ' A' ' 39' ' ' PHE . 8.2 m -103.57 148.04 26.46 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 179.829 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.403 ' HA2' ' O ' ' A' ' 32' ' ' ALA . . . -104.51 144.23 15.8 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.095 -1.05 . . . . 0.0 113.507 -178.67 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.938 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -112.35 126.45 55.29 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 179.17 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.846 HD12 ' HA ' ' A' ' 55' ' ' PHE . 0.4 OUTLIER -104.67 144.2 32.05 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.308 0.575 . . . . 0.0 111.893 -178.846 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.441 ' H ' HD23 ' A' ' 27' ' ' LEU . 0.0 OUTLIER 171.12 57.28 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.135 179.891 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.841 ' C ' HD11 ' A' ' 3' ' ' LEU . . . 84.52 -2.25 88.13 Favored Glycine 0 N--CA 1.451 -0.35 0 N-CA-C 111.129 -0.788 . . . . 0.0 111.129 -177.883 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.569 ' N ' HD11 ' A' ' 3' ' ' LEU . 0.1 OUTLIER -166.45 165.5 16.97 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 179.731 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.708 HG22 ' HG3' ' A' ' 11' ' ' GLN . 1.3 m -119.78 117.8 54.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 C-N-CA 119.857 -0.737 . . . . 0.0 111.487 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.938 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -108.26 166.87 10.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.111 -179.296 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.736 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -103.33 132.24 49.75 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.221 0.534 . . . . 0.0 111.485 -179.305 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.403 ' O ' ' HB3' ' A' ' 23' ' ' CYS . 5.2 t30 -115.33 121.24 42.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.67 -179.52 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.5 tttt -113.69 -10.88 13.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.512 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -79.91 -66.78 0.83 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.781 0.324 . . . . 0.0 111.27 -179.704 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.6 168.93 17.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.332 -179.531 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 61.6 p -131.48 114.58 15.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.496 179.836 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.729 ' CZ ' HG22 ' A' ' 109' ' ' THR . 0.0 OUTLIER -79.59 -179.72 7.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.19 -179.586 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.502 ' N ' ' CG ' ' A' ' 39' ' ' PHE . 0.8 OUTLIER 165.63 36.28 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.512 179.716 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.496 ' C ' ' HB2' ' A' ' 107' ' ' GLN . . . 89.37 -34.83 3.86 Favored Glycine 0 CA--C 1.52 0.375 0 CA-C-N 115.76 -0.655 . . . . 0.0 112.367 -179.33 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.622 HD21 ' HB3' ' A' ' 46' ' ' SER . 0.4 OUTLIER -21.0 139.51 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.404 0.681 . . . . 0.0 112.785 179.579 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.9 27.41 1.82 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.599 -179.791 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.825 HG23 ' O ' ' A' ' 48' ' ' ALA . 8.7 mm 65.65 5.6 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -87.24 -29.12 21.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.777 0.322 . . . . 0.0 111.439 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.622 ' HB3' HD21 ' A' ' 42' ' ' LEU . 1.3 t -87.21 -32.52 19.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.081 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.41 40.16 0.03 OUTLIER Glycine 0 CA--C 1.518 0.281 0 C-N-CA 120.462 -0.875 . . . . 0.0 113.197 179.836 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.825 ' O ' HG23 ' A' ' 44' ' ' ILE . . . -106.86 169.28 8.64 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.841 0.32 . . . . 0.0 110.846 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.453 ' C ' HD12 ' A' ' 44' ' ' ILE . 14.9 mtp180 -87.98 132.13 34.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.844 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.63 ' O ' HG23 ' A' ' 54' ' ' VAL . 7.9 tt0 -52.12 -30.46 26.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.056 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' SER . . . . . 0.51 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 19.5 p -61.31 -55.11 35.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.969 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.524 ' CB ' ' HG2' ' A' ' 107' ' ' GLN . 13.8 mt-10 -51.6 -44.36 62.81 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.082 0.468 . . . . 0.0 110.411 179.733 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.469 ' HG3' ' HB3' ' A' ' 106' ' ' ASP . 0.1 OUTLIER -56.57 -62.52 1.67 Allowed 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.33 178.945 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.63 HG23 ' O ' ' A' ' 50' ' ' GLU . 33.5 t -49.81 -32.04 7.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 121.167 0.508 . . . . 0.0 110.33 179.262 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.846 ' HA ' HD12 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -64.98 -48.02 75.47 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.362 179.306 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.438 ' HB2' ' C ' ' A' ' 107' ' ' GLN . . . -59.27 -39.12 81.89 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-O 121.028 0.442 . . . . 0.0 110.061 179.118 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 4.0 mm100 -69.21 -33.85 73.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.943 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.403 HG21 HD11 ' A' ' 27' ' ' LEU . 48.3 m -75.59 -50.97 13.94 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 120.911 0.386 . . . . 0.0 110.505 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.765 HG13 ' O ' ' A' ' 55' ' ' PHE . 3.0 m -62.75 -37.33 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.694 179.737 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.776 HD13 HD23 ' A' ' 103' ' ' LEU . 4.9 tp -70.14 -44.51 68.71 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.556 179.415 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 74.8 m -60.85 -62.23 2.01 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.612 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' HIS . . . . . 0.807 ' HB3' HD21 ' A' ' 5' ' ' LEU . 1.9 m-70 -49.33 -43.27 43.52 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 121.08 0.467 . . . . 0.0 110.703 -179.768 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 1.011 HG11 HD23 ' A' ' 100' ' ' LEU . 67.7 t -74.2 -80.15 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.242 179.228 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.539 ' HB3' ' O ' ' A' ' 63' ' ' VAL . . . 75.21 -26.02 0.2 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.358 -0.383 . . . . 0.0 112.005 179.389 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.442 ' O ' HG22 ' A' ' 66' ' ' VAL . 1.5 p30 -170.03 -51.99 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.065 0.46 . . . . 0.0 110.396 -179.197 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.993 ' CG1' HG13 ' A' ' 63' ' ' VAL . 35.9 m 46.56 -139.72 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.555 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.532 ' O ' ' O ' ' A' ' 98' ' ' SER . 3.4 p -153.47 -24.85 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 N-CA-C 113.367 0.876 . . . . 0.0 113.367 -179.259 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.843 HD23 ' HB3' ' A' ' 72' ' ' ASP . 1.5 mp 34.07 98.42 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 112.659 0.615 . . . . 0.0 112.659 179.432 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.594 HG23 ' NH1' ' A' ' 122' ' ' ARG . 68.8 p -60.66 -122.94 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 179.081 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.35 -39.54 9.98 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.347 0.594 . . . . 0.0 109.869 179.139 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.501 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 2.1 tt0 -59.6 -64.92 0.77 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.215 -179.886 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.843 ' HB3' HD23 ' A' ' 68' ' ' LEU . 96.1 m-20 -52.44 -33.14 42.77 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.237 -179.676 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 97.8 m -61.62 -63.9 1.12 Allowed 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.66 -24.25 60.84 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 177.667 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 1.082 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.2 OUTLIER -59.23 -65.09 0.72 Allowed 'General case' 0 C--O 1.234 0.261 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.428 179.017 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 1.097 HD13 HD21 ' A' ' 90' ' ' LEU . 0.4 OUTLIER -58.55 -38.92 78.84 Favored 'General case' 0 CA--C 1.52 -0.206 0 N-CA-C 109.425 -0.584 . . . . 0.0 109.425 178.981 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -50.75 -49.83 57.1 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.726 179.648 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -67.36 -53.04 33.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.878 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.33 -21.54 59.93 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.161 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 45.8 m . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.145 -179.819 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 16.5 p-10 . . . . . 0 C--O 1.234 0.269 0 N-CA-C 111.457 0.169 . . . . 0.0 111.457 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.81 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 1.3 m-85 -103.05 137.28 41.44 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.691 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.733 ' CG ' HG13 ' A' ' 101' ' ' VAL . 0.4 OUTLIER -105.1 140.84 37.67 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 121.958 0.885 . . . . 0.0 110.921 -177.597 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 1.097 HD21 HD13 ' A' ' 76' ' ' LEU . 11.3 mt -132.2 150.1 52.23 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.137 -0.938 . . . . 0.0 113.134 -178.027 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.453 ' O ' ' CB ' ' A' ' 98' ' ' SER . 0.0 OUTLIER -137.18 148.99 46.94 Favored 'General case' 0 C--O 1.219 -0.534 0 N-CA-C 107.67 -1.234 . . . . 0.0 107.67 177.551 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.621 ' O ' HG13 ' A' ' 93' ' ' VAL . 11.4 p -111.26 141.88 44.2 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 -178.384 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.621 HG13 ' O ' ' A' ' 92' ' ' SER . 15.9 m . . . . . 0 N--CA 1.448 -0.565 0 CA-C-N 113.848 -1.524 . . . . 0.0 108.283 178.617 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.225 0 CA-C-O 120.555 0.216 . . . . 0.0 110.616 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.532 ' O ' ' O ' ' A' ' 67' ' ' VAL . 0.2 OUTLIER -133.1 165.57 24.45 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.518 0.675 . . . . 0.0 111.122 -179.981 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -103.93 140.04 23.19 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 179.087 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 1.011 HD23 HG11 ' A' ' 63' ' ' VAL . 8.7 tp -104.29 106.37 16.84 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -178.2 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.733 HG13 ' CG ' ' A' ' 89' ' ' ASP . 0.5 OUTLIER -122.48 123.05 67.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 104.741 -2.318 . . . . 0.0 104.741 176.361 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 102' ' ' SER . . . . . 0.81 ' HB2' ' HA ' ' A' ' 88' ' ' TYR . 72.2 p -165.31 166.79 18.44 Favored 'General case' 0 C--N 1.312 -1.06 0 C-N-CA 116.876 -1.93 . . . . 0.0 116.161 -173.782 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.776 HD23 HD13 ' A' ' 60' ' ' LEU . 0.1 OUTLIER 161.5 -89.73 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 112.815 -1.993 . . . . 0.0 111.789 175.52 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.573 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 52.75 40.16 29.95 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 -179.729 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.573 ' CB ' ' O ' ' A' ' 104' ' ' ARG . 57.7 m 116.64 156.65 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.392 1.077 . . . . 0.0 108.298 -177.939 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.469 ' HB3' ' HG3' ' A' ' 53' ' ' LYS . 1.5 m-20 -104.92 102.55 12.07 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -178.27 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.802 ' NE2' ' HB1' ' A' ' 48' ' ' ALA . 2.6 tt0 -167.65 148.55 5.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.058 177.522 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.77 ' HE2' ' CZ ' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -143.72 159.22 42.88 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -179.98 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 109' ' ' THR . . . . . 0.729 HG22 ' CZ ' ' A' ' 39' ' ' PHE . 1.2 t -117.5 160.82 20.59 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.405 -1.27 . . . . 0.0 109.409 179.133 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.944 HD13 ' CB ' ' A' ' 20' ' ' SER . 1.0 OUTLIER -50.24 -55.92 13.29 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 120.732 0.301 . . . . 0.0 111.284 -179.502 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 111' ' ' GLN . . . . . 0.894 ' O ' HG23 ' A' ' 115' ' ' VAL . 3.2 tp-100 -50.37 -65.36 0.57 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.243 -179.853 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 0.88 ' O ' HD22 ' A' ' 116' ' ' LEU . 11.5 m-20 -47.64 -55.46 9.33 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.88 0.371 . . . . 0.0 110.986 -179.58 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 0.53 ' HB1' ' CE1' ' A' ' 55' ' ' PHE . . . -42.39 -59.04 1.98 Allowed 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.104 179.805 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.675 ' HE2' ' HB ' ' A' ' 16' ' ' VAL . 0.0 OUTLIER -63.26 -34.62 78.07 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.084 179.894 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 1.082 HG22 ' CG ' ' A' ' 75' ' ' LYS . 93.3 t -52.48 -65.37 0.3 Allowed 'Isoleucine or valine' 0 C--O 1.248 1.009 0 CA-C-O 122.127 0.965 . . . . 0.0 111.342 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 1.0 ' HB3' HG21 ' A' ' 63' ' ' VAL . 0.0 OUTLIER -61.35 -42.94 99.51 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 114.485 -1.234 . . . . 0.0 110.237 -178.876 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.8 ' CD2' HD23 ' A' ' 8' ' ' LEU . 0.2 OUTLIER -68.09 -16.1 63.87 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.245 179.952 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.593 ' O ' ' HG2' ' A' ' 122' ' ' ARG . 2.7 tm-20 -72.15 -56.58 5.33 Favored 'General case' 0 N--CA 1.438 -1.06 0 N-CA-C 105.453 -2.055 . . . . 0.0 105.453 176.53 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.663 ' HB2' ' OD2' ' A' ' 72' ' ' ASP . . . -64.24 -33.98 77.05 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 114.166 -1.379 . . . . 0.0 110.866 177.725 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.966 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -64.16 -57.88 8.25 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.035 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.629 ' HG ' ' N ' ' A' ' 122' ' ' ARG . 0.1 OUTLIER -56.87 -45.81 82.24 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.997 -179.324 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.629 ' N ' ' HG ' ' A' ' 121' ' ' LEU . 0.0 OUTLIER -63.1 -65.7 0.65 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 119.549 -0.861 . . . . 0.0 111.97 -179.823 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -53.65 -29.79 40.08 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.177 -0.92 . . . . 0.0 113.041 -178.302 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 124' ' ' GLU . . . . . 0.41 ' CG ' ' O ' ' A' ' 120' ' ' ALA . 4.6 mm-40 -95.11 -66.24 0.93 Allowed 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -178.685 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.327 -0.389 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -178.529 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 2' ' ' ASN . . . . . 0.566 ' ND2' HD22 ' A' ' 8' ' ' LEU . 8.6 p-10 . . . . . 0 CA--C 1.536 0.441 0 N-CA-C 111.68 0.252 . . . . 0.0 111.68 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.789 HD21 ' CA ' ' A' ' 30' ' ' ASN . 0.6 OUTLIER -99.9 16.37 24.04 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.457 0.17 . . . . 0.0 111.428 -179.342 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.1 m 72.79 -166.6 0.12 Allowed 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -178.568 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.865 HD21 ' HB3' ' A' ' 62' ' ' HIS . 7.7 mt -95.51 -64.89 1.01 Allowed 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.234 0.54 . . . . 0.0 111.916 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.756 ' HA ' HD13 ' A' ' 121' ' ' LEU . 1.9 p -45.19 -47.07 12.51 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.297 -0.865 . . . . 0.0 112.367 -178.013 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ASP . . . . . 0.43 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 0.6 OUTLIER -73.4 -64.56 0.96 Allowed 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 120.857 0.361 . . . . 0.0 110.078 179.73 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.824 HD23 HD21 ' A' ' 117' ' ' LEU . 14.5 tp -41.39 -47.5 3.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.363 179.134 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' HIS . . . . . 0.579 ' CG ' HD22 ' A' ' 121' ' ' LEU . 32.6 t-80 -64.97 -43.87 91.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.614 178.538 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.43 ' HB2' ' O ' ' A' ' 7' ' ' ASP . 3.4 mmt-85 -53.68 -54.08 42.98 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.995 -1.002 . . . . 0.0 111.586 -179.634 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.723 ' HG3' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -67.72 -51.27 51.28 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.518 -179.505 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.855 HG23 HD23 ' A' ' 110' ' ' LEU . 11.0 p -57.69 -44.36 85.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 CA-C-O 121.137 0.494 . . . . 0.0 110.644 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.791 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 95.0 p -62.84 -51.63 66.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.727 179.417 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.495 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 1.0 OUTLIER -66.64 -17.6 64.93 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.934 179.977 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.488 HD13 HG22 ' A' ' 31' ' ' VAL . 4.9 mt -79.6 -59.62 2.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.709 -179.552 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.499 ' HB ' ' NZ ' ' A' ' 114' ' ' LYS . 1.0 OUTLIER -71.42 -27.66 29.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 C-N-CA 120.904 -0.319 . . . . 0.0 110.92 -179.798 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.406 ' HB2' ' O ' ' A' ' 13' ' ' SER . 5.6 mm-40 -74.98 -13.97 60.57 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.804 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.495 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 10.5 pt20 -170.48 62.53 0.04 OUTLIER 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.78 0.324 . . . . 0.0 111.167 179.498 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 173.12 -60.11 0.01 OUTLIER 'General case' 0 C--O 1.232 0.16 0 CA-C-O 120.835 0.35 . . . . 0.0 111.37 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.716 ' OG ' ' HB2' ' A' ' 33' ' ' ALA . 15.0 m -85.2 -36.85 20.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.603 -179.237 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 55.95 71.83 0.67 Allowed Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.335 -179.594 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 53.77 97.05 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.967 0.413 . . . . 0.0 110.881 -179.751 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.689 ' O ' HG23 ' A' ' 109' ' ' THR . 0.2 OUTLIER -161.82 -161.25 0.76 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.021 -179.731 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.67 HG22 ' OE2' ' A' ' 52' ' ' GLU . 35.4 m -104.1 136.73 43.19 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.336 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.465 ' CA ' ' HG ' ' A' ' 110' ' ' LEU . . . -104.8 140.83 15.15 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.407 -0.901 . . . . 0.0 113.554 -178.706 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.971 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -104.95 133.65 49.38 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.194 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.641 HD22 HG12 ' A' ' 54' ' ' VAL . 1.2 tt -104.72 148.87 26.11 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.327 0.584 . . . . 0.0 111.927 -179.252 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.548 HH21 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER 169.01 58.37 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 114.993 -1.003 . . . . 0.0 108.969 -179.821 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.633 ' CA ' HD11 ' A' ' 3' ' ' LEU . . . 72.3 6.07 64.38 Favored Glycine 0 CA--C 1.52 0.358 0 N-CA-C 110.424 -1.071 . . . . 0.0 110.424 -177.173 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.789 ' CA ' HD21 ' A' ' 3' ' ' LEU . 0.2 OUTLIER -166.36 165.15 17.37 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 -179.74 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.723 HG12 ' HG3' ' A' ' 11' ' ' GLN . 0.8 OUTLIER -119.54 122.85 69.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.399 0.618 . . . . 0.0 111.234 179.021 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.971 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -111.91 166.04 11.56 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.313 179.528 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.719 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -103.73 142.68 33.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.318 0.58 . . . . 0.0 112.176 -178.843 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.472 HD22 ' HB ' ' A' ' 24' ' ' THR . 6.7 t30 -126.96 120.2 28.52 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.1 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.05 21.61 3.49 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.99 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -106.08 -23.98 12.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.192 -179.634 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 12.3 t -135.7 -176.54 4.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.095 0.474 . . . . 0.0 111.615 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.502 ' CB ' HE22 ' A' ' 40' ' ' GLN . 41.5 p -120.66 126.53 50.46 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.24 -179.796 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.714 ' O ' ' HB2' ' A' ' 42' ' ' LEU . 3.2 p90 -81.87 -43.28 18.41 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.132 -179.559 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.502 HE22 ' CB ' ' A' ' 38' ' ' THR . 0.0 OUTLIER 21.09 69.85 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.17 0.988 . . . . 0.0 113.164 -179.669 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.583 ' O ' ' HB2' ' A' ' 105' ' ' SER . . . 36.72 46.02 1.09 Allowed Glycine 0 C--O 1.226 -0.391 0 C-N-CA 120.907 -0.664 . . . . 0.0 112.313 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.72 ' HB3' ' OE1' ' A' ' 107' ' ' GLN . 1.3 tp -85.06 -156.93 0.27 Allowed 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.745 HG23 ' H ' ' A' ' 106' ' ' ASP . 0.2 OUTLIER -155.93 31.67 0.35 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.238 0.542 . . . . 0.0 111.197 179.81 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.904 HG23 ' O ' ' A' ' 48' ' ' ALA . 4.7 mp 54.23 5.17 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.656 179.296 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.431 ' H ' ' C ' ' A' ' 43' ' ' THR . . . -87.8 -22.85 24.28 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.931 0.396 . . . . 0.0 110.672 179.556 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -108.34 -28.06 9.62 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.0 179.846 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 160.12 73.3 0.02 OUTLIER Glycine 0 C--N 1.333 0.398 0 C-N-CA 120.295 -0.955 . . . . 0.0 113.512 179.732 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.904 ' O ' HG23 ' A' ' 44' ' ' ILE . . . -152.53 174.33 14.05 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.836 0.35 . . . . 0.0 111.245 179.136 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -105.52 147.45 28.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.611 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.723 ' O ' HG23 ' A' ' 54' ' ' VAL . 33.1 tt0 -50.34 -39.99 47.81 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.265 0.555 . . . . 0.0 110.861 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' SER . . . . . 0.593 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 2.8 p -48.32 -55.17 11.34 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.189 179.815 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.67 ' OE2' HG22 ' A' ' 24' ' ' THR . 3.1 mp0 -40.52 -62.46 0.77 Allowed 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 120.794 0.33 . . . . 0.0 111.04 179.725 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.66 ' HG2' ' N ' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -54.02 -40.11 66.75 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.713 179.513 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.723 HG23 ' O ' ' A' ' 50' ' ' GLU . 40.7 t -63.33 -43.37 98.57 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.197 0 CA-C-O 121.192 0.52 . . . . 0.0 110.017 179.76 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.722 ' O ' HG12 ' A' ' 59' ' ' VAL . 0.1 OUTLIER -63.82 -32.91 74.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.334 179.386 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.438 ' HB2' ' HB2' ' A' ' 108' ' ' MET . . . -68.56 -59.18 3.33 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.035 179.808 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -56.48 -37.46 70.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.813 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.412 HG21 HD22 ' A' ' 27' ' ' LEU . 7.5 p -64.71 -60.58 2.94 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.74 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.953 HG23 HD12 ' A' ' 117' ' ' LEU . 10.1 p -62.29 -45.01 99.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.78 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.796 HD13 HD23 ' A' ' 103' ' ' LEU . 6.3 tp -56.06 -39.23 71.75 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 120.972 0.415 . . . . 0.0 110.282 179.306 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 44.1 m -65.24 -59.08 4.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.131 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' HIS . . . . . 0.865 ' HB3' HD21 ' A' ' 5' ' ' LEU . 9.8 m170 -54.52 -42.81 71.27 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 121.186 0.517 . . . . 0.0 110.111 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 1.085 HG13 HG11 ' A' ' 66' ' ' VAL . 2.7 t -88.52 54.14 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.443 179.368 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.453 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . -84.16 36.94 0.59 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.292 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.859 ' O ' HG22 ' A' ' 99' ' ' VAL . 0.5 OUTLIER 156.8 -62.99 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 122.744 0.417 . . . . 0.0 110.825 -179.757 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 1.085 HG11 HG13 ' A' ' 63' ' ' VAL . 33.3 m 40.73 -147.91 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.983 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.527 ' O ' ' O ' ' A' ' 98' ' ' SER . 4.9 p -149.62 -25.88 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -179.393 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.624 HD12 ' O ' ' A' ' 98' ' ' SER . 0.6 OUTLIER 32.75 88.94 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.616 0.598 . . . . 0.0 112.616 178.933 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.644 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 0.9 OUTLIER -75.13 -169.77 1.01 Allowed 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.694 -0.403 . . . . 0.0 110.729 179.508 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -40.28 -41.32 1.31 Allowed 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.2 -0.454 . . . . 0.0 112.162 -179.284 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.405 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 0.8 OUTLIER -60.78 -65.11 0.74 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.086 -179.743 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.96 ' O ' HD22 ' A' ' 76' ' ' LEU . 55.0 m-20 -58.47 -44.8 89.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.249 -179.613 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.592 ' HA ' HD23 ' A' ' 76' ' ' LEU . 0.6 OUTLIER -48.93 -57.98 5.6 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.547 0.689 . . . . 0.0 109.659 178.83 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.67 -27.22 68.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.059 -0.973 . . . . 0.0 108.87 177.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 1.039 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -63.76 -46.57 84.71 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.935 -1.029 . . . . 0.0 109.227 178.436 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 1.059 HD13 HG11 ' A' ' 115' ' ' VAL . 1.4 mm? -61.06 -59.84 4.71 Favored 'General case' 0 C--N 1.343 0.284 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 178.078 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.632 ' HA ' HG22 ' A' ' 80' ' ' THR . 5.9 mt -55.19 -30.87 60.8 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.906 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -64.13 -51.99 61.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.303 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' SER . . . . . 0.46 ' CB ' ' HG2' ' A' ' 111' ' ' GLN . 0.3 OUTLIER -68.31 -26.43 65.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.257 179.851 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.632 HG22 ' HA ' ' A' ' 77' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--N 1.331 -0.239 0 CA-C-O 120.734 0.302 . . . . 0.0 111.33 -179.519 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ASN . . . . . 0.405 ' CB ' ' HA3' ' A' ' 41' ' ' GLY . 12.4 p-10 . . . . . 0 C--O 1.235 0.335 0 N-CA-C 111.634 0.235 . . . . 0.0 111.634 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.588 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 0.1 OUTLIER -106.38 153.87 21.61 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.24 0.543 . . . . 0.0 111.118 -179.877 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.744 ' CG ' HG13 ' A' ' 101' ' ' VAL . 0.4 OUTLIER -120.12 150.06 41.22 Favored 'General case' 0 N--CA 1.435 -1.177 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -179.208 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.758 HD11 ' CB ' ' A' ' 76' ' ' LEU . 49.3 mt -142.21 161.64 37.49 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -177.547 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.4 133.65 40.78 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 114.334 -1.303 . . . . 0.0 107.9 177.716 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.873 ' O ' HG13 ' A' ' 93' ' ' VAL . 90.4 p -104.33 150.41 24.5 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -177.666 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.873 HG13 ' O ' ' A' ' 92' ' ' SER . 1.1 m . . . . . 0 CA--C 1.539 0.555 0 CA-C-N 113.596 -1.638 . . . . 0.0 108.355 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.644 ' HA ' ' HA ' ' A' ' 69' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.452 -0.371 0 CA-C-O 120.651 0.263 . . . . 0.0 110.469 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.624 ' O ' HD12 ' A' ' 68' ' ' LEU . 4.1 t -139.97 161.19 38.19 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.294 0.569 . . . . 0.0 110.635 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.859 HG22 ' O ' ' A' ' 65' ' ' ASN . 1.2 t -103.35 150.0 7.08 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.975 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 178.878 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.626 HD13 ' CD1' ' A' ' 116' ' ' LEU . 0.3 OUTLIER -103.68 114.13 28.16 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -178.105 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.744 HG13 ' CG ' ' A' ' 89' ' ' ASP . 1.3 p -126.06 103.8 12.12 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.11 0 N-CA-C 103.198 -2.89 . . . . 0.0 103.198 174.108 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' SER . . . . . 0.66 ' O ' HD23 ' A' ' 103' ' ' LEU . 8.2 p -143.82 165.24 28.23 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 113.879 1.066 . . . . 0.0 113.879 -174.016 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.947 HD13 ' O ' ' A' ' 105' ' ' SER . 0.1 OUTLIER 155.13 -88.13 0.0 OUTLIER 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 113.817 -1.538 . . . . 0.0 112.019 176.589 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.472 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 60.23 21.13 10.52 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 -178.54 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.947 ' O ' HD13 ' A' ' 103' ' ' LEU . 4.6 m 144.43 176.32 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 114.471 -1.24 . . . . 0.0 108.104 -179.082 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.745 ' H ' HG23 ' A' ' 43' ' ' THR . 0.3 OUTLIER -104.04 101.17 10.94 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.315 -0.554 . . . . 0.0 111.037 -179.483 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.72 ' OE1' ' HB3' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -168.51 151.35 5.32 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.429 178.665 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.446 ' HB3' ' HB3' ' A' ' 55' ' ' PHE . 0.9 OUTLIER -153.64 147.91 25.87 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.144 0.497 . . . . 0.0 111.613 178.369 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 109' ' ' THR . . . . . 0.689 HG23 ' O ' ' A' ' 23' ' ' CYS . 0.3 OUTLIER -115.28 160.94 19.16 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.229 -179.916 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.855 HD23 HG23 ' A' ' 12' ' ' VAL . 0.4 OUTLIER -48.91 -60.46 2.74 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.683 0.278 . . . . 0.0 110.444 179.818 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 111' ' ' GLN . . . . . 0.882 ' O ' HG23 ' A' ' 115' ' ' VAL . 3.7 tp-100 -45.47 -65.18 0.57 Allowed 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.537 179.586 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 0.956 ' O ' HD22 ' A' ' 116' ' ' LEU . 29.6 m-20 -45.95 -53.13 10.48 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.113 0.482 . . . . 0.0 110.482 179.331 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 0.526 ' HB1' ' CE1' ' A' ' 55' ' ' PHE . . . -44.81 -63.16 0.97 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.202 179.732 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.791 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -64.41 -27.07 68.75 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.657 -179.756 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 1.059 HG11 HD13 ' A' ' 76' ' ' LEU . 92.6 t -58.72 -64.96 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.868 0 CA-C-O 122.148 0.975 . . . . 0.0 110.627 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.956 HD22 ' O ' ' A' ' 112' ' ' ASP . 0.1 OUTLIER -62.95 -40.08 96.57 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 114.512 -1.222 . . . . 0.0 110.04 -179.415 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.953 HD12 HG23 ' A' ' 59' ' ' VAL . 0.2 OUTLIER -67.78 -22.26 65.2 Favored 'General case' 0 CA--C 1.511 -0.536 0 O-C-N 123.235 0.335 . . . . 0.0 110.925 179.641 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.575 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 5.5 tp10 -69.03 -51.65 36.91 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 106.345 -1.724 . . . . 0.0 106.345 177.291 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.661 ' HB2' ' OD2' ' A' ' 72' ' ' ASP . . . -73.72 -19.15 60.89 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 114.464 -1.244 . . . . 0.0 110.877 177.858 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.915 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -77.59 -59.93 2.58 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.684 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.756 HD13 ' HA ' ' A' ' 6' ' ' SER . 0.1 OUTLIER -59.82 -30.14 68.72 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.739 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.575 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.9 OUTLIER -68.45 -54.82 14.52 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.33 -179.7 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.86 -30.07 26.74 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -177.142 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 124' ' ' GLU . . . . . 0.529 ' OE1' ' HB1' ' A' ' 120' ' ' ALA . 2.7 mt-10 -78.05 -66.57 0.83 Allowed 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.222 -0.591 . . . . 0.0 112.366 -178.35 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.324 -0.541 0 CA-C-O 121.094 0.474 . . . . 0.0 111.747 -179.086 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.532 0.266 0 CA-C-O 120.412 0.148 . . . . 0.0 110.716 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.79 HD21 ' HA ' ' A' ' 30' ' ' ASN . 5.5 mp -71.39 -79.69 0.07 Allowed 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.941 0.4 . . . . 0.0 110.8 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.49 ' O ' ' HB2' ' A' ' 8' ' ' LEU . 0.4 OUTLIER -165.54 -166.43 0.97 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.963 179.934 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.731 HD21 ' HB1' ' A' ' 120' ' ' ALA . 0.4 OUTLIER -95.68 -66.36 0.91 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 122.013 0.911 . . . . 0.0 111.6 -179.949 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p -63.97 -38.36 90.8 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.46 -1.246 . . . . 0.0 112.337 -178.16 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.97 -34.12 64.13 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.517 -0.473 . . . . 0.0 109.919 179.324 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.929 HD23 HD11 ' A' ' 117' ' ' LEU . 13.5 tp -66.98 -49.7 64.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.947 179.24 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' HIS . . . . . 0.678 ' CG ' HD22 ' A' ' 121' ' ' LEU . 56.5 t-80 -61.09 -46.11 91.98 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.969 178.995 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.41 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 5.0 mtp180 -56.73 -42.36 79.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.857 179.367 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.793 ' HG3' HG22 ' A' ' 31' ' ' VAL . 5.4 tp-100 -67.13 -65.65 0.66 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.834 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.038 HG23 HD23 ' A' ' 110' ' ' LEU . 14.4 p -52.29 -46.93 46.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 121.071 0.462 . . . . 0.0 111.204 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.714 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 41.0 m -64.28 -37.88 89.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.802 -179.467 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.41 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 3.7 mmt180 -69.0 -30.7 69.15 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.513 -179.573 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.955 HD12 ' HA ' ' A' ' 12' ' ' VAL . 2.4 mt -72.67 -62.11 1.56 Allowed 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.671 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.782 ' CG2' ' HB3' ' A' ' 110' ' ' LEU . 56.3 t -57.7 -53.61 42.44 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.471 0 CA-C-O 121.217 0.532 . . . . 0.0 111.425 -179.489 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -62.55 -7.35 4.52 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.539 -178.658 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -150.12 37.15 0.69 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 120.953 -0.299 . . . . 0.0 111.699 179.266 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.491 ' N ' ' O ' ' A' ' 15' ' ' LEU . 1.4 mt-10 168.33 -66.79 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.903 ' CB ' HD13 ' A' ' 110' ' ' LEU . 0.8 OUTLIER -76.29 80.09 3.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.669 -177.669 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -66.64 73.5 0.16 Allowed Glycine 0 C--N 1.311 -0.843 0 CA-C-N 114.937 -1.029 . . . . 0.0 112.759 179.438 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.8 t70 75.94 22.09 1.49 Allowed 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 179.433 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.538 ' HB2' HD12 ' A' ' 110' ' ' LEU . 96.4 m -70.21 -165.79 0.11 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 179.329 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.552 ' HA ' ' HA ' ' A' ' 109' ' ' THR . 0.2 OUTLIER -104.39 163.42 12.45 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.818 0.342 . . . . 0.0 110.506 179.692 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -104.28 131.2 10.54 Favored Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.131 -1.033 . . . . 0.0 113.344 -179.229 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.784 ' HB3' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -104.42 110.75 23.13 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.927 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.0 tt -104.0 139.47 39.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.474 0.654 . . . . 0.0 112.231 -178.014 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 165.08 51.71 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.109 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.51 ' C ' HD11 ' A' ' 3' ' ' LEU . . . 94.02 -5.53 72.22 Favored Glycine 0 CA--C 1.519 0.287 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.402 -178.259 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.79 ' HA ' HD21 ' A' ' 3' ' ' LEU . 0.1 OUTLIER -165.55 151.98 9.86 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.818 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.793 HG22 ' HG3' ' A' ' 11' ' ' GLN . 1.5 m -104.81 123.91 59.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.469 179.19 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.784 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . . . -114.02 166.34 11.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.211 -178.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.834 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -103.29 105.97 16.38 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.22 0.533 . . . . 0.0 111.25 -179.628 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.448 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 0.8 OUTLIER -85.11 124.57 31.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.559 -179.884 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -125.08 28.19 6.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.923 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -110.39 -39.35 4.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.795 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.475 HG21 ' O ' ' A' ' 47' ' ' GLY . 0.8 OUTLIER -104.96 -53.46 2.66 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.115 -179.963 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.6 p 60.58 96.13 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.351 0.596 . . . . 0.0 109.627 -179.269 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.742 ' CG ' ' NE2' ' A' ' 107' ' ' GLN . 18.7 m-85 -133.13 -177.52 4.55 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 113.745 1.017 . . . . 0.0 113.745 -177.793 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.426 ' N ' ' CD ' ' A' ' 40' ' ' GLN . 0.0 OUTLIER -149.75 -56.31 0.18 Allowed 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 114.838 -1.074 . . . . 0.0 110.703 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.523 ' HA3' ' CB ' ' A' ' 87' ' ' ASN . . . -150.66 101.27 0.21 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.495 -0.86 . . . . 0.0 112.911 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.707 HD12 ' H ' ' A' ' 43' ' ' THR . 0.1 OUTLIER -156.74 172.84 17.9 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.787 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.707 ' H ' HD12 ' A' ' 42' ' ' LEU . 0.2 OUTLIER -108.67 40.9 1.69 Allowed 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -176.946 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.66 ' HA ' ' HB3' ' A' ' 48' ' ' ALA . 3.3 mt 55.1 0.89 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 179.299 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.47 ' H ' ' C ' ' A' ' 43' ' ' THR . . . -68.83 -35.92 77.56 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.204 0.526 . . . . 0.0 109.974 179.541 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.541 ' H ' HD11 ' A' ' 42' ' ' LEU . 6.6 t -74.96 -59.77 2.59 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.393 179.257 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLY . . . . . 0.475 ' O ' HG21 ' A' ' 37' ' ' THR . . . 173.5 31.75 0.03 OUTLIER Glycine 0 CA--C 1.52 0.36 0 C-N-CA 120.638 -0.792 . . . . 0.0 113.246 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.703 ' HB2' ' NE2' ' A' ' 107' ' ' GLN . . . -67.67 -167.42 0.07 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.268 0.556 . . . . 0.0 111.535 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 17.0 mmm180 -145.67 143.4 29.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.937 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.666 ' O ' HG23 ' A' ' 54' ' ' VAL . 4.6 mp0 -45.06 -31.49 1.37 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.884 0.373 . . . . 0.0 111.381 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' SER . . . . . 0.434 ' CB ' ' HG2' ' A' ' 26' ' ' LYS . 0.4 OUTLIER -60.49 -61.49 2.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.253 -179.936 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.419 ' HG2' ' CG2' ' A' ' 24' ' ' THR . 54.1 mt-10 -48.88 -65.35 0.58 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.122 0.487 . . . . 0.0 110.957 -179.894 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.627 ' HD2' HD11 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -45.01 -57.59 3.74 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.345 179.72 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.685 ' O ' HG23 ' A' ' 58' ' ' THR . 78.2 t -52.58 -35.25 20.45 Favored 'Isoleucine or valine' 0 C--O 1.232 0.133 0 CA-C-O 120.945 0.402 . . . . 0.0 110.534 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.586 ' HB3' ' HB3' ' A' ' 108' ' ' MET . 0.2 OUTLIER -65.35 -47.31 76.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.306 179.462 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.813 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -55.6 -49.2 73.43 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-O 120.982 0.42 . . . . 0.0 110.59 179.339 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -59.98 -45.57 92.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.816 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.685 HG23 ' O ' ' A' ' 54' ' ' VAL . 82.0 p -66.97 -52.83 37.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.804 -179.559 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.654 HG23 HD12 ' A' ' 117' ' ' LEU . 13.4 p -56.2 -46.49 81.29 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-O 120.828 0.347 . . . . 0.0 111.267 -179.189 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.463 ' N ' HG13 ' A' ' 59' ' ' VAL . 1.1 tp -67.62 -36.85 81.59 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.533 179.743 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 33.3 m -61.44 -65.23 0.72 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.123 -0.49 . . . . 0.0 112.036 -179.447 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' HIS . . . . . 0.856 ' NE2' HG23 ' A' ' 63' ' ' VAL . 9.7 p-80 -50.09 -44.99 52.2 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.019 0.438 . . . . 0.0 110.365 -179.726 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 1.009 HG21 ' HB3' ' A' ' 116' ' ' LEU . 16.8 t -63.79 -66.63 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.776 178.552 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.503 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 37.82 36.17 0.09 Allowed 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.541 178.751 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.549 ' H ' HG12 ' A' ' 63' ' ' VAL . 11.2 t-20 154.97 -80.44 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 122.479 0.311 . . . . 0.0 110.979 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.98 ' CG1' HG13 ' A' ' 63' ' ' VAL . 17.0 m 45.38 -154.41 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.546 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.845 HG13 ' O ' ' A' ' 67' ' ' VAL . 3.2 p -163.98 69.34 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.334 -0.084 0 CA-C-O 121.869 0.842 . . . . 0.0 111.4 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.842 HD23 ' HB3' ' A' ' 72' ' ' ASP . 1.0 OUTLIER -53.39 107.0 0.2 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.12 -0.945 . . . . 0.0 112.32 -179.904 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.732 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 74.1 p -71.14 -176.83 1.52 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 0.0 109.778 178.767 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.416 ' HA ' ' OG1' ' A' ' 73' ' ' THR . 0.0 OUTLIER -46.08 -34.59 4.26 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.159 0.504 . . . . 0.0 111.115 -179.786 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.406 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 0.8 OUTLIER -68.83 -65.05 0.75 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.793 179.987 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.842 ' HB3' HD23 ' A' ' 68' ' ' LEU . 43.9 m-20 -55.21 -29.45 57.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.971 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.439 ' CG2' ' HB3' ' A' ' 98' ' ' SER . 1.5 p -65.65 -60.95 2.38 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 178.443 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.73 -25.97 55.92 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 177.57 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 1.101 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.1 OUTLIER -57.71 -65.07 0.7 Allowed 'General case' 0 C--O 1.234 0.262 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.564 178.922 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.848 HD21 HD11 ' A' ' 116' ' ' LEU . 0.4 OUTLIER -59.01 -38.96 80.44 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 121.2 0.524 . . . . 0.0 109.87 179.085 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -52.25 -44.37 64.85 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.617 179.766 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -72.31 -58.24 3.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.887 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' SER . . . . . 0.412 ' CB ' ' HG2' ' A' ' 111' ' ' GLN . 0.0 OUTLIER -56.53 -23.93 43.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.491 -179.822 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.644 HG23 ' OD1' ' A' ' 87' ' ' ASN . 51.1 m . . . . . 0 C--N 1.329 -0.287 0 CA-C-O 120.772 0.32 . . . . 0.0 111.63 -179.461 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ASN . . . . . 0.644 ' OD1' HG23 ' A' ' 80' ' ' THR . 11.5 p-10 . . . . . 0 C--O 1.244 0.772 0 CA-C-O 121.585 0.707 . . . . 0.0 110.496 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.69 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 3.1 m-85 -108.83 138.35 45.29 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.53 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.649 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.1 OUTLIER -104.64 150.49 24.65 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.444 -178.437 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.665 HD23 ' HA ' ' A' ' 100' ' ' LEU . 12.5 mt -138.53 144.65 40.03 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -178.013 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -132.88 114.53 14.17 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 178.178 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.512 ' HA ' ' CB ' ' A' ' 98' ' ' SER . 1.6 m -104.24 146.25 29.05 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 113.739 1.015 . . . . 0.0 113.739 -177.043 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.529 ' O ' ' O ' ' A' ' 97' ' ' ASN . 12.7 m . . . . . 0 N--CA 1.447 -0.594 0 CA-C-N 114.107 -1.406 . . . . 0.0 108.753 179.163 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.762 ' HB2' HG22 ' A' ' 67' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.518 -0.285 0 CA-C-O 121.281 0.563 . . . . 0.0 111.422 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.52 ' O ' ' N ' ' A' ' 68' ' ' LEU . 39.9 t -146.28 165.12 30.19 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.472 -179.165 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.457 ' H ' ' HG ' ' A' ' 98' ' ' SER . 2.3 t -116.07 152.9 17.73 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.541 179.242 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.665 ' CB ' HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -104.69 126.39 51.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.7 0.762 . . . . 0.0 112.447 -179.586 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.649 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -130.71 110.67 18.9 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 N-CA-C 104.976 -2.231 . . . . 0.0 104.976 175.955 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 102' ' ' SER . . . . . 0.768 ' O ' ' HB2' ' A' ' 103' ' ' LEU . 17.8 p -153.14 165.33 35.97 Favored 'General case' 0 C--N 1.309 -1.169 0 C-N-CA 118.401 -1.32 . . . . 0.0 114.544 -174.603 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.768 ' HB2' ' O ' ' A' ' 102' ' ' SER . 0.8 OUTLIER 136.21 74.72 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 113.21 -1.814 . . . . 0.0 112.457 176.05 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.573 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -108.51 29.02 7.78 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 177.464 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.535 ' HB3' ' N ' ' A' ' 42' ' ' LEU . 2.8 m 153.35 163.49 0.01 OUTLIER 'General case' 0 C--O 1.231 0.117 0 CA-C-N 114.188 -1.369 . . . . 0.0 107.509 -178.489 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.457 ' O ' ' HG3' ' A' ' 107' ' ' GLN . 0.8 OUTLIER -104.79 100.98 10.61 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.977 -179.159 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.813 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 13.7 mt-30 -169.17 163.35 10.99 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.708 177.656 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.586 ' HB3' ' HB3' ' A' ' 55' ' ' PHE . 1.0 OUTLIER -165.93 135.23 3.25 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.293 0.568 . . . . 0.0 112.126 178.293 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 109' ' ' THR . . . . . 0.552 ' HA ' ' HA ' ' A' ' 24' ' ' THR . 0.4 OUTLIER -103.13 160.93 14.21 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.004 178.608 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 1.038 HD23 HG23 ' A' ' 12' ' ' VAL . 4.0 mt -45.77 -54.71 7.53 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -178.589 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' GLN . . . . . 0.843 ' O ' HG23 ' A' ' 115' ' ' VAL . 3.1 tp-100 -48.31 -65.45 0.57 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.747 0.308 . . . . 0.0 111.04 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 0.502 ' O ' ' HB ' ' A' ' 115' ' ' VAL . 1.6 m-20 -47.2 -46.02 23.62 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.247 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 0.49 ' HB1' ' CE1' ' A' ' 55' ' ' PHE . . . -52.08 -60.54 3.08 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.648 179.897 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.842 ' NZ ' HG22 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -65.34 -22.53 66.83 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.993 179.745 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 1.101 HG22 ' CG ' ' A' ' 75' ' ' LYS . 53.0 t -61.51 -61.95 1.35 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.876 0 CA-C-O 121.894 0.854 . . . . 0.0 109.973 179.556 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 1.009 ' HB3' HG21 ' A' ' 63' ' ' VAL . 9.1 mp -61.83 -39.48 91.97 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.595 179.653 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.929 HD11 HD23 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -68.05 -23.17 64.93 Favored 'General case' 0 CA--C 1.507 -0.685 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.677 179.265 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.559 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 9.3 tp10 -66.62 -54.95 17.83 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 106.271 -1.751 . . . . 0.0 106.271 177.114 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.528 ' HB2' ' HA ' ' A' ' 68' ' ' LEU . . . -67.99 -20.13 64.99 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.497 177.226 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.915 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -77.04 -64.49 1.12 Allowed 'General case' 0 CA--C 1.509 -0.627 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.717 179.802 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.913 HD23 ' O ' ' A' ' 117' ' ' LEU . 0.2 OUTLIER -60.63 -21.76 63.06 Favored 'General case' 0 N--CA 1.444 -0.74 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.63 179.416 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.559 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 14.6 ttm-85 -73.9 -57.35 4.04 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.904 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.773 ' HB2' HG12 ' A' ' 67' ' ' VAL . 0.8 OUTLIER -94.37 -21.18 19.12 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -177.395 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -86.42 -66.58 0.89 Allowed 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -178.091 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.458 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -178.665 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 2' ' ' ASN . . . . . 0.49 ' CB ' HG21 ' A' ' 58' ' ' THR . 3.7 p-10 . . . . . 0 CA--C 1.531 0.231 0 CA-C-O 120.64 0.257 . . . . 0.0 110.712 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.781 HD11 ' C ' ' A' ' 29' ' ' GLY . 5.4 mp -84.95 -80.47 0.21 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.857 0.361 . . . . 0.0 111.054 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.431 ' O ' ' HB2' ' A' ' 8' ' ' LEU . 0.1 OUTLIER 171.3 154.33 0.07 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.884 -179.89 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.896 HD21 ' HB3' ' A' ' 62' ' ' HIS . 30.1 mt -49.17 -65.12 0.62 Allowed 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 121.205 0.526 . . . . 0.0 111.936 -179.392 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.2 t -42.4 -56.76 2.87 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.225 -0.898 . . . . 0.0 112.516 -178.31 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.86 -56.16 5.61 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.663 0.268 . . . . 0.0 111.055 -179.517 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.837 HD23 HD21 ' A' ' 117' ' ' LEU . 15.8 tp -45.52 -55.01 6.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.106 0.479 . . . . 0.0 110.218 179.317 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' HIS . . . . . 0.631 ' CG ' HD22 ' A' ' 121' ' ' LEU . 51.5 t-80 -59.62 -47.76 84.33 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.532 178.564 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.2 mmt-85 -49.99 -45.63 51.84 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.512 179.607 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.696 ' CG ' HG22 ' A' ' 31' ' ' VAL . 4.4 tp60 -64.68 -65.51 0.66 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.517 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.799 HG21 ' HB3' ' A' ' 113' ' ' ALA . 12.5 p -57.92 -48.17 84.62 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.768 -179.242 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.766 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 39.6 p -58.24 -53.55 57.03 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.098 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.455 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 8.9 ttm-85 -65.1 -23.81 67.25 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.831 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.446 ' CB ' HD11 ' A' ' 110' ' ' LEU . 7.5 mt -69.94 -61.73 1.66 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.806 0.336 . . . . 0.0 111.46 -179.727 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.734 HG23 HD12 ' A' ' 110' ' ' LEU . 1.2 t -71.41 -27.74 29.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.035 -179.609 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.413 ' CG ' ' O ' ' A' ' 13' ' ' SER . 9.5 mm-40 -72.57 -20.2 61.36 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.727 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.455 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 7.1 pt20 -162.42 57.43 0.23 Allowed 'General case' 0 CA--C 1.527 0.087 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.539 179.516 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 178.64 -60.71 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.159 0 N-CA-C 111.86 0.319 . . . . 0.0 111.86 179.614 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.482 ' OG ' ' HB2' ' A' ' 33' ' ' ALA . 70.2 m -85.89 -78.86 0.26 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.878 0.371 . . . . 0.0 111.514 -179.069 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLY . . . . . 0.591 ' H ' ' HA ' ' A' ' 16' ' ' VAL . . . 123.3 -28.47 5.55 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 121.1 -0.571 . . . . 0.0 112.722 -179.752 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.491 ' HB3' ' O ' ' A' ' 21' ' ' GLY . 0.0 OUTLIER 167.43 6.08 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.801 0.301 . . . . 0.0 111.61 179.958 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.452 ' O ' ' O ' ' A' ' 22' ' ' ASP . 62.9 m -51.76 -164.75 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.083 0.468 . . . . 0.0 111.535 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.639 ' HA ' ' HA ' ' A' ' 109' ' ' THR . 12.5 m -103.61 155.53 18.48 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.673 ' HA2' HD23 ' A' ' 110' ' ' LEU . . . -106.02 129.05 9.6 Favored Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.249 -0.976 . . . . 0.0 113.878 -178.183 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.96 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -109.87 123.62 49.91 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.504 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.541 HD23 ' N ' ' A' ' 28' ' ' ARG . 9.9 tt -107.61 154.5 21.34 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.156 0.503 . . . . 0.0 111.739 -178.76 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.541 ' N ' HD23 ' A' ' 27' ' ' LEU . 2.7 mtt180 161.5 52.08 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.067 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.781 ' C ' HD11 ' A' ' 3' ' ' LEU . . . 96.32 -9.44 67.23 Favored Glycine 0 N--CA 1.452 -0.286 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -178.024 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.466 ' N ' HD11 ' A' ' 3' ' ' LEU . 0.1 OUTLIER -165.77 165.04 18.75 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 179.665 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.696 HG22 ' CG ' ' A' ' 11' ' ' GLN . 1.5 m -112.69 138.24 42.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 C-N-CA 120.359 -0.536 . . . . 0.0 110.979 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.96 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -130.42 165.85 21.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.544 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.482 ' HB2' ' OG ' ' A' ' 20' ' ' SER . . . -103.49 115.09 29.88 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.137 0.494 . . . . 0.0 111.574 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.55 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 0.8 OUTLIER -90.93 119.56 31.22 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.184 179.786 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.27 -22.42 10.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.019 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.682 ' CG ' HG23 ' A' ' 37' ' ' THR . 2.2 pt-20 -55.37 -48.52 74.16 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.854 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.682 HG23 ' CG ' ' A' ' 36' ' ' GLU . 8.9 p -103.33 -161.24 0.82 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.411 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 58.7 p -132.83 -35.99 1.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -179.467 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.78 ' CD1' HG23 ' A' ' 109' ' ' THR . 0.0 OUTLIER 74.25 172.82 0.28 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.828 0.347 . . . . 0.0 110.236 -179.356 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.56 ' N ' ' CG ' ' A' ' 39' ' ' PHE . 0.2 OUTLIER 169.36 37.52 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.122 179.708 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.669 ' C ' ' HB2' ' A' ' 107' ' ' GLN . . . 82.66 -22.05 6.93 Favored Glycine 0 CA--C 1.519 0.313 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.15 -179.141 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.68 HD21 ' CB ' ' A' ' 46' ' ' SER . 12.6 tp -24.17 138.68 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.257 0.623 . . . . 0.0 112.186 179.195 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.509 HG22 ' O ' ' A' ' 43' ' ' THR . 12.8 m -91.58 26.56 2.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.795 -179.42 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.908 HD13 ' HB3' ' A' ' 48' ' ' ALA . 4.4 mm 71.69 3.18 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 179.537 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -74.05 -26.88 60.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.768 0.318 . . . . 0.0 111.113 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.68 ' CB ' HD21 ' A' ' 42' ' ' LEU . 0.5 OUTLIER -95.33 -40.52 9.49 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.074 -179.903 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.79 38.45 0.03 OUTLIER Glycine 0 CA--C 1.519 0.318 0 C-N-CA 120.394 -0.908 . . . . 0.0 113.353 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.908 ' HB3' HD13 ' A' ' 44' ' ' ILE . . . -81.98 159.19 23.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.936 0.368 . . . . 0.0 110.624 179.483 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.45 ' HB3' ' HG2' ' A' ' 52' ' ' GLU . 0.0 OUTLIER -80.2 130.61 35.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.695 179.902 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.715 ' O ' HG22 ' A' ' 54' ' ' VAL . 4.7 mp0 -52.76 -25.66 11.92 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.075 0.464 . . . . 0.0 110.868 179.834 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' SER . . . . . 0.568 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 92.8 p -69.55 -48.65 59.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.026 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.552 ' H ' ' HG2' ' A' ' 52' ' ' GLU . 0.0 OUTLIER -55.28 -56.99 13.69 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 179.15 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.684 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -52.06 -58.78 5.53 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.667 179.654 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.715 HG22 ' O ' ' A' ' 50' ' ' GLU . 16.0 m -52.73 -45.86 49.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 CA-C-O 121.17 0.509 . . . . 0.0 110.401 179.726 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.635 ' CZ ' ' HB1' ' A' ' 113' ' ' ALA . 0.9 OUTLIER -51.42 -46.86 63.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.363 179.237 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.735 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -59.05 -46.65 87.71 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.13 179.168 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -57.93 -40.58 80.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.417 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.49 HG21 ' CB ' ' A' ' 2' ' ' ASN . 89.2 m -68.4 -58.57 4.15 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.212 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 1.025 HG23 HD12 ' A' ' 117' ' ' LEU . 7.2 p -55.92 -42.45 71.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.021 -179.756 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.854 HD22 ' HG ' ' A' ' 103' ' ' LEU . 4.9 tp -64.41 -45.2 88.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.553 179.725 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 72.3 m -57.08 -61.2 2.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.872 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' HIS . . . . . 0.896 ' HB3' HD21 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -49.85 -40.03 40.96 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.009 0.433 . . . . 0.0 110.211 179.572 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.951 HG21 ' HB3' ' A' ' 116' ' ' LEU . 56.1 t -71.47 -80.39 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.648 178.742 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.419 ' O ' ' HB2' ' A' ' 65' ' ' ASN . . . 67.12 -6.11 0.62 Allowed 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 178.298 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.443 ' C ' HG22 ' A' ' 66' ' ' VAL . 2.6 t-20 175.35 -56.2 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 120.806 0.336 . . . . 0.0 110.172 -179.587 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.914 ' CG1' HG13 ' A' ' 63' ' ' VAL . 27.7 m 42.94 -157.68 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.326 178.99 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.828 HG22 ' HB3' ' A' ' 97' ' ' ASN . 0.5 OUTLIER -161.53 89.66 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 CA-C-O 122.088 0.947 . . . . 0.0 108.708 179.531 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.611 ' HB3' ' CB ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -89.99 112.64 24.12 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.812 -1.085 . . . . 0.0 113.007 -177.34 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.511 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 9.2 p -62.63 174.95 0.88 Allowed 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.34 -0.845 . . . . 0.0 109.389 178.248 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -43.8 -30.34 0.65 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.869 0.366 . . . . 0.0 111.445 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.415 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 0.2 OUTLIER -63.04 -65.31 0.71 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.138 -179.909 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.634 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 60.1 m-20 -62.25 -28.95 70.06 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.42 -179.644 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.564 HG22 ' N ' ' A' ' 74' ' ' ALA . 0.8 OUTLIER -61.34 -60.32 3.91 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 179.047 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.595 ' HB1' ' OE1' ' A' ' 78' ' ' GLN . . . -58.87 -28.16 65.87 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.487 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 1.055 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -56.08 -52.49 64.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.601 -1.181 . . . . 0.0 110.154 178.513 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 1.026 HD21 HD11 ' A' ' 116' ' ' LEU . 0.5 OUTLIER -67.01 -54.19 24.07 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.308 179.089 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.653 HD12 ' C ' ' A' ' 77' ' ' LEU . 0.4 OUTLIER -54.83 -24.76 24.47 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.4 -179.901 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.595 ' OE1' ' HB1' ' A' ' 74' ' ' ALA . 2.8 mt-30 -75.65 -63.66 1.25 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.399 179.096 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' SER . . . . . 0.449 ' CB ' ' HG2' ' A' ' 111' ' ' GLN . 0.0 OUTLIER -56.54 -23.09 37.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.498 179.985 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 2.0 m . . . . . 0 C--N 1.33 -0.276 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -179.185 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 87' ' ' ASN . . . . . 0.441 ' HA ' ' HB2' ' A' ' 104' ' ' ARG . 8.5 t-20 . . . . . 0 C--O 1.239 0.526 0 CA-C-O 121.073 0.463 . . . . 0.0 110.907 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.584 ' CE2' HD21 ' A' ' 116' ' ' LEU . 5.2 m-85 -107.37 140.56 40.1 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 120.62 -0.432 . . . . 0.0 111.438 -179.453 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.673 ' CG ' HG13 ' A' ' 101' ' ' VAL . 0.7 OUTLIER -108.92 145.36 35.53 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 -179.593 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.826 HD21 HD13 ' A' ' 76' ' ' LEU . 6.2 mt -132.67 148.39 52.35 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 -177.254 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.451 ' O ' ' O ' ' A' ' 99' ' ' VAL . 5.1 ttp180 -146.36 105.04 3.84 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 105.715 -1.957 . . . . 0.0 105.715 177.363 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.687 ' HB2' ' HB3' ' A' ' 98' ' ' SER . 0.1 OUTLIER -103.37 165.4 11.05 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 116.22 1.933 . . . . 0.0 116.22 -174.041 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.497 HG23 ' HA ' ' A' ' 98' ' ' SER . 0.2 OUTLIER . . . . . 0 C--O 1.242 0.705 0 CA-C-N 111.48 -2.6 . . . . 0.0 106.863 177.67 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.828 ' HB3' HG22 ' A' ' 67' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.506 -0.729 0 CA-C-O 121.368 0.604 . . . . 0.0 111.877 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.687 ' HB3' ' HB2' ' A' ' 92' ' ' SER . 3.7 m -153.96 141.33 19.66 Favored 'General case' 0 N--CA 1.436 -1.173 0 CA-C-N 114.987 -1.006 . . . . 0.0 109.633 178.772 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.451 ' O ' ' O ' ' A' ' 91' ' ' ARG . 76.4 t -104.99 123.04 58.84 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.143 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.499 -179.516 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.834 HD22 HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -102.91 133.33 48.18 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 122.094 0.949 . . . . 0.0 112.821 -178.028 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.673 HG13 ' CG ' ' A' ' 89' ' ' ASP . 0.2 OUTLIER -127.26 117.22 46.63 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 N-CA-C 104.943 -2.243 . . . . 0.0 104.943 176.829 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 102' ' ' SER . . . . . 0.774 ' O ' ' HB2' ' A' ' 103' ' ' LEU . 0.1 OUTLIER -146.36 165.15 30.19 Favored 'General case' 0 C--N 1.307 -1.267 0 C-N-CA 118.589 -1.244 . . . . 0.0 114.205 -174.91 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.854 ' HG ' HD22 ' A' ' 60' ' ' LEU . 0.6 OUTLIER 126.13 72.41 0.0 OUTLIER 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 112.816 -1.993 . . . . 0.0 112.759 176.11 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.441 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -89.3 -5.28 57.69 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.714 -1.13 . . . . 0.0 108.171 176.889 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' A' ' 41' ' ' GLY . 70.1 m -175.79 172.94 2.42 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 113.891 -1.504 . . . . 0.0 107.405 179.299 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.44 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.4 OUTLIER -104.77 102.4 11.97 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 119.581 -0.848 . . . . 0.0 112.326 -178.982 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.735 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 2.2 mt-30 -168.49 165.22 12.57 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.394 178.393 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.658 ' HB2' ' HB2' ' A' ' 56' ' ' ALA . 4.1 tpt -162.04 149.87 14.54 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 179.333 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 109' ' ' THR . . . . . 0.78 HG23 ' CD1' ' A' ' 39' ' ' PHE . 0.7 OUTLIER -116.88 165.21 13.58 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.98 178.732 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.734 HD12 HG23 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -51.73 -59.09 4.69 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 120.837 0.351 . . . . 0.0 110.323 179.513 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 111' ' ' GLN . . . . . 0.938 ' O ' HG23 ' A' ' 115' ' ' VAL . 2.9 tp-100 -48.59 -65.54 0.55 Allowed 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.726 179.743 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 0.677 ' O ' HD22 ' A' ' 116' ' ' LEU . 4.0 t0 -41.95 -54.1 3.6 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-O 121.317 0.579 . . . . 0.0 111.212 179.697 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 0.799 ' HB3' HG21 ' A' ' 12' ' ' VAL . . . -47.98 -64.17 0.87 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.219 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.766 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -60.71 -25.31 66.33 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.956 -0.297 . . . . 0.0 111.253 -179.673 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 1.055 HG22 ' CG ' ' A' ' 75' ' ' LYS . 89.7 t -60.57 -65.49 0.47 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.819 0 CA-C-O 121.58 0.705 . . . . 0.0 110.996 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 1.026 HD11 HD21 ' A' ' 76' ' ' LEU . 0.1 OUTLIER -65.26 -37.41 87.13 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.368 -179.402 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 1.025 HD12 HG23 ' A' ' 59' ' ' VAL . 0.1 OUTLIER -67.59 -24.6 65.52 Favored 'General case' 0 CA--C 1.508 -0.669 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.397 179.422 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.488 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 1.1 tp10 -67.65 -50.38 58.21 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 177.097 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.541 ' CB ' HD23 ' A' ' 68' ' ' LEU . . . -69.62 -24.21 63.62 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.507 -1.224 . . . . 0.0 110.376 177.242 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.899 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -75.69 -65.34 0.91 Allowed 'General case' 0 CA--C 1.51 -0.588 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.711 -179.692 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.631 HD22 ' CG ' ' A' ' 9' ' ' HIS . 0.1 OUTLIER -56.16 -31.72 63.63 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.115 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.488 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 2.3 ttt85 -66.95 -48.8 67.45 Favored 'General case' 0 CA--C 1.528 0.102 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.597 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.61 ' HG3' HG12 ' A' ' 67' ' ' VAL . 0.0 OUTLIER -89.24 -19.1 25.8 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -177.658 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 124' ' ' GLU . . . . . 0.43 ' HB2' ' CD1' ' A' ' 5' ' ' LEU . 3.5 mm-40 -95.35 -66.51 0.91 Allowed 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -178.541 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.327 -0.385 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -178.501 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 2' ' ' ASN . . . . . 0.458 ' HB3' ' CG2' ' A' ' 58' ' ' THR . 6.6 p30 . . . . . 0 CA--C 1.531 0.244 0 CA-C-O 120.88 0.371 . . . . 0.0 111.714 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.926 HD11 HD13 ' A' ' 8' ' ' LEU . 0.2 OUTLIER -88.51 -95.69 0.1 Allowed 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.187 -179.846 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.513 ' O ' ' HB2' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -166.45 146.39 5.98 Favored 'General case' 0 CA--C 1.527 0.082 0 CA-C-O 120.608 0.242 . . . . 0.0 110.349 -179.893 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.728 HD21 ' HB3' ' A' ' 62' ' ' HIS . 19.5 mt -45.87 -65.06 0.6 Allowed 'General case' 0 CA--C 1.51 -0.57 0 CA-C-O 121.018 0.437 . . . . 0.0 111.913 -179.444 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -41.71 -62.05 0.97 Allowed 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.625 -178.327 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ASP . . . . . 0.405 ' OD2' HD12 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -59.79 -47.06 87.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.842 179.822 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.926 HD13 HD11 ' A' ' 3' ' ' LEU . 0.1 OUTLIER -54.81 -65.82 0.51 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.997 -179.642 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 9' ' ' HIS . . . . . 0.53 ' CG ' ' CD2' ' A' ' 121' ' ' LEU . 40.5 t-80 -51.73 -34.3 38.46 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-O 121.61 0.719 . . . . 0.0 109.72 179.166 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.409 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -60.38 -61.38 2.64 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.665 -1.152 . . . . 0.0 110.523 179.919 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.641 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 7.1 pt20 -64.44 -53.22 51.83 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 120.774 -0.37 . . . . 0.0 111.743 -179.691 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.828 HG23 HD23 ' A' ' 110' ' ' LEU . 13.1 p -51.42 -48.45 34.27 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 121.078 0.466 . . . . 0.0 111.077 -179.67 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.642 ' HA ' ' NZ ' ' A' ' 114' ' ' LYS . 52.4 p -67.58 -31.41 71.44 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.417 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.409 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -72.71 -27.0 61.8 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -178.384 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.641 ' HG ' ' O ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -93.45 -37.99 11.66 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 119.308 -0.957 . . . . 0.0 110.579 179.565 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.886 HG13 ' O ' ' A' ' 20' ' ' SER . 59.5 t -68.67 -50.08 58.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 120.864 0.364 . . . . 0.0 111.239 179.688 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.401 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 2.6 mm100 -70.08 -5.66 28.38 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.392 -179.499 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.401 ' HG2' ' O ' ' A' ' 17' ' ' GLN . 9.0 mt-30 -145.14 32.22 1.11 Allowed 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 111.671 0.248 . . . . 0.0 111.671 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.449 ' N ' ' O ' ' A' ' 15' ' ' LEU . 0.4 OUTLIER 175.46 -71.95 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 179.847 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.952 ' CB ' HD13 ' A' ' 110' ' ' LEU . 0.7 OUTLIER -76.65 75.87 3.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.595 -178.629 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -62.83 74.72 0.03 OUTLIER Glycine 0 C--N 1.318 -0.445 0 CA-C-N 115.219 -0.9 . . . . 0.0 112.882 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.42 ' N ' ' O ' ' A' ' 20' ' ' SER . 16.3 t70 78.53 9.84 1.94 Allowed 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 179.226 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.464 ' O ' ' OG1' ' A' ' 109' ' ' THR . 0.9 OUTLIER -61.78 -167.49 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.191 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.132 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.502 ' CG2' ' HB3' ' A' ' 39' ' ' PHE . 94.6 m -103.56 142.34 34.45 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.629 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.614 ' CA ' ' HG ' ' A' ' 110' ' ' LEU . . . -104.76 149.45 16.89 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.049 -1.072 . . . . 0.0 114.157 -178.101 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.821 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -114.19 133.35 55.66 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 178.552 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.703 HD13 ' OG1' ' A' ' 58' ' ' THR . 7.8 tt -113.17 149.94 32.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.377 0.608 . . . . 0.0 111.966 -179.285 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 165.42 64.23 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.183 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.608 ' C ' HD22 ' A' ' 3' ' ' LEU . . . 78.25 -4.87 57.38 Favored Glycine 0 C--N 1.334 0.417 0 C-N-CA 120.681 -0.771 . . . . 0.0 111.214 -177.89 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.468 ' HA ' ' OE1' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -166.26 166.11 17.01 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 -179.772 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.609 ' CG1' ' HG3' ' A' ' 11' ' ' GLN . 13.5 p -105.71 144.76 14.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.223 0.535 . . . . 0.0 111.765 179.361 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.821 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -129.68 159.76 35.45 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.25 178.385 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.78 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -104.17 120.78 41.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.21 0.529 . . . . 0.0 111.832 -179.246 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.459 ' ND2' ' HB ' ' A' ' 24' ' ' THR . 5.0 t30 -104.41 110.11 22.24 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.133 179.528 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -110.82 -32.29 6.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.518 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -63.67 -49.13 74.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.736 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -95.46 171.85 8.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.613 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.4 p -141.15 110.3 6.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.062 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.75 ' CZ ' HG22 ' A' ' 109' ' ' THR . 0.0 OUTLIER -62.64 -175.85 0.1 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.374 179.829 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.507 ' HB3' ' O ' ' A' ' 39' ' ' PHE . 1.1 pm0 160.94 44.56 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.094 179.783 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.405 ' HA2' ' HB2' ' A' ' 107' ' ' GLN . . . 48.8 88.61 0.01 OUTLIER Glycine 0 CA--C 1.52 0.346 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.006 -178.929 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.459 ' HA ' HD13 ' A' ' 42' ' ' LEU . 0.0 OUTLIER -125.9 -155.12 0.66 Allowed 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 -179.948 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.83 8.46 3.54 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.77 HD13 ' HB3' ' A' ' 48' ' ' ALA . 3.6 mm 75.2 2.32 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 179.685 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -93.85 -24.28 17.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.814 0.34 . . . . 0.0 110.896 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.6 t -93.59 -66.64 0.91 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.003 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -163.13 32.76 0.29 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.556 -0.83 . . . . 0.0 112.904 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.77 ' HB3' HD13 ' A' ' 44' ' ' ILE . . . -99.54 165.7 11.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.647 0.26 . . . . 0.0 110.925 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -109.74 149.39 29.85 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.876 0.37 . . . . 0.0 111.188 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.653 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 1.0 OUTLIER -58.66 -26.83 64.19 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.849 179.719 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 51' ' ' SER . . . . . 0.513 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 20.6 p -70.34 -52.31 23.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.817 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.517 ' HB3' ' HG2' ' A' ' 107' ' ' GLN . 1.0 OUTLIER -53.03 -52.08 59.62 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.991 0.424 . . . . 0.0 110.535 179.434 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.653 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -57.9 -54.9 41.69 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.313 -179.967 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.626 HG22 ' O ' ' A' ' 50' ' ' GLU . 19.4 m -55.9 -46.56 80.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 CA-C-O 121.114 0.483 . . . . 0.0 110.165 179.6 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.828 ' O ' HG13 ' A' ' 59' ' ' VAL . 0.5 OUTLIER -50.78 -45.73 59.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.899 178.767 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.734 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -60.36 -41.98 94.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.407 179.143 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.8 mm-40 -66.42 -36.91 84.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.371 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.703 ' OG1' HD13 ' A' ' 27' ' ' LEU . 59.5 p -73.9 -50.72 18.88 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 121.091 0.472 . . . . 0.0 110.045 179.774 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.828 HG13 ' O ' ' A' ' 55' ' ' PHE . 5.1 m -61.49 -46.81 95.82 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.696 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.988 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.728 HD22 ' CD2' ' A' ' 103' ' ' LEU . 14.3 tp -66.38 -47.09 74.46 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.636 -0.256 . . . . 0.0 111.547 -179.858 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.5 m -61.06 -63.88 1.15 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.189 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' HIS . . . . . 0.728 ' HB3' HD21 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -47.39 -30.36 3.24 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 121.101 0.477 . . . . 0.0 110.607 -179.737 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 1.009 HG21 ' HB3' ' A' ' 116' ' ' LEU . 25.1 t -80.32 -69.75 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.753 179.034 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.47 ' O ' ' ND2' ' A' ' 65' ' ' ASN . . . 40.19 26.1 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 178.678 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.498 ' H ' HG12 ' A' ' 63' ' ' VAL . 0.9 OUTLIER 163.78 -74.38 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.775 0.321 . . . . 0.0 110.688 -179.764 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.916 ' CG1' HG13 ' A' ' 63' ' ' VAL . 25.0 m 44.02 -165.9 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.727 179.821 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.602 ' HB ' ' HB3' ' A' ' 97' ' ' ASN . 26.9 m -149.6 60.54 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.435 -1.206 0 CA-C-O 120.906 0.384 . . . . 0.0 111.511 -178.539 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.981 HD22 HD11 ' A' ' 76' ' ' LEU . 1.1 mp -49.21 101.4 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.619 -179.859 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 22.6 p -60.99 -166.78 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.838 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.92 -33.79 67.32 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.11 0.481 . . . . 0.0 110.862 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.443 ' O ' ' HE3' ' A' ' 75' ' ' LYS . 1.6 tm-20 -70.72 -65.45 0.73 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.205 -179.828 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.739 ' HB3' HD23 ' A' ' 68' ' ' LEU . 3.1 m-20 -51.03 -26.25 5.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.021 -179.655 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.446 ' CG2' ' OG ' ' A' ' 98' ' ' SER . 1.1 p -72.7 -54.62 8.49 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 177.868 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.561 ' HA ' HD21 ' A' ' 77' ' ' LEU . . . -54.45 -29.38 49.46 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 176.6 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 1.043 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -58.75 -60.8 3.26 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 113.742 -1.572 . . . . 0.0 110.489 178.289 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 1.099 HD13 HD23 ' A' ' 90' ' ' LEU . 1.0 OUTLIER -52.83 -56.91 12.3 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.139 0.495 . . . . 0.0 110.483 179.41 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.561 HD21 ' HA ' ' A' ' 74' ' ' ALA . 3.3 pp -59.67 -31.13 69.27 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.119 -179.481 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.428 ' N ' HD12 ' A' ' 77' ' ' LEU . 20.0 mm-40 -70.59 -58.62 3.49 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.945 0.402 . . . . 0.0 110.351 179.321 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' SER . . . . . 0.415 ' CB ' ' HG2' ' A' ' 111' ' ' GLN . 1.2 t -50.46 -35.78 30.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.813 179.632 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.495 HG21 ' CE1' ' A' ' 88' ' ' TYR . 2.7 m . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.986 -179.452 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' ASN . . . . . 0.436 ' O ' ' HB2' ' A' ' 104' ' ' ARG . 0.1 OUTLIER . . . . . 0 CA--C 1.533 0.313 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.904 ' CE2' HD11 ' A' ' 90' ' ' LEU . 8.8 p90 -87.24 146.3 26.03 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-O 121.109 0.481 . . . . 0.0 111.702 -179.08 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.779 ' O ' ' O ' ' A' ' 101' ' ' VAL . 1.3 t0 -129.01 154.08 46.97 Favored 'General case' 0 N--CA 1.431 -1.404 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 178.62 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 1.099 HD23 HD13 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -157.9 147.79 20.17 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 114.668 1.358 . . . . 0.0 114.668 -178.578 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.564 ' HB3' ' HB ' ' A' ' 99' ' ' VAL . 0.0 OUTLIER -107.71 165.2 11.61 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 105.127 -2.175 . . . . 0.0 105.127 174.876 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.6 ' HA ' ' HA ' ' A' ' 98' ' ' SER . 75.6 p -139.42 165.18 27.9 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 116.065 1.876 . . . . 0.0 116.065 -177.689 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.594 ' C ' ' O ' ' A' ' 97' ' ' ASN . 0.2 OUTLIER . . . . . 0 C--N 1.323 -0.557 0 CA-C-N 111.448 -2.614 . . . . 0.0 107.502 178.583 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.965 HD21 ' N ' ' A' ' 97' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.442 -0.835 0 CA-C-O 121.535 0.683 . . . . 0.0 111.885 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.6 ' HA ' ' HA ' ' A' ' 92' ' ' SER . 2.1 m -149.94 145.02 26.24 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 179.052 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.564 ' HB ' ' HB3' ' A' ' 91' ' ' ARG . 73.7 t -103.48 152.69 6.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 120.887 0.375 . . . . 0.0 111.669 -177.033 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 1.078 HD21 HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -108.95 130.47 55.45 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 114.916 1.45 . . . . 0.0 114.916 -177.211 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.779 ' O ' ' O ' ' A' ' 89' ' ' ASP . 2.1 p -143.95 103.02 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 N-CA-C 104.581 -2.377 . . . . 0.0 104.581 174.315 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' SER . . . . . 0.583 ' O ' HD23 ' A' ' 103' ' ' LEU . 0.1 OUTLIER -146.42 164.49 32.29 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 119.065 -1.054 . . . . 0.0 113.17 -174.843 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.815 HD13 ' O ' ' A' ' 105' ' ' SER . 0.1 OUTLIER 156.17 -90.96 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 113.505 -1.679 . . . . 0.0 111.372 176.722 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.436 ' HB2' ' O ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER 60.04 18.16 7.4 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 -179.407 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.815 ' O ' HD13 ' A' ' 103' ' ' LEU . 1.1 p 153.18 170.95 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -178.778 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.426 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.4 OUTLIER -110.73 100.02 8.85 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 119.25 -0.98 . . . . 0.0 111.452 179.264 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.734 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 6.1 mt-30 -169.19 164.96 11.1 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.742 -1.117 . . . . 0.0 109.174 177.685 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.566 ' HB2' ' HB2' ' A' ' 56' ' ' ALA . 2.3 tpt -160.76 145.49 14.13 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.121 0.486 . . . . 0.0 111.495 178.668 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' THR . . . . . 0.75 HG22 ' CZ ' ' A' ' 39' ' ' PHE . 0.6 OUTLIER -107.62 156.06 19.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.053 179.513 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.952 HD13 ' CB ' ' A' ' 20' ' ' SER . 0.6 OUTLIER -46.77 -53.48 11.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.746 0.308 . . . . 0.0 111.151 -179.51 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 111' ' ' GLN . . . . . 0.925 ' O ' HG23 ' A' ' 115' ' ' VAL . 3.2 tp-100 -54.05 -61.95 1.97 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.212 179.324 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 0.504 ' HB2' HG23 ' A' ' 109' ' ' THR . 0.8 OUTLIER -46.54 -47.07 19.67 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.935 179.511 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 0.581 ' HB1' ' CZ ' ' A' ' 55' ' ' PHE . . . -53.01 -56.51 15.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.838 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.642 ' NZ ' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -66.11 -28.77 69.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.827 179.94 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 1.043 HG22 ' CG ' ' A' ' 75' ' ' LYS . 94.1 t -57.15 -65.27 0.42 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.729 0 CA-C-O 122.029 0.919 . . . . 0.0 110.588 179.235 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 1.009 ' HB3' HG21 ' A' ' 63' ' ' VAL . 9.5 mp -63.5 -40.63 97.58 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 114.437 -1.256 . . . . 0.0 111.003 -179.131 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.809 HD22 ' HB3' ' A' ' 8' ' ' LEU . 0.6 OUTLIER -73.62 -15.92 61.25 Favored 'General case' 0 CA--C 1.512 -0.507 0 C-N-CA 120.325 -0.55 . . . . 0.0 111.341 -179.809 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.488 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 20.5 tt0 -73.57 -47.84 37.48 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 105.928 -1.878 . . . . 0.0 105.928 176.143 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.431 ' CB ' ' HG ' ' A' ' 68' ' ' LEU . . . -71.77 -29.02 64.03 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 114.693 -1.139 . . . . 0.0 109.868 177.073 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.968 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -68.27 -64.82 0.79 Allowed 'General case' 0 CA--C 1.504 -0.808 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.612 179.614 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.696 HD23 ' O ' ' A' ' 117' ' ' LEU . 0.2 OUTLIER -57.52 -39.27 76.17 Favored 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 119.987 -0.685 . . . . 0.0 109.24 179.509 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.57 ' N ' ' HG ' ' A' ' 121' ' ' LEU . 19.8 ttm-85 -54.73 -45.16 74.05 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.94 179.153 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -86.21 -31.63 21.62 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -178.806 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -95.75 -66.52 0.9 Allowed 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 -178.197 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 47.8 t . . . . . 0 C--N 1.33 -0.276 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 -177.595 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 1.6 p30 . . . . . 0 CA--C 1.532 0.284 0 CA-C-O 120.7 0.286 . . . . 0.0 110.831 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 1.041 HD11 HD12 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -106.85 -81.83 0.55 Allowed 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.108 -179.632 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.521 ' O ' ' HB2' ' A' ' 8' ' ' LEU . 34.9 t -178.23 -162.27 0.06 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.719 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.709 HD21 ' HB3' ' A' ' 62' ' ' HIS . 4.3 mt -95.38 -65.2 0.99 Allowed 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 121.24 0.543 . . . . 0.0 111.283 179.726 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' SER . . . . . 0.427 ' HA ' HD13 ' A' ' 121' ' ' LEU . 1.7 t -44.56 -39.32 4.83 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.636 -178.76 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.98 -62.8 1.58 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.266 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 1.069 HD11 HD11 ' A' ' 27' ' ' LEU . 2.7 tp -46.57 -41.69 14.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.357 0.598 . . . . 0.0 109.97 179.043 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' HIS . . . . . 0.61 ' CG ' HD22 ' A' ' 121' ' ' LEU . 33.7 t-80 -69.34 -45.66 68.93 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.521 178.667 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.9 mtt-85 -54.87 -44.28 73.89 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.193 179.236 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.658 ' CB ' HG13 ' A' ' 31' ' ' VAL . 4.4 mp0 -64.63 -65.17 0.71 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.733 179.432 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 1.0 HG23 HD23 ' A' ' 110' ' ' LEU . 9.6 p -54.8 -47.81 74.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.082 -179.382 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.65 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 7.8 t -60.74 -50.22 74.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.404 -179.688 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -68.05 -22.47 64.94 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.374 -179.465 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.603 HD11 ' O ' ' A' ' 31' ' ' VAL . 12.4 mt -74.31 -60.14 2.41 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.402 -179.7 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.638 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 0.9 OUTLIER -70.81 -28.57 34.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.204 -179.384 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.442 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 5.7 mm-40 -85.46 -9.07 57.98 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.73 -0.388 . . . . 0.0 111.312 -179.681 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.442 ' HG2' ' O ' ' A' ' 17' ' ' GLN . 30.2 mt-30 -152.92 42.38 0.61 Allowed 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 179.759 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 177.56 -69.54 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 179.667 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.638 ' HB2' ' HA ' ' A' ' 16' ' ' VAL . 20.0 m -70.62 -81.5 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.973 -0.558 . . . . 0.0 112.126 -178.315 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLY . . . . . 0.637 ' H ' ' HA ' ' A' ' 16' ' ' VAL . . . 120.42 -33.43 4.5 Favored Glycine 0 N--CA 1.45 -0.376 0 N-CA-C 111.549 -0.62 . . . . 0.0 111.549 -179.22 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 169.64 28.18 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 120.764 0.316 . . . . 0.0 110.98 179.692 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.432 ' HB2' ' HB3' ' A' ' 20' ' ' SER . 0.8 OUTLIER -80.74 -156.34 0.13 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.467 -179.903 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.665 HG21 ' CD2' ' A' ' 39' ' ' PHE . 0.1 OUTLIER -104.02 163.05 12.64 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.813 0.339 . . . . 0.0 110.589 -179.944 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLY . . . . . 0.428 ' HA3' ' CE2' ' A' ' 55' ' ' PHE . . . -110.71 150.72 17.72 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.541 -0.837 . . . . 0.0 113.647 -178.922 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.73 ' HB3' ' HB3' ' A' ' 32' ' ' ALA . 0.3 OUTLIER -114.33 104.44 12.07 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.229 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 1.069 HD11 HD11 ' A' ' 8' ' ' LEU . 0.5 OUTLIER -107.31 152.66 23.84 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -178.108 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.483 ' CB ' ' O ' ' A' ' 27' ' ' LEU . 5.7 ptp180 143.34 55.84 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 114.281 -1.327 . . . . 0.0 109.574 179.007 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.539 ' C ' HD22 ' A' ' 3' ' ' LEU . . . 105.83 -12.8 45.98 Favored Glycine 0 C--N 1.333 0.407 0 N-CA-C 111.388 -0.685 . . . . 0.0 111.388 -178.71 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.442 ' O ' ' HA ' ' A' ' 27' ' ' LEU . 0.1 OUTLIER -166.38 165.23 17.28 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 179.849 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.677 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 1.4 m -121.8 117.29 51.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.244 0.545 . . . . 0.0 110.975 179.228 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.73 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . . . -107.99 166.27 10.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.874 -179.615 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.525 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -103.36 119.73 39.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.094 0.473 . . . . 0.0 111.316 -179.503 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.46 HD22 ' H ' ' A' ' 37' ' ' THR . 1.6 t-20 -98.56 122.09 41.32 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.931 -179.741 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.2 mtmm -118.68 -22.51 7.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.131 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -68.86 -16.21 63.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.486 -179.754 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.46 ' H ' HD22 ' A' ' 34' ' ' ASN . 0.1 OUTLIER -134.82 -175.14 3.8 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.985 0.421 . . . . 0.0 111.261 -179.786 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 72.3 p -147.86 106.84 3.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.872 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.737 ' O ' HG22 ' A' ' 109' ' ' THR . 21.8 m-85 -116.21 138.12 51.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.484 0.659 . . . . 0.0 112.57 -178.839 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -126.17 -45.99 1.67 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.065 179.419 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.469 ' HA2' ' HB2' ' A' ' 107' ' ' GLN . . . 177.04 76.43 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.278 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.112 179.231 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.608 ' H ' ' HB2' ' A' ' 107' ' ' GLN . 0.1 OUTLIER -113.2 -159.53 0.69 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 179.636 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.481 ' H ' HD12 ' A' ' 42' ' ' LEU . 0.2 OUTLIER -137.19 26.75 2.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.733 0.301 . . . . 0.0 111.793 179.963 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.831 ' HA ' ' HB3' ' A' ' 48' ' ' ALA . 1.1 mp 68.14 3.49 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 112.141 0.422 . . . . 0.0 112.141 179.536 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -93.89 -33.51 13.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.865 0.364 . . . . 0.0 110.874 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 3.2 t -98.83 -29.47 12.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.833 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 159.4 83.47 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.617 -0.801 . . . . 0.0 112.559 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.831 ' HB3' ' HA ' ' A' ' 44' ' ' ILE . . . -141.58 -177.48 5.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.044 0.45 . . . . 0.0 111.381 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.1 tpm_? -140.78 143.64 35.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.154 179.304 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.799 ' O ' HG23 ' A' ' 54' ' ' VAL . 2.5 mp0 -48.57 -35.16 12.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.216 0.532 . . . . 0.0 110.981 -179.846 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' SER . . . . . 0.461 ' CB ' ' HG2' ' A' ' 26' ' ' LYS . 0.7 OUTLIER -63.4 -60.61 3.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.374 -179.817 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.542 ' HG3' ' CD2' ' A' ' 39' ' ' PHE . 0.5 OUTLIER -44.41 -65.74 0.48 Allowed 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.149 0.5 . . . . 0.0 110.568 -179.752 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.518 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -47.16 -50.03 21.32 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.796 179.366 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.799 HG23 ' O ' ' A' ' 50' ' ' GLU . 57.0 t -56.53 -39.19 60.56 Favored 'Isoleucine or valine' 0 C--O 1.231 0.112 0 CA-C-O 121.013 0.435 . . . . 0.0 109.906 179.085 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.935 ' CD1' HD13 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -56.66 -51.05 70.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.01 179.23 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.632 ' HB2' ' HB2' ' A' ' 108' ' ' MET . . . -62.34 -32.79 73.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.509 179.187 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.2 tp-100 -71.26 -52.29 19.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.012 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.443 ' OG1' HD23 ' A' ' 27' ' ' LEU . 2.2 m -60.15 -48.22 82.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.076 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.663 ' CG2' HD12 ' A' ' 117' ' ' LEU . 9.7 p -66.36 -44.79 90.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 C-N-CA 120.585 -0.446 . . . . 0.0 111.314 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.49 HD13 HD23 ' A' ' 103' ' ' LEU . 0.6 OUTLIER -54.21 -44.98 72.09 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 121.028 0.442 . . . . 0.0 110.208 179.774 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 42.3 m -63.11 -59.17 5.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.179 179.781 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' HIS . . . . . 0.709 ' HB3' HD21 ' A' ' 5' ' ' LEU . 0.6 OUTLIER -50.89 -49.45 59.36 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-O 120.861 0.362 . . . . 0.0 110.564 -179.951 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.961 HG22 ' HB2' ' A' ' 120' ' ' ALA . 73.5 t -58.13 -66.51 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.86 178.82 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.493 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 36.78 32.21 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.859 178.682 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.554 ' O ' HG22 ' A' ' 66' ' ' VAL . 9.8 t-20 155.29 -79.47 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 122.466 0.307 . . . . 0.0 110.759 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.957 ' CG1' HG13 ' A' ' 63' ' ' VAL . 15.9 m 46.68 -155.9 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 116.121 -0.491 . . . . 0.0 112.001 179.683 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.759 HG13 ' O ' ' A' ' 67' ' ' VAL . 8.1 p -172.93 60.96 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.112 0 CA-C-O 121.643 0.735 . . . . 0.0 111.017 -179.506 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.997 HD11 ' HB2' ' A' ' 100' ' ' LEU . 0.5 OUTLIER -42.62 99.05 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.101 -0.954 . . . . 0.0 112.465 -179.551 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 75.1 p -60.25 178.06 0.22 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.751 178.872 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.23 -31.96 1.72 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.996 0.427 . . . . 0.0 110.955 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.81 -64.34 0.88 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.502 179.667 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.641 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 69.0 m-20 -60.55 -27.85 67.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.363 179.611 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 20.3 m -62.62 -61.34 2.49 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.51 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.0 -26.14 61.99 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 177.622 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 1.076 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.4 OUTLIER -57.24 -64.06 1.01 Allowed 'General case' 0 C--O 1.235 0.306 0 CA-C-N 114.777 -1.101 . . . . 0.0 110.134 178.783 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 1.019 HD13 HD21 ' A' ' 90' ' ' LEU . 0.4 OUTLIER -57.96 -39.22 77.58 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.806 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -52.63 -43.73 65.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.798 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.46 -50.54 30.66 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.595 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' SER . . . . . 0.452 ' HB3' ' CG ' ' A' ' 111' ' ' GLN . 35.6 p -62.24 -26.55 68.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.635 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.703 HG22 ' O ' ' A' ' 76' ' ' LEU . 13.1 t . . . . . 0 C--N 1.33 -0.278 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -179.124 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' ASN . . . . . 0.488 ' HB2' ' O ' ' A' ' 103' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.533 0.296 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.506 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 3.3 m-85 -102.83 131.87 49.41 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 120.958 0.408 . . . . 0.0 111.208 -179.194 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.768 ' CG ' HG13 ' A' ' 101' ' ' VAL . 1.0 OUTLIER -109.22 144.28 37.54 Favored 'General case' 0 N--CA 1.435 -1.206 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 -179.445 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 1.019 HD21 HD13 ' A' ' 76' ' ' LEU . 39.7 mt -135.28 158.84 43.34 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -177.261 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.674 ' O ' ' CB ' ' A' ' 98' ' ' SER . 0.1 OUTLIER -134.16 161.32 35.22 Favored 'General case' 0 C--O 1.216 -0.659 0 CA-C-N 114.63 -1.168 . . . . 0.0 108.355 178.101 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.788 ' O ' HG13 ' A' ' 93' ' ' VAL . 17.9 p -103.96 157.93 16.76 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.82 0.819 . . . . 0.0 112.74 -178.832 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.788 HG13 ' O ' ' A' ' 92' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.435 -1.197 0 CA-C-N 113.87 -1.514 . . . . 0.0 108.089 -179.171 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.657 HD21 ' N ' ' A' ' 97' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.452 -0.354 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.674 ' CB ' ' O ' ' A' ' 91' ' ' ARG . 0.1 OUTLIER -140.41 165.34 27.68 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.184 0.516 . . . . 0.0 110.908 179.847 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.499 HG12 ' HB2' ' A' ' 91' ' ' ARG . 0.5 OUTLIER -104.14 150.68 7.13 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 115.361 -0.836 . . . . 0.0 108.869 179.562 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.997 ' HB2' HD11 ' A' ' 68' ' ' LEU . 3.2 tp -103.79 106.31 16.78 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 113.423 0.897 . . . . 0.0 113.423 -178.476 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.768 HG13 ' CG ' ' A' ' 89' ' ' ASP . 1.4 p -121.85 104.19 14.56 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.978 0 N-CA-C 104.007 -2.59 . . . . 0.0 104.007 174.623 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' SER . . . . . 0.581 ' O ' HD23 ' A' ' 103' ' ' LEU . 0.2 OUTLIER -149.87 161.31 42.53 Favored 'General case' 0 C--N 1.309 -1.194 0 C-N-CA 118.829 -1.148 . . . . 0.0 114.036 -173.841 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.581 HD23 ' O ' ' A' ' 102' ' ' SER . 0.1 OUTLIER 166.14 -69.48 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 113.478 -1.692 . . . . 0.0 112.278 175.343 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.552 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 35.14 56.18 0.79 Allowed 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.055 0.455 . . . . 0.0 110.228 179.6 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.552 ' CB ' ' O ' ' A' ' 104' ' ' ARG . 11.4 m 105.27 167.98 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.545 -177.579 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.426 ' HB3' ' CB ' ' A' ' 53' ' ' LYS . 0.5 OUTLIER -104.74 102.33 11.91 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.092 -0.643 . . . . 0.0 112.665 -178.545 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.822 ' OE1' ' HB2' ' A' ' 48' ' ' ALA . 0.9 OUTLIER -168.72 165.1 12.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.841 177.989 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.686 ' HB3' ' HB3' ' A' ' 55' ' ' PHE . 18.6 ttm -165.59 143.4 5.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.346 0.593 . . . . 0.0 112.286 178.668 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' THR . . . . . 0.737 HG22 ' O ' ' A' ' 39' ' ' PHE . 0.1 OUTLIER -104.38 165.11 11.27 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.027 -0.988 . . . . 0.0 109.078 178.287 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 1.0 HD23 HG23 ' A' ' 12' ' ' VAL . 7.0 mt -56.03 -52.87 62.7 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.665 0.269 . . . . 0.0 111.395 -179.369 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 111' ' ' GLN . . . . . 0.849 ' O ' HG23 ' A' ' 115' ' ' VAL . 3.4 tp-100 -50.45 -65.19 0.6 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.786 0.327 . . . . 0.0 110.642 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 0.893 ' O ' HD22 ' A' ' 116' ' ' LEU . 0.3 OUTLIER -47.71 -45.53 28.69 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.096 0.474 . . . . 0.0 110.895 179.898 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 0.845 ' HB1' ' CE1' ' A' ' 55' ' ' PHE . . . -49.42 -61.24 2.21 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.936 179.664 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.697 ' NZ ' HG22 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -66.36 -25.52 66.84 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.239 -179.982 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 1.076 HG22 ' CG ' ' A' ' 75' ' ' LYS . 76.6 t -58.36 -65.11 0.46 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.808 0 CA-C-O 121.991 0.9 . . . . 0.0 110.305 179.37 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.893 HD22 ' O ' ' A' ' 112' ' ' ASP . 0.0 OUTLIER -62.95 -40.98 99.3 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.645 -179.476 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.874 ' CD1' HD23 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -69.03 -22.41 64.05 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 120.792 0.33 . . . . 0.0 111.433 -179.763 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.594 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 30.8 tt0 -69.75 -49.51 52.4 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 106.008 -1.849 . . . . 0.0 106.008 177.324 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.657 ' O ' ' HB2' ' A' ' 123' ' ' GLN . . . -70.18 -28.27 65.18 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.081 177.384 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 0.961 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -72.05 -63.58 1.11 Allowed 'General case' 0 CA--C 1.511 -0.537 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.397 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.61 HD22 ' CG ' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -55.99 -42.35 76.23 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.314 -179.746 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.594 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.4 OUTLIER -67.37 -39.14 85.65 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.904 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.657 ' HB2' ' O ' ' A' ' 119' ' ' ALA . 1.7 mp0 -77.15 -36.73 54.99 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -178.711 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -96.17 -69.74 0.74 Allowed 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 -177.464 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 26.0 t . . . . . 0 N--CA 1.464 0.226 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -178.774 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.782 0.325 . . . . 0.0 110.815 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.898 HD11 ' HA ' ' A' ' 30' ' ' ASN . 1.2 mt -68.87 -81.56 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.062 0.458 . . . . 0.0 110.368 179.469 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.414 ' CB ' ' OD1' ' A' ' 7' ' ' ASP . 0.6 OUTLIER -170.12 -156.11 0.13 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.616 179.732 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 1.089 HD21 ' HB1' ' A' ' 120' ' ' ALA . 0.3 OUTLIER -95.71 -66.31 0.92 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.712 0.768 . . . . 0.0 112.429 -179.33 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.2 p -65.08 -41.14 95.31 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.549 -1.205 . . . . 0.0 112.87 -177.693 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ASP . . . . . 0.414 ' OD1' ' CB ' ' A' ' 4' ' ' SER . 0.1 OUTLIER -67.53 -48.21 67.67 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.23 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.887 HD23 HD21 ' A' ' 117' ' ' LEU . 18.2 tp -51.74 -46.58 64.09 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.927 178.738 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' HIS . . . . . 0.571 ' CG ' ' CD2' ' A' ' 121' ' ' LEU . 46.1 t-80 -65.06 -39.92 93.98 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.538 178.697 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.407 ' HB2' ' O ' ' A' ' 7' ' ' ASP . 0.1 OUTLIER -52.06 -53.14 45.79 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.258 -179.691 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.979 ' HG3' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -69.64 -55.38 10.2 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 120.885 -0.326 . . . . 0.0 111.566 -179.706 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.687 HG23 HG21 ' A' ' 31' ' ' VAL . 2.4 p -55.82 -46.82 80.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 CA-C-O 120.973 0.416 . . . . 0.0 111.244 -179.814 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.805 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 56.0 p -60.96 -53.32 58.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.309 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.48 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 0.6 OUTLIER -60.73 -21.09 62.59 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.823 0.344 . . . . 0.0 110.445 -179.916 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.61 HD12 ' O ' ' A' ' 11' ' ' GLN . 4.8 mt -78.11 -65.54 0.96 Allowed 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 112.74 0.645 . . . . 0.0 112.74 -179.247 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.655 HG23 HD13 ' A' ' 110' ' ' LEU . 0.9 OUTLIER -72.49 -26.75 24.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.526 -0.47 . . . . 0.0 111.662 -178.863 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.457 ' HB2' ' O ' ' A' ' 13' ' ' SER . 3.5 mm100 -70.54 -21.86 62.67 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.461 -0.495 . . . . 0.0 110.326 179.639 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.48 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 2.1 pt20 -165.99 63.33 0.11 Allowed 'General case' 0 CA--C 1.528 0.113 0 CA-C-O 120.75 0.31 . . . . 0.0 111.318 179.376 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 175.53 -57.72 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.537 179.779 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.591 ' CB ' HD13 ' A' ' 110' ' ' LEU . 63.5 m -85.51 -39.63 17.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.647 -179.179 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 59.53 69.23 1.34 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.45 -0.881 . . . . 0.0 111.969 -179.447 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.42 ' N ' HG22 ' A' ' 16' ' ' VAL . 0.0 OUTLIER 58.77 88.7 0.06 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.977 0.418 . . . . 0.0 110.7 -179.635 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 23' ' ' CYS . . . . . 0.449 ' HB2' ' HB3' ' A' ' 20' ' ' SER . 97.1 m -149.79 -162.91 1.66 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.962 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.774 ' CG2' HG22 ' A' ' 109' ' ' THR . 0.0 OUTLIER -104.46 147.96 26.99 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.713 -179.923 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -104.99 140.6 15.07 Favored Glycine 0 N--CA 1.443 -0.834 0 C-N-CA 120.282 -0.961 . . . . 0.0 113.386 -178.76 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.963 ' HB3' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -104.45 121.77 44.13 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 178.967 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.772 HD22 HG12 ' A' ' 54' ' ' VAL . 8.7 tt -104.6 149.04 25.86 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.327 0.584 . . . . 0.0 112.243 -178.762 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 162.33 55.76 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.383 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.716 ' O ' HD21 ' A' ' 3' ' ' LEU . . . 90.61 -8.1 80.32 Favored Glycine 0 C--N 1.332 0.336 0 N-CA-C 111.355 -0.698 . . . . 0.0 111.355 -178.153 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.898 ' HA ' HD11 ' A' ' 3' ' ' LEU . 0.1 OUTLIER -165.92 162.97 18.54 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 179.815 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.979 HG12 ' HG3' ' A' ' 11' ' ' GLN . 7.4 p -104.7 133.58 48.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 121.482 0.658 . . . . 0.0 110.784 178.928 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.963 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . . . -113.22 166.38 11.51 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.657 -179.699 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.529 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -102.14 105.95 16.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.617 0.722 . . . . 0.0 110.573 -179.442 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -91.47 114.35 26.85 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.604 -1.18 . . . . 0.0 111.321 -179.015 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -131.08 40.22 3.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.558 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -110.93 -38.89 4.97 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.589 -179.383 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.809 ' O ' HG23 ' A' ' 38' ' ' THR . 89.5 m -122.51 -106.44 0.36 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.511 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.809 HG23 ' O ' ' A' ' 37' ' ' THR . 0.7 OUTLIER -174.44 -49.1 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 113.037 0.754 . . . . 0.0 113.037 179.933 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.639 ' O ' ' O ' ' A' ' 38' ' ' THR . 0.9 OUTLIER 45.1 122.38 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.879 0.847 . . . . 0.0 110.977 -177.72 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLN . . . . . 0.452 ' OE1' HD12 ' A' ' 42' ' ' LEU . 0.0 OUTLIER -128.61 40.38 3.66 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.0 -178.998 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.622 ' C ' ' HB2' ' A' ' 107' ' ' GLN . . . 90.24 8.53 66.37 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 115.396 -0.82 . . . . 0.0 113.112 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.784 ' HB3' ' NE2' ' A' ' 107' ' ' GLN . 0.3 OUTLIER -49.41 -166.58 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 117.04 0.42 . . . . 0.0 111.364 179.311 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.674 ' C ' HD12 ' A' ' 44' ' ' ILE . 1.5 m -132.58 24.17 4.38 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -179.748 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.809 ' HA ' ' HB3' ' A' ' 48' ' ' ALA . 1.3 mp 67.4 2.89 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 179.627 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.74 -32.51 60.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.847 0.356 . . . . 0.0 111.011 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.551 ' CB ' HD21 ' A' ' 42' ' ' LEU . 7.8 t -82.06 -62.64 1.57 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.095 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -175.07 32.54 0.09 OUTLIER Glycine 0 C--N 1.331 0.281 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.997 -179.891 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.809 ' HB3' ' HA ' ' A' ' 44' ' ' ILE . . . -83.7 -163.95 0.84 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.073 0.463 . . . . 0.0 111.64 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -130.79 -178.31 4.74 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.134 179.528 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.647 ' O ' HG23 ' A' ' 54' ' ' VAL . 2.4 mp0 -83.03 -27.88 30.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.91 0.386 . . . . 0.0 110.842 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' SER . . . . . 0.437 ' CB ' ' HG2' ' A' ' 26' ' ' LYS . 1.5 m -55.41 -65.14 0.64 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.743 -179.724 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.682 ' OE1' HG22 ' A' ' 24' ' ' THR . 31.2 mm-40 -49.39 -67.38 0.27 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.901 0.381 . . . . 0.0 111.641 -179.08 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.604 ' CB ' HD11 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -40.54 -54.38 2.52 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.917 179.147 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.772 HG12 HD22 ' A' ' 27' ' ' LEU . 77.3 t -58.09 -44.83 88.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.806 179.178 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.621 ' HA ' HD13 ' A' ' 27' ' ' LEU . 0.5 OUTLIER -55.31 -33.49 63.34 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.488 178.995 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.537 ' HB1' HD11 ' A' ' 60' ' ' LEU . . . -64.17 -65.2 0.71 Allowed 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 177.837 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLN . . . . . 0.437 ' HA ' HD12 ' A' ' 60' ' ' LEU . 3.7 mm-40 -37.46 -47.64 0.9 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.652 179.753 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.429 HG21 HD11 ' A' ' 27' ' ' LEU . 68.8 p -67.27 -46.56 73.29 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -179.208 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.996 HG23 HD12 ' A' ' 117' ' ' LEU . 11.9 p -72.23 -28.21 28.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -178.183 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 1.025 HD13 HD21 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -92.97 -21.38 19.81 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 120.201 -0.599 . . . . 0.0 110.525 179.486 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.407 ' CB ' ' O ' ' A' ' 57' ' ' GLN . 44.7 m -79.82 -42.9 23.42 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 178.259 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -61.96 -49.2 77.06 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.873 179.353 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 0.974 HG12 HG11 ' A' ' 66' ' ' VAL . 2.8 m -58.23 -60.64 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.035 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.599 ' H ' HG23 ' A' ' 63' ' ' VAL . . . 40.36 28.66 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.237 -0.438 . . . . 0.0 112.06 179.659 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.604 ' O ' HG22 ' A' ' 66' ' ' VAL . 0.9 OUTLIER 159.19 -80.26 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 120.724 0.297 . . . . 0.0 111.697 -179.679 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.974 HG11 HG12 ' A' ' 63' ' ' VAL . 23.0 m 49.98 -158.85 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.95 -179.142 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.923 HG22 ' HB3' ' A' ' 97' ' ' ASN . 4.5 p -163.92 87.28 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 121.597 0.713 . . . . 0.0 109.777 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.843 HD23 ' HB3' ' A' ' 72' ' ' ASP . 1.1 mp -80.87 112.73 18.52 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.66 -177.882 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.609 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 2.3 p -89.97 -177.18 5.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.52 179.033 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.449 ' HA ' ' OG1' ' A' ' 73' ' ' THR . 0.0 OUTLIER -34.67 -39.06 0.08 Allowed 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.018 -179.312 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -69.27 -65.35 0.72 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.406 -179.435 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.843 ' HB3' HD23 ' A' ' 68' ' ' LEU . 0.7 OUTLIER -60.57 -30.91 70.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.685 -179.902 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.547 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 1.5 p -61.86 -64.32 0.97 Allowed 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 178.247 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -53.23 -25.84 15.69 Favored 'General case' 0 N--CA 1.456 -0.163 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.422 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 1.077 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.1 OUTLIER -58.92 -56.33 23.66 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.187 178.765 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.871 HD13 HD11 ' A' ' 90' ' ' LEU . 1.3 mp -63.47 -47.91 79.85 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 178.921 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' A' ' 73' ' ' THR . 4.9 mt -58.61 -29.68 66.67 Favored 'General case' 0 N--CA 1.461 0.097 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.355 179.406 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -72.72 -47.66 45.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.533 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 22.0 p -59.06 -38.76 80.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.697 179.801 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.432 HG22 ' HA ' ' A' ' 77' ' ' LEU . 15.3 t . . . . . 0 C--N 1.331 -0.23 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.281 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' ASN . . . . . 0.541 ' OD1' ' HA3' ' A' ' 41' ' ' GLY . 0.4 OUTLIER . . . . . 0 C--O 1.244 0.804 0 CA-C-O 121.703 0.763 . . . . 0.0 110.387 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.579 ' HA ' ' HB3' ' A' ' 102' ' ' SER . 4.7 m-85 -101.96 152.23 21.19 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.457 -179.85 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.721 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.2 OUTLIER -124.34 143.93 50.3 Favored 'General case' 0 N--CA 1.443 -0.813 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 -179.353 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.871 HD11 HD13 ' A' ' 76' ' ' LEU . 11.8 mt -133.02 151.96 52.01 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -177.232 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.636 ' O ' ' CB ' ' A' ' 98' ' ' SER . 0.0 OUTLIER -134.19 159.43 40.94 Favored 'General case' 0 C--O 1.218 -0.575 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.048 178.291 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.788 ' O ' HG13 ' A' ' 93' ' ' VAL . 0.7 OUTLIER -103.98 160.95 14.39 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.738 0.78 . . . . 0.0 112.56 -178.882 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.788 HG13 ' O ' ' A' ' 92' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.441 -0.891 0 CA-C-N 113.992 -1.458 . . . . 0.0 108.5 -179.215 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.923 ' HB3' HG22 ' A' ' 67' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.393 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.636 ' CB ' ' O ' ' A' ' 91' ' ' ARG . 0.1 OUTLIER -141.85 163.95 31.52 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.278 0.561 . . . . 0.0 110.941 -179.811 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.57 HG12 ' HB2' ' A' ' 91' ' ' ARG . 0.4 OUTLIER -104.72 151.65 7.04 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.825 179.782 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.838 HD21 HD11 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -104.13 105.85 16.16 Favored 'General case' 0 CA--C 1.509 -0.602 0 CA-C-O 121.68 0.752 . . . . 0.0 112.439 -179.684 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.721 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 43.6 t -122.15 105.67 16.65 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.978 0 N-CA-C 105.348 -2.093 . . . . 0.0 105.348 175.761 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' SER . . . . . 0.745 ' O ' HD23 ' A' ' 103' ' ' LEU . 73.7 m -146.37 153.3 40.34 Favored 'General case' 0 C--N 1.309 -1.157 0 C-N-CA 119.256 -0.978 . . . . 0.0 113.051 -175.427 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 1.025 HD21 HD13 ' A' ' 60' ' ' LEU . 1.2 mm? 144.19 67.21 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 114.612 -1.176 . . . . 0.0 112.643 176.7 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.526 ' CB ' ' HB2' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -101.85 21.31 14.82 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 114.686 -1.143 . . . . 0.0 108.012 177.023 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.581 ' CB ' ' O ' ' A' ' 41' ' ' GLY . 4.3 m 159.02 160.32 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 -179.003 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.436 ' C ' ' O ' ' A' ' 42' ' ' LEU . 0.4 OUTLIER -104.79 102.85 12.39 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 -177.168 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.784 ' NE2' ' HB3' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -168.39 162.66 12.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.289 177.278 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.876 ' SD ' HG11 ' A' ' 59' ' ' VAL . 0.0 OUTLIER -165.38 126.06 1.9 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.27 0.557 . . . . 0.0 112.067 179.95 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 109' ' ' THR . . . . . 0.774 HG22 ' CG2' ' A' ' 24' ' ' THR . 4.7 p -103.0 162.73 12.69 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.558 -179.638 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.655 HD13 HG23 ' A' ' 16' ' ' VAL . 1.0 OUTLIER -39.34 -64.85 0.43 Allowed 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.293 -179.576 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 111' ' ' GLN . . . . . 0.872 ' O ' HG23 ' A' ' 115' ' ' VAL . 3.6 tp-100 -43.69 -64.35 0.67 Allowed 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.278 179.653 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -44.19 -41.75 5.98 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 121.232 0.539 . . . . 0.0 110.597 179.569 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 0.802 ' HB2' ' HE1' ' A' ' 108' ' ' MET . . . -60.07 -65.09 0.74 Allowed 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.494 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.805 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.2 OUTLIER -55.88 -25.56 43.07 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.967 179.611 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 1.077 HG22 ' CG ' ' A' ' 75' ' ' LYS . 72.7 t -65.36 -64.62 0.68 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.739 0 CA-C-O 121.657 0.741 . . . . 0.0 110.728 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.838 HD11 HD21 ' A' ' 100' ' ' LEU . 9.8 mp -63.86 -30.74 71.8 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.448 -179.591 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.996 HD12 HG23 ' A' ' 59' ' ' VAL . 2.1 mp -79.07 -26.4 43.04 Favored 'General case' 0 CA--C 1.511 -0.535 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.256 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.554 ' HB2' ' O ' ' A' ' 114' ' ' LYS . 0.8 OUTLIER -66.38 -48.35 70.43 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 177.278 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.44 ' HB2' ' OD2' ' A' ' 72' ' ' ASP . . . -74.6 -25.35 59.19 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 114.992 -1.004 . . . . 0.0 109.695 177.1 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 1.089 ' HB1' HD21 ' A' ' 5' ' ' LEU . . . -68.73 -60.17 2.59 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.469 179.496 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.822 HD23 ' O ' ' A' ' 117' ' ' LEU . 1.0 OUTLIER -65.51 -33.77 76.71 Favored 'General case' 0 N--CA 1.444 -0.748 0 C-N-CA 120.202 -0.599 . . . . 0.0 109.695 179.638 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.549 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.1 OUTLIER -58.45 -46.47 86.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.828 179.494 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.619 ' HB2' HG12 ' A' ' 67' ' ' VAL . 2.4 tt0 -94.53 -29.82 14.71 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 113.769 1.025 . . . . 0.0 113.769 -177.769 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 124' ' ' GLU . . . . . 0.425 ' HB2' HD13 ' A' ' 5' ' ' LEU . 0.8 OUTLIER -96.42 -68.38 0.8 Allowed 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -177.399 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 6.0 p . . . . . 0 C--N 1.329 -0.325 0 N-CA-C 113.005 0.742 . . . . 0.0 113.005 -177.503 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' ASN . . . . . 0.547 ' HB2' HD21 ' A' ' 27' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.869 0.366 . . . . 0.0 110.899 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 3' ' ' LEU . . . . . 0.989 HD11 ' HB2' ' A' ' 8' ' ' LEU . 4.1 pp -68.89 -172.84 0.42 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.447 179.691 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' SER . . . . . 0.488 ' O ' HD12 ' A' ' 3' ' ' LEU . 0.1 OUTLIER -63.97 130.72 45.21 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.135 0.493 . . . . 0.0 112.03 -179.035 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 1.049 HD21 ' HB1' ' A' ' 120' ' ' ALA . 0.1 OUTLIER -51.08 -65.74 0.5 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.025 -179.939 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -48.96 -30.12 5.6 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.59 0.234 . . . . 0.0 111.418 -179.244 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ASP . . . . . 0.536 ' O ' ' HB3' ' A' ' 11' ' ' GLN . 0.9 OUTLIER -73.39 -44.83 57.66 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.046 0.45 . . . . 0.0 109.973 179.385 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.989 ' HB2' HD11 ' A' ' 3' ' ' LEU . 1.5 tp -73.8 -30.57 62.8 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.964 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' HIS . . . . . 0.771 ' CG ' HD22 ' A' ' 121' ' ' LEU . 4.4 t-80 -68.25 -54.3 18.59 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 121.677 0.751 . . . . 0.0 109.214 179.656 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.521 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 0.6 OUTLIER -63.57 -36.89 85.29 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 114.584 -1.189 . . . . 0.0 108.988 179.164 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.992 ' HG2' HG13 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -60.49 -65.47 0.68 Allowed 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.917 178.477 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 12' ' ' VAL . . . . . 0.978 HG12 ' O ' ' A' ' 8' ' ' LEU . 5.7 p -56.69 -51.99 59.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.809 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.515 ' O ' ' HB2' ' A' ' 17' ' ' GLN . 2.5 p -63.49 -27.3 69.18 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.224 -179.388 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.521 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -76.81 -41.03 45.94 Favored 'General case' 0 CA--C 1.514 -0.405 0 C-N-CA 120.281 -0.568 . . . . 0.0 111.344 -179.02 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.718 HD12 ' HA ' ' A' ' 12' ' ' VAL . 0.1 OUTLIER -68.67 -53.2 23.74 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 119.707 -0.797 . . . . 0.0 110.043 179.627 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 16' ' ' VAL . . . . . 0.725 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 10.4 p -65.47 -47.84 85.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.75 -178.483 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLN . . . . . 0.522 ' N ' HG13 ' A' ' 16' ' ' VAL . 1.0 OUTLIER -61.76 -18.65 60.64 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.169 -0.612 . . . . 0.0 110.964 -179.783 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLN . . . . . 0.415 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 1.5 pt20 -158.84 61.65 0.42 Allowed 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 120.73 -0.388 . . . . 0.0 111.869 179.557 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.476 ' N ' ' O ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER 169.87 -44.59 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.331 179.339 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.773 ' CB ' HD13 ' A' ' 110' ' ' LEU . 14.7 m -105.69 -28.41 10.72 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.387 -179.39 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLY . . . . . 0.405 ' O ' HG22 ' A' ' 16' ' ' VAL . . . 79.41 -59.7 4.35 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.245 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -173.55 21.77 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 120.617 0.246 . . . . 0.0 111.227 179.712 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -61.09 -156.81 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.736 -179.924 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.74 HG21 ' CD2' ' A' ' 39' ' ' PHE . 0.3 OUTLIER -103.56 149.78 24.56 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 179.854 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -105.0 128.54 9.48 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.448 -0.882 . . . . 0.0 113.224 -179.009 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.885 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -104.6 129.19 52.73 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 178.884 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.638 HD12 ' CD2' ' A' ' 55' ' ' PHE . 0.3 OUTLIER -104.14 165.63 10.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.545 -179.024 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.564 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER 144.97 50.16 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.488 1.115 . . . . 0.0 109.949 179.891 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.583 ' C ' HD23 ' A' ' 3' ' ' LEU . . . 93.7 -9.61 73.38 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 120.912 -0.661 . . . . 0.0 111.67 -179.1 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -165.58 156.17 13.44 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.992 HG13 ' HG2' ' A' ' 11' ' ' GLN . 0.6 OUTLIER -109.5 132.18 58.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 C-N-CA 119.785 -0.766 . . . . 0.0 111.237 179.727 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.885 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -117.41 166.96 11.71 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.869 -1.059 . . . . 0.0 110.859 -179.406 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.633 ' HB2' ' OG ' ' A' ' 20' ' ' SER . . . -103.28 119.49 38.97 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.16 0.505 . . . . 0.0 111.3 -179.393 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.636 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 8.3 t30 -100.0 137.02 39.03 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.73 -179.728 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.7 ttmp? -121.9 9.9 10.1 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.51 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.63 -61.02 2.58 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 120.963 0.411 . . . . 0.0 110.428 179.709 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.543 HG23 ' CE1' ' A' ' 39' ' ' PHE . 0.1 OUTLIER -137.04 -78.94 0.39 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.264 179.339 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.774 ' O ' HG22 ' A' ' 109' ' ' THR . 9.3 t 176.03 -41.95 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.059 0.457 . . . . 0.0 111.352 179.727 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.74 ' CD2' HG21 ' A' ' 24' ' ' THR . 9.0 m-85 59.52 135.68 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.798 0.809 . . . . 0.0 111.498 -178.966 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -169.41 76.61 0.1 Allowed 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.586 -1.188 . . . . 0.0 108.835 179.645 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLY . . . . . 0.468 ' C ' ' HB2' ' A' ' 105' ' ' SER . . . 69.37 106.04 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.615 0 CA-C-N 115.353 -0.839 . . . . 0.0 112.696 -178.926 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.643 ' N ' ' HB3' ' A' ' 105' ' ' SER . 5.3 tp -159.01 -141.77 0.09 Allowed 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 178.798 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -162.72 25.62 0.1 Allowed 'General case' 0 C--N 1.33 -0.241 0 O-C-N 122.204 -0.31 . . . . 0.0 111.693 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.887 HG23 ' O ' ' A' ' 48' ' ' ALA . 29.4 mt 63.36 5.04 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 179.576 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -87.18 -55.55 3.76 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.801 0.334 . . . . 0.0 111.474 -179.441 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.74 -28.34 61.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.152 -179.627 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.14 80.19 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.196 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.887 ' O ' HG23 ' A' ' 44' ' ' ILE . . . -151.52 132.5 14.26 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.714 0.292 . . . . 0.0 111.21 -179.634 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.2 mtt-85 -68.14 -177.18 0.81 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.745 0.307 . . . . 0.0 110.398 179.232 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.886 ' O ' HG23 ' A' ' 54' ' ' VAL . 0.9 OUTLIER -87.8 -35.92 17.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.001 0.429 . . . . 0.0 110.766 179.821 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 51' ' ' SER . . . . . 0.607 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 18.2 p -56.05 -62.78 1.47 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.171 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.865 ' OE1' ' HB1' ' A' ' 48' ' ' ALA . 0.0 OUTLIER -34.72 -67.08 0.15 Allowed 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.882 -179.811 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.641 ' HD2' HD11 ' A' ' 44' ' ' ILE . 2.7 ptpt -56.87 -46.75 81.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.418 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.886 HG23 ' O ' ' A' ' 50' ' ' GLU . 97.8 t -54.7 -41.32 55.39 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-O 121.046 0.45 . . . . 0.0 110.038 179.439 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.851 ' CZ ' ' HB1' ' A' ' 113' ' ' ALA . 1.9 t80 -61.63 -49.75 75.34 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.872 178.992 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.525 ' HB2' ' HB2' ' A' ' 108' ' ' MET . . . -50.44 -48.06 56.49 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.108 179.805 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -62.25 -47.02 86.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.639 179.581 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' THR . . . . . 0.564 HG21 HD22 ' A' ' 27' ' ' LEU . 24.0 p -63.7 -49.5 72.87 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.378 -179.696 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' VAL . . . . . 0.96 ' O ' HG23 ' A' ' 63' ' ' VAL . 14.0 p -65.67 -48.89 80.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.786 179.76 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.684 HD22 ' HG ' ' A' ' 103' ' ' LEU . 13.1 tp -50.25 -49.9 51.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.725 0.298 . . . . 0.0 110.774 179.588 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.6 m -63.93 -41.81 97.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.736 179.624 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' HIS . . . . . 0.587 ' HB3' HD22 ' A' ' 5' ' ' LEU . 0.1 OUTLIER -68.21 -20.86 64.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.961 179.756 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 63' ' ' VAL . . . . . 1.041 HG13 HG11 ' A' ' 66' ' ' VAL . 4.6 t -105.01 37.81 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.061 0.458 . . . . 0.0 111.121 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.484 ' O ' ' HB2' ' A' ' 65' ' ' ASN . . . -65.64 91.23 0.13 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.677 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.769 ' O ' HG22 ' A' ' 99' ' ' VAL . 10.0 m120 93.28 -61.11 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.679 -0.691 . . . . 0.0 112.22 179.514 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 1.041 HG11 HG13 ' A' ' 63' ' ' VAL . 33.7 m 39.03 -140.08 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -179.387 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' VAL . . . . . 0.851 HG22 ' CB ' ' A' ' 97' ' ' ASN . 4.6 p -175.62 67.42 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 CA-C-O 121.71 0.767 . . . . 0.0 111.215 179.63 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.791 HD23 ' HB3' ' A' ' 72' ' ' ASP . 2.4 mp -62.66 103.69 0.45 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.86 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.872 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 0.6 OUTLIER -78.42 -177.88 5.48 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.642 179.278 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.34 -37.42 0.19 Allowed 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.3 -179.257 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.526 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 2.5 tt0 -66.12 -65.43 0.68 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.987 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.791 ' HB3' HD23 ' A' ' 68' ' ' LEU . 82.3 m-20 -60.3 -28.09 67.83 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.087 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 36.5 m -64.0 -64.06 0.99 Allowed 'General case' 0 C--O 1.239 0.516 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 178.949 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.499 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . . . -56.68 -25.11 53.13 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 108.787 -0.819 . . . . 0.0 108.787 177.407 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 1.083 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.3 OUTLIER -59.35 -54.63 44.55 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 114.733 -1.121 . . . . 0.0 110.224 178.743 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.934 HD21 HD11 ' A' ' 116' ' ' LEU . 1.9 mt -64.49 -48.04 76.71 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.838 0.352 . . . . 0.0 110.181 179.272 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.641 HD12 ' C ' ' A' ' 77' ' ' LEU . 0.4 OUTLIER -63.83 -23.62 67.43 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.034 -179.765 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -78.37 -47.83 16.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.833 0.349 . . . . 0.0 110.883 179.792 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -64.6 -33.75 76.65 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.184 179.692 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' THR . . . . . 0.432 ' CG2' ' CD2' ' A' ' 88' ' ' TYR . 11.4 p . . . . . 0 C--N 1.327 -0.39 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.943 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' ASN . . . . . 0.518 ' HA ' ' HB2' ' A' ' 104' ' ' ARG . 2.2 p-10 . . . . . 0 C--O 1.243 0.738 0 CA-C-O 120.871 0.367 . . . . 0.0 111.968 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' TYR . . . . . 0.533 ' HA ' ' CB ' ' A' ' 102' ' ' SER . 1.3 m-85 -99.79 135.62 40.94 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 120.435 -0.506 . . . . 0.0 110.447 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.763 ' CG ' HG13 ' A' ' 101' ' ' VAL . 0.7 OUTLIER -107.47 142.44 37.33 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 -179.93 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.592 HD21 HD13 ' A' ' 76' ' ' LEU . 11.1 mt -132.23 147.24 52.4 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 113.337 0.865 . . . . 0.0 113.337 -176.92 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.47 127.81 34.09 Favored 'General case' 0 C--O 1.224 -0.261 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 177.845 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' SER . . . . . 0.715 ' O ' HG13 ' A' ' 93' ' ' VAL . 0.7 OUTLIER -104.39 145.95 29.53 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 113.955 1.094 . . . . 0.0 113.955 -177.428 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 93' ' ' VAL . . . . . 0.715 HG13 ' O ' ' A' ' 92' ' ' SER . 4.9 m . . . . . 0 CA--C 1.542 0.644 0 CA-C-N 113.691 -1.595 . . . . 0.0 108.558 179.09 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.872 ' HA ' ' HA ' ' A' ' 69' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.448 -0.552 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' SER . . . . . 0.531 ' O ' ' N ' ' A' ' 68' ' ' LEU . 3.1 t -140.19 163.02 33.85 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.482 0.658 . . . . 0.0 111.32 -179.517 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' VAL . . . . . 0.769 HG22 ' O ' ' A' ' 65' ' ' ASN . 1.2 t -107.45 146.23 13.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-N 115.04 -0.982 . . . . 0.0 108.74 178.912 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.567 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.1 OUTLIER -103.87 114.36 28.56 Favored 'General case' 0 CA--C 1.513 -0.454 0 C-N-CA 119.766 -0.774 . . . . 0.0 112.136 -179.662 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 101' ' ' VAL . . . . . 0.763 HG13 ' CG ' ' A' ' 89' ' ' ASP . 0.9 OUTLIER -120.36 104.19 15.1 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.015 0 N-CA-C 104.288 -2.486 . . . . 0.0 104.288 175.453 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 102' ' ' SER . . . . . 0.628 ' O ' HD23 ' A' ' 103' ' ' LEU . 0.9 OUTLIER -141.39 152.51 44.39 Favored 'General case' 0 C--N 1.307 -1.263 0 C-N-CA 119.807 -0.757 . . . . 0.0 112.713 -174.907 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 103' ' ' LEU . . . . . 0.684 ' HG ' HD22 ' A' ' 60' ' ' LEU . 0.4 OUTLIER 147.7 59.66 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 114.506 -1.224 . . . . 0.0 112.441 176.529 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 104' ' ' ARG . . . . . 0.518 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -83.86 -6.38 59.41 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.308 -0.86 . . . . 0.0 108.739 177.434 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.643 ' HB3' ' N ' ' A' ' 42' ' ' LEU . 58.7 m -177.92 171.92 1.72 Allowed 'General case' 0 C--O 1.232 0.147 0 CA-C-N 114.553 -1.203 . . . . 0.0 108.105 179.258 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ASP . . . . . 0.555 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -104.74 101.88 11.48 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 119.693 -0.803 . . . . 0.0 112.754 -178.492 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 107' ' ' GLN . . . . . 0.616 ' NE2' ' HB2' ' A' ' 48' ' ' ALA . 4.4 mt-30 -169.76 162.99 9.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.273 177.534 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 108' ' ' MET . . . . . 0.603 ' HE2' ' HB3' ' A' ' 112' ' ' ASP . 0.3 OUTLIER -165.77 144.15 5.94 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.426 -0.51 . . . . 0.0 112.142 179.005 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 109' ' ' THR . . . . . 0.774 HG22 ' O ' ' A' ' 38' ' ' THR . 30.2 p -110.11 165.29 11.86 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.719 179.362 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 110' ' ' LEU . . . . . 0.791 HD23 HG23 ' A' ' 12' ' ' VAL . 6.5 mt -52.46 -59.18 4.74 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.584 179.615 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 111' ' ' GLN . . . . . 0.835 ' O ' HG23 ' A' ' 115' ' ' VAL . 2.0 tp-100 -47.67 -65.48 0.56 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.817 0.342 . . . . 0.0 110.634 179.577 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 112' ' ' ASP . . . . . 0.92 ' O ' HD22 ' A' ' 116' ' ' LEU . 16.5 m-20 -46.63 -45.98 19.49 Favored 'General case' 0 C--O 1.236 0.395 0 CA-C-O 121.477 0.656 . . . . 0.0 110.429 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 113' ' ' ALA . . . . . 0.851 ' HB1' ' CZ ' ' A' ' 55' ' ' PHE . . . -51.65 -63.32 1.17 Allowed 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.35 179.256 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 114' ' ' LYS . . . . . 0.572 ' HE3' ' CG1' ' A' ' 16' ' ' VAL . 0.0 OUTLIER -62.04 -20.05 63.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.281 179.902 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 1.083 HG22 ' CG ' ' A' ' 75' ' ' LYS . 74.2 t -65.06 -65.11 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.886 0 CA-C-O 122.013 0.911 . . . . 0.0 109.967 179.399 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 116' ' ' LEU . . . . . 0.955 ' HB3' HG21 ' A' ' 63' ' ' VAL . 0.1 OUTLIER -61.62 -35.58 78.29 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.399 179.693 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 117' ' ' LEU . . . . . 0.916 HD21 HD23 ' A' ' 8' ' ' LEU . 0.3 OUTLIER -70.51 -24.24 62.8 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.9 179.36 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 118' ' ' GLU . . . . . 0.539 ' HA ' ' CD2' ' A' ' 9' ' ' HIS . 1.7 tt0 -69.35 -46.85 66.02 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 106.741 -1.578 . . . . 0.0 106.741 177.954 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 119' ' ' ALA . . . . . 0.495 ' CB ' ' HG ' ' A' ' 68' ' ' LEU . . . -77.52 -22.18 51.57 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 114.695 -1.139 . . . . 0.0 110.236 177.651 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 120' ' ' ALA . . . . . 1.049 ' HB1' HD21 ' A' ' 5' ' ' LEU . . . -75.06 -56.71 4.46 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.78 179.471 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 121' ' ' LEU . . . . . 0.771 HD22 ' CG ' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -60.8 -37.43 81.93 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 178.208 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 122' ' ' ARG . . . . . 0.5 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.5 OUTLIER -60.99 -46.37 91.04 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.356 179.97 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.615 ' CG ' HG12 ' A' ' 67' ' ' VAL . 8.4 mm-40 -95.29 -19.5 19.93 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -177.762 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 124' ' ' GLU . . . . . 0.445 ' CG ' ' O ' ' A' ' 120' ' ' ALA . 2.9 mm-40 -95.32 -66.62 0.9 Allowed 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.867 0.691 . . . . 0.0 112.867 -178.393 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 1.2 p . . . . . 0 C--N 1.326 -0.425 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -178.172 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.5 mtm . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.853 0.359 . . . . 0.0 111.182 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.423 ' HB3' ' CG2' ' A' ' 58' ' ' THR . 0.0 OUTLIER -161.36 -163.71 1.04 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.918 -179.883 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.798 HD11 ' N ' ' A' ' 30' ' ' ASN . 5.1 mp -73.1 172.89 10.21 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.909 0.385 . . . . 0.0 110.497 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.4 p -88.62 135.68 33.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.077 179.157 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.532 HD21 ' HB3' ' A' ' 62' ' ' HIS . 2.9 mt -37.4 -62.02 0.55 Allowed 'General case' 0 CA--C 1.504 -0.792 0 CA-C-O 121.434 0.635 . . . . 0.0 111.712 -179.621 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.411 ' HB3' ' HG2' ' A' ' 128' ' ' ARG . 0.2 OUTLIER -40.44 -65.01 0.45 Allowed 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 114.553 -1.203 . . . . 0.0 111.378 -179.192 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ASP . . . . . 0.543 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 0.7 OUTLIER -61.63 -44.57 96.74 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.982 0.42 . . . . 0.0 109.95 178.873 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.867 ' HB3' HD22 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -45.41 -65.0 0.6 Allowed 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.791 178.87 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.66 ' CB ' HD22 ' A' ' 121' ' ' LEU . 15.4 t-80 -52.77 -39.87 62.64 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.603 178.601 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.543 ' HB2' ' O ' ' A' ' 7' ' ' ASP . 8.3 mmt180 -56.94 -62.48 1.71 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.846 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.757 ' HG3' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -64.75 -53.26 49.93 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 120.299 -0.561 . . . . 0.0 111.168 179.894 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.924 ' O ' HG23 ' A' ' 16' ' ' VAL . 8.1 p -53.96 -51.07 49.12 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 C-N-CA 120.63 -0.428 . . . . 0.0 111.343 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.584 ' HA ' ' CE ' ' A' ' 114' ' ' LYS . 21.6 t -63.68 -31.19 72.28 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -179.552 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 20.0 tpp180 -70.99 -35.3 72.05 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 120.236 -0.585 . . . . 0.0 110.966 -178.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.776 HD12 ' HA ' ' A' ' 12' ' ' VAL . 0.1 OUTLIER -75.35 -52.66 10.28 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 119.974 -0.691 . . . . 0.0 110.593 179.841 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.924 HG23 ' O ' ' A' ' 12' ' ' VAL . 1.8 t -60.81 -55.14 26.6 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.96 -179.367 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -61.02 -17.83 54.37 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -178.215 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 15.9 pt20 -170.39 71.44 0.06 Allowed 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.527 -0.469 . . . . 0.0 111.977 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.479 ' HB2' ' HA ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER 170.3 -38.18 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.117 179.382 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.414 ' N ' ' O ' ' A' ' 15' ' ' LEU . 70.1 m -115.33 -24.03 8.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.54 -179.362 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 56.66 55.34 30.45 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.457 -0.877 . . . . 0.0 111.945 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.417 ' HA ' ' CG1' ' A' ' 16' ' ' VAL . 0.3 OUTLIER 59.97 82.9 0.14 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.136 0.493 . . . . 0.0 110.768 -179.544 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.421 ' O ' ' HB ' ' A' ' 109' ' ' THR . 0.1 OUTLIER -133.97 -151.9 0.46 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.703 179.851 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.671 ' HB ' ' HB3' ' A' ' 34' ' ' ASN . 0.2 OUTLIER -103.9 134.37 47.31 Favored 'General case' 0 CA--C 1.52 -0.184 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.179 179.609 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.406 ' CA ' ' HG ' ' A' ' 110' ' ' LEU . . . -104.5 141.01 15.19 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.399 -0.905 . . . . 0.0 112.619 -179.11 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.852 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -104.5 130.27 52.44 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 179.877 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.565 HD13 ' CD1' ' A' ' 55' ' ' PHE . 0.7 OUTLIER -111.12 153.17 26.09 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.296 0.57 . . . . 0.0 112.293 -178.468 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.403 ' HD2' ' NZ ' ' A' ' 26' ' ' LYS . 2.7 mtm180 161.2 61.35 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.188 179.559 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.769 ' C ' HD11 ' A' ' 3' ' ' LEU . . . 79.74 -0.34 82.31 Favored Glycine 0 N--CA 1.45 -0.379 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 -177.777 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.798 ' N ' HD11 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -165.93 165.84 17.87 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 -179.682 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.757 HG12 ' HG3' ' A' ' 11' ' ' GLN . 9.1 p -111.9 137.91 42.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.24 0.543 . . . . 0.0 111.074 178.542 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.852 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -125.39 165.72 17.89 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.783 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -103.93 127.89 51.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.295 0.569 . . . . 0.0 111.717 -179.21 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.671 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 50.3 t30 -116.3 115.93 26.81 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.628 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.68 -28.6 3.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.279 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -48.6 -72.6 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.207 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.541 ' C ' HG22 ' A' ' 38' ' ' THR . 57.9 p -86.95 -103.43 0.07 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.423 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.585 ' O ' HG21 ' A' ' 24' ' ' THR . 0.2 OUTLIER 164.66 -111.69 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.626 ' HB3' HG21 ' A' ' 24' ' ' THR . 0.1 OUTLIER 172.54 -164.61 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 179.98 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.581 ' N ' ' CG ' ' A' ' 39' ' ' PHE . 0.2 OUTLIER 160.34 37.6 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.078 0.551 . . . . 0.0 110.494 179.501 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.556 ' C ' ' HB2' ' A' ' 107' ' ' GLN . . . 77.72 -26.24 2.03 Favored Glycine 0 CA--C 1.526 0.727 0 CA-C-N 115.755 -0.657 . . . . 0.0 113.091 -179.159 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.509 HD13 ' HG3' ' A' ' 40' ' ' GLN . 1.8 mp -32.62 135.03 0.09 Allowed 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.61 HG23 ' HB2' ' A' ' 106' ' ' ASP . 3.4 m -95.39 36.08 1.27 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.422 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.597 HG22 ' O ' ' A' ' 44' ' ' ILE . 5.1 mp 66.02 0.0 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.079 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -74.92 -25.56 59.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.927 0.394 . . . . 0.0 110.761 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.5 t -101.33 -66.01 0.94 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.144 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -170.59 52.25 0.19 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.602 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.662 ' HB1' ' NE2' ' A' ' 107' ' ' GLN . . . -113.34 -178.73 3.45 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.015 0.436 . . . . 0.0 111.11 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.72 126.28 51.97 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.786 179.268 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.809 ' O ' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -46.97 -28.36 1.6 Allowed 'General case' 0 C--O 1.233 0.206 0 CA-C-O 120.98 0.419 . . . . 0.0 110.468 179.848 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.536 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 82.7 p -59.22 -62.49 1.84 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.935 179.502 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.51 ' CB ' ' HG2' ' A' ' 107' ' ' GLN . 0.4 OUTLIER -42.65 -57.6 2.65 Favored 'General case' 0 C--O 1.231 0.082 0 CA-C-O 121.188 0.518 . . . . 0.0 110.435 179.639 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.433 ' HB3' HD11 ' A' ' 44' ' ' ILE . 0.1 OUTLIER -46.85 -61.9 1.64 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.88 179.151 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.809 HG23 ' O ' ' A' ' 50' ' ' GLU . 30.9 t -50.07 -46.86 24.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.812 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.736 ' O ' HG13 ' A' ' 59' ' ' VAL . 0.4 OUTLIER -58.95 -33.42 70.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.329 179.263 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.497 ' HA ' HG22 ' A' ' 59' ' ' VAL . . . -67.76 -43.91 78.71 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.847 179.628 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.1 mm-40 -67.42 -33.87 76.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.057 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.423 ' CG2' ' HB3' ' A' ' 2' ' ' ASN . 11.8 p -77.46 -41.29 40.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.061 -179.507 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.894 ' O ' HG22 ' A' ' 63' ' ' VAL . 21.0 m -73.49 -31.28 32.42 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.844 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.538 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.659 HD13 ' O ' ' A' ' 102' ' ' SER . 10.1 tp -77.84 -37.89 47.42 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-O 120.906 0.384 . . . . 0.0 110.101 178.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 6.3 t -67.73 -53.06 30.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.793 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' HIS . . . . . 0.532 ' HB3' HD21 ' A' ' 5' ' ' LEU . 2.0 m-70 -47.82 -50.17 26.88 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 120.791 0.329 . . . . 0.0 110.199 179.471 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 1.036 HG12 HG11 ' A' ' 66' ' ' VAL . 0.9 OUTLIER -68.38 -74.48 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.35 179.48 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.712 ' H ' HG23 ' A' ' 63' ' ' VAL . . . 60.91 13.95 4.88 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.506 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.457 ' CB ' ' O ' ' A' ' 64' ' ' ALA . 1.2 m-20 159.72 -66.47 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 120.849 0.357 . . . . 0.0 111.644 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 1.036 HG11 HG12 ' A' ' 63' ' ' VAL . 14.8 m 48.11 -127.66 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 115.79 -0.641 . . . . 0.0 112.248 -179.199 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.522 ' O ' ' O ' ' A' ' 98' ' ' SER . 5.9 p -174.54 -18.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 N-CA-C 113.107 0.781 . . . . 0.0 113.107 -179.303 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.822 HD23 ' HB3' ' A' ' 72' ' ' ASP . 3.5 mp 32.81 105.05 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 178.688 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 18.9 p -66.12 -153.42 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 177.612 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -68.64 -34.54 75.9 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.122 0.487 . . . . 0.0 110.114 179.312 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.44 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 0.8 OUTLIER -64.04 -65.77 0.63 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.362 -179.631 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.822 ' HB3' HD23 ' A' ' 68' ' ' LEU . 1.0 OUTLIER -50.92 -32.26 20.14 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.755 0.312 . . . . 0.0 110.936 -179.929 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 85.1 m -62.61 -63.51 1.2 Allowed 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.4 -24.43 59.99 Favored 'General case' 0 C--N 1.333 -0.116 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 177.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 1.087 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.2 OUTLIER -57.13 -65.42 0.62 Allowed 'General case' 0 C--O 1.236 0.36 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.514 179.074 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.845 HD21 HD11 ' A' ' 116' ' ' LEU . 0.5 OUTLIER -60.48 -42.22 95.82 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 178.913 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -54.15 -36.45 63.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.801 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -75.66 -60.45 2.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.321 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.58 -32.05 70.02 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.206 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 54.5 m -79.51 -59.59 2.69 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.346 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.474 HG12 ' O ' ' A' ' 81' ' ' VAL . 20.7 t -72.53 -6.92 8.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.772 -179.636 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.66 -74.49 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.775 0.321 . . . . 0.0 111.376 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 76.1 t60 -93.29 -80.04 0.39 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.022 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.749 ' HB3' HD22 ' A' ' 85' ' ' LEU . 1.1 t-20 -178.36 -161.11 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.908 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.749 HD22 ' HB3' ' A' ' 84' ' ' ASN . 2.7 mm? 61.91 87.4 0.1 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.845 0.355 . . . . 0.0 110.685 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 13.0 p-10 -63.18 113.16 2.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.308 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ASN . . . . . 0.405 ' HA ' ' HB2' ' A' ' 104' ' ' ARG . 0.0 OUTLIER -122.43 -32.79 3.56 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.774 179.795 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.522 ' CZ ' ' CG ' ' A' ' 112' ' ' ASP . 2.5 m-85 -96.59 141.8 29.42 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 121.038 0.447 . . . . 0.0 110.757 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.732 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.5 OUTLIER -117.06 140.29 49.67 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 179.732 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.841 HD23 ' HA ' ' A' ' 100' ' ' LEU . 34.0 mt -143.31 154.55 43.89 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -177.018 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.421 ' CG ' HG12 ' A' ' 99' ' ' VAL . 0.0 OUTLIER -143.77 131.9 21.82 Favored 'General case' 0 C--O 1.223 -0.334 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 177.176 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.665 ' O ' HG13 ' A' ' 93' ' ' VAL . 54.2 p -103.96 146.01 29.31 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 -176.701 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.665 HG13 ' O ' ' A' ' 92' ' ' SER . 10.4 m -164.8 -126.01 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 CA-C-N 113.616 -1.629 . . . . 0.0 108.683 179.237 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.504 ' O ' ' N ' ' A' ' 96' ' ' GLY . . . 36.95 30.73 0.04 OUTLIER Glycine 0 C--N 1.336 0.554 0 C-N-CA 121.155 -0.545 . . . . 0.0 114.088 178.447 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ASN . . . . . 0.452 ' ND2' ' O ' ' A' ' 94' ' ' GLY . 0.6 OUTLIER 66.22 -56.42 0.38 Allowed 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 -178.658 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.504 ' N ' ' O ' ' A' ' 94' ' ' GLY . . . -136.61 21.82 3.38 Favored Glycine 0 N--CA 1.444 -0.829 0 N-CA-C 110.379 -1.088 . . . . 0.0 110.379 177.754 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.448 ' CB ' HG22 ' A' ' 67' ' ' VAL . 0.0 OUTLIER -123.27 166.18 15.7 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-O 120.697 0.284 . . . . 0.0 110.385 -179.68 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.522 ' O ' ' O ' ' A' ' 67' ' ' VAL . 4.1 t -140.49 162.88 34.3 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.371 0.605 . . . . 0.0 110.834 -179.581 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.421 HG12 ' CG ' ' A' ' 91' ' ' ARG . 1.2 t -103.18 136.8 34.13 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.957 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 178.658 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.841 ' HA ' HD23 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -104.3 110.37 22.58 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-O 121.911 0.863 . . . . 0.0 113.032 -177.695 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.732 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -118.69 103.61 14.81 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.997 0 N-CA-C 103.878 -2.638 . . . . 0.0 103.878 175.023 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.659 ' O ' HD13 ' A' ' 60' ' ' LEU . 0.3 OUTLIER -139.75 154.59 47.46 Favored 'General case' 0 C--N 1.309 -1.192 0 C-N-CA 119.015 -1.074 . . . . 0.0 113.732 -174.756 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.548 HD23 ' O ' ' A' ' 102' ' ' SER . 0.0 OUTLIER 166.81 -91.38 0.0 OUTLIER 'General case' 0 N--CA 1.438 -1.063 0 CA-C-N 113.662 -1.608 . . . . 0.0 111.515 176.796 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.574 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 48.6 59.18 4.53 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 -179.532 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.574 ' CB ' ' O ' ' A' ' 104' ' ' ARG . 4.9 t 102.53 157.82 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 -176.479 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.61 ' HB2' HG23 ' A' ' 43' ' ' THR . 0.6 OUTLIER -104.95 100.87 10.47 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 119.211 -0.996 . . . . 0.0 112.799 -178.685 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.662 ' NE2' ' HB1' ' A' ' 48' ' ' ALA . 7.4 tt0 -168.03 122.92 0.97 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.838 -1.074 . . . . 0.0 109.874 177.325 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.491 ' HG2' HG21 ' A' ' 59' ' ' VAL . 0.0 OUTLIER -122.8 164.46 18.33 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.172 0.51 . . . . 0.0 111.531 179.967 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.524 HG22 HG23 ' A' ' 24' ' ' THR . 1.5 p -121.79 165.4 15.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.771 -179.63 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.815 ' HB3' HG22 ' A' ' 16' ' ' VAL . 5.5 mt -51.86 -49.87 62.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.778 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.902 ' O ' HG23 ' A' ' 115' ' ' VAL . 3.4 tp-100 -59.82 -64.05 1.09 Allowed 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.119 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.722 ' O ' HD22 ' A' ' 116' ' ' LEU . 24.8 m-20 -48.02 -44.87 31.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.901 179.434 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.548 ' HB1' ' CZ ' ' A' ' 55' ' ' PHE . . . -56.4 -54.2 48.42 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.08 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.584 ' CE ' ' HA ' ' A' ' 13' ' ' SER . 0.3 OUTLIER -62.5 -34.68 77.34 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.505 179.413 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 1.087 HG22 ' CG ' ' A' ' 75' ' ' LYS . 84.4 t -55.84 -65.48 0.37 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.827 0 CA-C-O 121.931 0.872 . . . . 0.0 111.299 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.845 HD11 HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -59.93 -37.75 80.4 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.311 -179.106 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.867 HD22 ' HB3' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -73.66 -21.36 60.3 Favored 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 120.505 -0.478 . . . . 0.0 111.621 -179.994 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.486 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 0.1 OUTLIER -69.17 -47.4 65.04 Favored 'General case' 0 CA--C 1.503 -0.83 0 N-CA-C 106.442 -1.688 . . . . 0.0 106.442 177.479 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.436 ' CB ' ' HG ' ' A' ' 68' ' ' LEU . . . -76.12 -25.31 55.26 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 114.747 -1.115 . . . . 0.0 109.909 177.211 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.827 ' HB3' ' HA ' ' A' ' 117' ' ' LEU . . . -69.8 -60.64 2.18 Favored 'General case' 0 CA--C 1.508 -0.666 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.979 179.395 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.727 HD12 ' HA2' ' A' ' 126' ' ' GLY . 0.2 OUTLIER -62.4 -39.39 93.09 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.193 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.58 ' N ' ' HG ' ' A' ' 121' ' ' LEU . 0.1 OUTLIER -52.37 -58.18 7.49 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.186 179.481 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 29.0 mm100 -81.74 -26.37 34.59 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 -178.577 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' GLU . . . . . 0.42 ' CG ' ' O ' ' A' ' 120' ' ' ALA . 3.6 mm-40 -96.06 -66.65 0.89 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.847 1.054 . . . . 0.0 113.847 -178.164 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -95.72 -65.86 0.95 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -177.66 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' GLY . . . . . 0.727 ' HA2' HD12 ' A' ' 121' ' ' LEU . . . 64.72 82.42 0.1 Allowed Glycine 0 N--CA 1.448 -0.526 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 -178.514 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.432 ' HB3' ' O ' ' A' ' 126' ' ' GLY . . . 68.38 38.9 2.34 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -178.001 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ARG . . . . . 0.411 ' HG2' ' HB3' ' A' ' 6' ' ' SER . 0.0 OUTLIER 72.08 105.82 0.07 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.817 -179.223 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . -145.87 -39.2 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.332 0 CA-C-N 115.733 -0.667 . . . . 0.0 112.453 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 10.8 t . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.892 -179.942 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.071 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 65.6 m-20 -112.83 -176.38 2.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.817 0.341 . . . . 0.0 110.932 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -65.96 -162.62 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.764 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 204' ' ' PTR . . . . . 0.469 ' HD1' ' ND2' ' A' ' 30' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -78.03 -60.39 2.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.852 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 206' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -121.18 145.08 41.16 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.896 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 207' ' ' PRO . . . . . 0.595 ' HB3' HD21 ' A' ' 3' ' ' LEU . 85.7 Cg_endo -78.43 -163.06 0.2 Allowed 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.826 2.351 . . . . 0.0 112.534 -179.842 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 208' ' ' PHE . . . . . 0.471 ' CZ ' ' HB3' ' A' ' 10' ' ' ARG . 0.6 OUTLIER 71.02 118.84 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.873 -179.967 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.466 -0.334 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.663 0.268 . . . . 0.0 111.339 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.518 ' C ' HD12 ' A' ' 3' ' ' LEU . 2.5 p30 -101.92 -72.3 0.69 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.915 0.388 . . . . 0.0 111.078 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.714 ' HB2' HD13 ' A' ' 8' ' ' LEU . 2.6 mp -164.05 -75.23 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.278 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.411 ' O ' ' CB ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER 171.07 -170.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.726 -179.842 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.725 HD21 ' HB3' ' A' ' 62' ' ' HIS . 6.5 mt -95.52 -63.26 1.18 Allowed 'General case' 0 CA--C 1.505 -0.765 0 CA-C-O 121.293 0.568 . . . . 0.0 111.558 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.437 ' HB3' ' CA ' ' A' ' 129' ' ' GLY . 0.0 OUTLIER -59.54 -47.19 86.48 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 115.195 -0.911 . . . . 0.0 112.075 -178.162 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -65.59 -55.1 19.49 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.33 0.586 . . . . 0.0 110.021 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.744 HD23 ' CD2' ' A' ' 117' ' ' LEU . 8.6 tp -55.2 -45.7 75.86 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.102 179.019 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.448 ' HA ' HG12 ' A' ' 12' ' ' VAL . 76.4 t60 -54.4 -45.66 72.96 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.227 179.154 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.544 ' HB3' ' CZ ' ' B' ' 208' ' ' PHE . 36.9 mtt180 -59.31 -52.88 63.74 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.594 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.522 ' HG3' HG13 ' A' ' 31' ' ' VAL . 23.8 tp60 -57.31 -57.41 12.74 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 121.149 0.5 . . . . 0.0 110.706 179.461 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.967 HG23 HD13 ' A' ' 110' ' ' LEU . 7.4 p -58.83 -46.11 91.16 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.717 -179.804 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.76 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 35.9 t -55.34 -64.07 0.96 Allowed 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.954 -0.566 . . . . 0.0 112.002 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.464 ' O ' ' CG ' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -60.16 -32.78 71.37 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.056 -179.115 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.522 HD11 ' O ' ' A' ' 31' ' ' VAL . 9.7 mt -59.57 -65.37 0.68 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.925 -179.373 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.797 HG22 ' H ' ' A' ' 22' ' ' ASP . 0.5 OUTLIER -65.53 -24.99 35.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.144 -179.523 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.38 -4.88 47.65 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -178.787 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.464 ' CG ' ' O ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -140.38 23.9 2.31 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 120.392 -0.523 . . . . 0.0 112.382 179.558 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -177.69 -69.85 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.619 ' OG ' ' HB1' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -46.51 -53.06 12.02 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.703 -178.787 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 80.93 37.57 18.66 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.558 -0.83 . . . . 0.0 112.031 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.797 ' H ' HG22 ' A' ' 16' ' ' VAL . 7.7 t70 78.13 21.87 0.84 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.823 0.344 . . . . 0.0 110.715 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.28 -151.97 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.708 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.635 HG23 ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -103.51 165.35 11.09 Favored 'General case' 0 CA--C 1.519 -0.243 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 -179.987 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.641 ' HA3' HD22 ' A' ' 110' ' ' LEU . . . -127.58 156.18 20.4 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.041 -1.076 . . . . 0.0 113.909 -178.721 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.988 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -125.75 123.88 39.8 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.998 -0.601 . . . . 0.0 109.96 179.488 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.839 HD13 HG21 ' A' ' 58' ' ' THR . 2.6 tt -113.15 144.34 42.82 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.419 0.628 . . . . 0.0 111.922 -179.376 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.409 ' HD3' ' HD3' ' A' ' 26' ' ' LYS . 0.0 OUTLIER 169.77 54.23 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.729 179.672 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.612 ' O ' HD21 ' A' ' 3' ' ' LEU . . . 109.17 -19.31 29.88 Favored Glycine 0 N--CA 1.45 -0.433 0 N-CA-C 110.468 -1.053 . . . . 0.0 110.468 -177.673 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.481 ' N ' HD11 ' A' ' 3' ' ' LEU . 0.1 OUTLIER -166.14 165.45 17.67 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 179.481 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.555 HG23 ' CE2' ' A' ' 55' ' ' PHE . 2.1 p -106.74 133.38 51.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 121.348 0.594 . . . . 0.0 110.836 178.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.988 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -123.52 166.27 15.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.404 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.619 ' HB1' ' OG ' ' A' ' 20' ' ' SER . . . -102.61 138.42 39.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.543 0.687 . . . . 0.0 112.381 -178.216 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.536 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 9.9 t-20 -114.94 123.5 49.28 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 114.698 -1.137 . . . . 0.0 110.531 -179.603 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.1 mtmp? -135.86 21.96 3.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.068 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -119.02 -24.59 6.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.338 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 4.9 p -118.09 177.55 4.75 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.988 0.423 . . . . 0.0 111.105 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 12.3 p -128.63 115.04 17.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.312 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.635 ' CD1' HG23 ' A' ' 24' ' ' THR . 4.2 p90 -68.45 -84.87 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.591 -179.138 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.553 ' N ' ' CG ' ' A' ' 39' ' ' PHE . 2.6 pm0 63.96 54.45 1.72 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.382 0.673 . . . . 0.0 112.711 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.566 ' O ' ' O ' ' A' ' 42' ' ' LEU . . . 69.2 -50.55 0.56 Allowed Glycine 0 CA--C 1.526 0.72 0 CA-C-N 116.088 -0.505 . . . . 0.0 113.095 179.618 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.821 HD11 ' CB ' ' A' ' 46' ' ' SER . 0.8 OUTLIER 3.94 125.75 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.454 1.101 . . . . 0.0 113.92 179.102 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.679 HG22 ' CG ' ' A' ' 106' ' ' ASP . 0.8 OUTLIER -91.2 56.98 3.28 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.976 -179.617 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.595 HG22 ' O ' ' A' ' 44' ' ' ILE . 1.8 mp 49.55 9.26 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 179.052 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -100.75 -56.78 2.25 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -178.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.821 ' CB ' HD11 ' A' ' 42' ' ' LEU . 0.3 OUTLIER -54.5 -26.79 33.65 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.741 -178.883 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 140.51 38.99 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.378 -0.915 . . . . 0.0 112.929 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.736 ' HB1' HE21 ' A' ' 107' ' ' GLN . . . -93.96 -167.04 1.61 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.799 0.333 . . . . 0.0 110.447 179.504 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.467 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 0.7 OUTLIER -128.94 146.86 50.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.574 179.664 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.814 ' O ' HG22 ' A' ' 54' ' ' VAL . 8.5 tt0 -53.14 -24.05 9.62 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.099 0.476 . . . . 0.0 110.706 179.575 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.585 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -61.7 -65.25 0.72 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.454 -179.441 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.556 ' HB2' ' HG2' ' A' ' 107' ' ' GLN . 0.6 OUTLIER -53.23 -50.52 64.58 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.713 0.292 . . . . 0.0 111.783 -179.221 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.82 ' HD2' HG13 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -55.22 -57.13 13.03 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 111.716 0.265 . . . . 0.0 111.716 -179.35 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.82 HG13 ' HD2' ' A' ' 53' ' ' LYS . 15.7 m -54.36 -47.55 69.42 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 120.662 -0.415 . . . . 0.0 110.383 179.503 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.597 ' O ' HG23 ' A' ' 58' ' ' THR . 0.6 OUTLIER -48.37 -42.72 32.51 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.812 178.785 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.778 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -64.24 -44.95 90.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.316 178.876 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 50.6 mm-40 -56.73 -47.46 79.96 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.13 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.839 HG21 HD13 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -64.02 -64.08 0.98 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.309 -179.702 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.914 HG23 HD12 ' A' ' 117' ' ' LEU . 12.0 p -46.28 -51.73 3.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.971 -179.6 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.507 ' N ' HG13 ' A' ' 59' ' ' VAL . 0.4 OUTLIER -55.6 -49.17 73.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.815 0.341 . . . . 0.0 110.835 179.235 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.8 m -55.57 -60.6 3.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.239 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' HIS . . . . . 0.725 ' HB3' HD21 ' A' ' 5' ' ' LEU . 1.7 m170 -49.51 -37.36 26.31 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 121.094 0.473 . . . . 0.0 110.123 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.892 HG23 ' O ' ' A' ' 59' ' ' VAL . 40.8 t -75.64 -82.19 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.247 179.194 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.493 ' HB3' ' O ' ' A' ' 63' ' ' VAL . . . 72.62 -6.72 1.56 Allowed 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 178.655 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.538 ' OD1' HG13 ' A' ' 99' ' ' VAL . 6.5 m-20 153.46 -61.52 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.394 0.677 . . . . 0.0 109.365 -179.378 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.867 HG12 ' HB3' ' A' ' 123' ' ' GLN . 0.1 OUTLIER 44.23 -100.96 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 CA-C-N 115.243 -0.89 . . . . 0.0 112.842 178.903 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.743 HG22 ' HB3' ' A' ' 97' ' ' ASN . 0.3 OUTLIER 167.38 107.87 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.343 0.289 0 CA-C-O 121.594 0.711 . . . . 0.0 109.833 -179.519 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.842 HD11 ' HB2' ' A' ' 100' ' ' LEU . 0.1 OUTLIER -110.29 112.63 24.71 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.752 -178.071 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.531 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 11.0 p -83.37 178.7 7.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.608 -0.723 . . . . 0.0 110.788 179.291 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -41.0 -31.14 0.16 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.558 -179.696 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -68.97 -57.8 4.98 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.943 0.401 . . . . 0.0 110.396 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.655 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 65.4 m-20 -69.3 -39.87 78.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.722 179.742 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 62.1 m -61.3 -41.23 96.63 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-O 121.296 0.569 . . . . 0.0 109.622 178.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.501 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . . . -71.24 -30.74 66.69 Favored 'General case' 0 CA--C 1.512 -0.506 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 177.744 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 1.074 ' CG ' HG12 ' A' ' 115' ' ' VAL . 0.3 OUTLIER -55.01 -50.36 69.22 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 114.322 -1.308 . . . . 0.0 109.426 177.92 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 1.087 HD13 HD11 ' A' ' 90' ' ' LEU . 1.4 mt -67.29 -56.75 8.49 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.466 179.205 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.752 ' O ' HG22 ' A' ' 81' ' ' VAL . 0.6 OUTLIER -54.57 -26.85 34.85 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.476 179.808 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.408 ' HA ' HG22 ' A' ' 81' ' ' VAL . 8.7 mt-30 -72.53 -54.81 8.18 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.232 179.213 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' SER . . . . . 0.411 ' OG ' ' HG3' ' A' ' 111' ' ' GLN . 0.0 OUTLIER -52.65 -36.19 56.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.676 179.551 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 86.0 m -78.12 -62.96 1.51 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.788 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.752 HG22 ' O ' ' A' ' 77' ' ' LEU . 32.7 m -50.6 -35.39 13.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 N-CA-C 111.841 0.312 . . . . 0.0 111.841 -179.275 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 3.8 mmtm -50.7 -70.02 0.1 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.118 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -172.0 45.6 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.897 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 70.8 m-20 -137.3 169.58 17.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.893 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.41 HD13 ' HA ' ' A' ' 85' ' ' LEU . 4.1 mm? -88.33 173.68 8.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.74 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.446 ' O ' ' HB3' ' A' ' 87' ' ' ASN . 7.5 m120 -60.07 -89.21 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.587 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ASN . . . . . 0.61 ' HA ' ' HB2' ' A' ' 104' ' ' ARG . 56.7 t30 72.64 -42.65 0.54 Allowed 'General case' 0 C--O 1.238 0.47 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 179.507 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.758 ' CD2' HD22 ' A' ' 76' ' ' LEU . 6.9 p90 -96.73 160.57 14.3 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 121.232 0.539 . . . . 0.0 112.397 -178.587 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.697 ' HB3' ' O ' ' A' ' 101' ' ' VAL . 0.8 OUTLIER -131.9 140.7 49.14 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 178.593 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 1.087 HD11 HD13 ' A' ' 76' ' ' LEU . 8.0 mt -133.94 155.27 50.23 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 -176.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.67 ' O ' ' HB3' ' A' ' 98' ' ' SER . 0.0 OUTLIER -139.96 150.25 44.27 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.293 178.439 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.79 ' O ' HG13 ' A' ' 93' ' ' VAL . 33.7 p -104.47 159.33 15.82 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 121.77 0.795 . . . . 0.0 112.648 -179.02 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.79 HG13 ' O ' ' A' ' 92' ' ' SER . 0.0 OUTLIER 165.38 150.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.146 0 CA-C-N 113.853 -1.521 . . . . 0.0 108.199 -179.389 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.76 ' HA3' ' ND2' ' A' ' 97' ' ' ASN . . . 97.43 30.39 7.34 Favored Glycine 0 C--N 1.293 -1.846 0 C-N-CA 120.076 -1.059 . . . . 0.0 113.337 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ASN . . . . . 0.407 ' O ' ' ND2' ' A' ' 95' ' ' ASN . 1.1 p-10 42.14 29.18 0.13 Allowed 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 121.37 0.605 . . . . 0.0 110.115 -179.04 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.466 ' O ' ' HB ' ' A' ' 69' ' ' THR . . . 141.46 23.1 0.24 Allowed Glycine 0 N--CA 1.442 -0.933 0 CA-C-N 115.261 -0.881 . . . . 0.0 112.729 -179.153 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.76 ' ND2' ' HA3' ' A' ' 94' ' ' GLY . 0.6 OUTLIER -128.01 167.64 16.42 Favored 'General case' 0 N--CA 1.438 -1.049 0 N-CA-C 106.86 -1.533 . . . . 0.0 106.86 177.999 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.717 ' O ' HD12 ' A' ' 68' ' ' LEU . 3.5 m -147.48 159.85 43.26 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 119.343 -0.943 . . . . 0.0 111.39 -178.274 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.538 HG13 ' OD1' ' A' ' 65' ' ' ASN . 1.2 t -103.56 140.42 21.78 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 179.56 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.924 HD22 HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -103.57 111.07 23.37 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-O 121.764 0.792 . . . . 0.0 112.899 -178.197 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.697 ' O ' ' HB3' ' A' ' 89' ' ' ASP . 0.1 OUTLIER -123.88 103.52 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.194 0 N-CA-C 104.202 -2.518 . . . . 0.0 104.202 175.003 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.607 ' O ' ' HB2' ' A' ' 103' ' ' LEU . 12.2 p -140.37 142.24 35.54 Favored 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 119.669 -0.813 . . . . 0.0 112.068 -175.73 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.814 HD13 ' O ' ' A' ' 105' ' ' SER . 0.2 OUTLIER 147.74 79.29 0.0 OUTLIER 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.784 177.531 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.61 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -98.31 28.43 4.1 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 177.487 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.814 ' O ' HD13 ' A' ' 103' ' ' LEU . 6.9 m 148.83 179.21 0.0 OUTLIER 'General case' 0 C--N 1.343 0.293 0 CA-C-N 113.749 -1.569 . . . . 0.0 107.047 -178.719 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.679 ' CG ' HG22 ' A' ' 43' ' ' THR . 0.0 OUTLIER -104.14 101.34 11.09 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 119.1 0.864 . . . . 0.0 111.908 -178.973 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.778 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 4.2 mt-30 -169.46 165.05 10.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.308 178.434 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.549 ' HB2' ' HB2' ' A' ' 56' ' ' ALA . 1.8 tpt -165.21 142.46 5.88 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.3 0.572 . . . . 0.0 112.008 178.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.551 HG22 ' CE2' ' A' ' 39' ' ' PHE . 0.5 OUTLIER -104.83 159.55 15.7 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.709 179.112 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.967 HD13 HG23 ' A' ' 12' ' ' VAL . 0.9 OUTLIER -46.44 -55.75 6.96 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.357 0.599 . . . . 0.0 109.977 179.411 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.879 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 2.2 tp-100 -53.05 -66.7 0.34 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.791 -179.214 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.84 ' O ' HG22 ' A' ' 115' ' ' VAL . 7.5 m-20 -44.61 -37.57 3.7 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.525 0.679 . . . . 0.0 110.746 -179.699 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.554 ' HB3' HG21 ' A' ' 12' ' ' VAL . . . -62.63 -44.24 96.79 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.384 179.205 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.879 ' HD2' ' HA ' ' A' ' 111' ' ' GLN . 0.0 OUTLIER -79.28 -21.9 45.41 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.77 -179.578 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 1.074 HG12 ' CG ' ' A' ' 75' ' ' LYS . 13.2 m -69.55 -48.87 63.64 Favored 'Isoleucine or valine' 0 C--O 1.242 0.688 0 CA-C-O 122.165 0.984 . . . . 0.0 109.209 179.164 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.856 ' HB3' HG21 ' A' ' 63' ' ' VAL . 1.2 mp -71.5 -36.82 71.24 Favored 'General case' 0 N--CA 1.433 -1.3 0 CA-C-N 114.148 -1.387 . . . . 0.0 110.068 179.525 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.914 HD12 HG23 ' A' ' 59' ' ' VAL . 0.2 OUTLIER -75.83 -20.12 58.39 Favored 'General case' 0 CA--C 1.51 -0.578 0 C-N-CA 120.421 -0.512 . . . . 0.0 110.767 178.935 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.45 ' HA ' HD23 ' A' ' 121' ' ' LEU . 28.6 tp10 -71.66 -50.23 32.42 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 177.531 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.526 ' HA ' ' HB3' ' A' ' 122' ' ' ARG . . . -72.28 -33.27 67.31 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.863 177.287 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.813 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -60.82 -64.82 0.82 Allowed 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.824 179.367 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.49 HD23 ' O ' ' A' ' 117' ' ' LEU . 0.0 OUTLIER -58.42 -31.5 67.78 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.716 179.077 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.526 ' HB3' ' HA ' ' A' ' 119' ' ' ALA . 0.0 OUTLIER -59.5 -65.15 0.72 Allowed 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.958 -179.798 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.867 ' HB3' HG12 ' A' ' 66' ' ' VAL . 1.4 tm0? -86.71 -4.7 59.21 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 113.376 0.88 . . . . 0.0 113.376 -177.486 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' GLU . . . . . 0.573 ' HG2' HG13 ' A' ' 66' ' ' VAL . 5.0 mm-40 -93.83 -67.34 0.86 Allowed 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 119.895 -0.722 . . . . 0.0 111.614 -179.675 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.425 ' CB ' ' HB2' ' A' ' 128' ' ' ARG . 9.8 p -96.93 -39.26 9.46 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.492 -179.832 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 85.43 68.08 1.38 Allowed Glycine 0 CA--C 1.5 -0.846 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 -178.367 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . 49.65 27.46 2.19 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 -177.455 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ARG . . . . . 0.425 ' HB2' ' CB ' ' A' ' 125' ' ' SER . 0.2 OUTLIER -95.64 -59.1 1.94 Allowed 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.343 -178.39 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 129' ' ' GLY . . . . . 0.437 ' CA ' ' HB3' ' A' ' 6' ' ' SER . . . 90.52 -79.47 1.43 Allowed Glycine 0 C--N 1.332 0.332 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.55 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.249 -0.882 . . . . 0.0 110.907 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 201' ' ' ACE . . . . . 0.449 ' H2 ' ' CE2' ' B' ' 204' ' ' PTR . . . . . . . . 0 C--O 1.232 0.144 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -93.3 -56.23 3.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.754 0.311 . . . . 0.0 110.906 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -117.47 -7.15 11.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.446 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 204' ' ' PTR . . . . . 0.449 ' CE2' ' H2 ' ' B' ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 51.56 -102.68 0.13 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.593 -0.73 . . . . 0.0 112.433 179.045 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 206' ' ' ASP . . . . . 0.497 ' CB ' ' HD2' ' B' ' 207' ' ' PRO . 0.7 OUTLIER -136.76 173.96 4.97 Favored Pre-proline 0 CA--C 1.532 0.26 0 CA-C-O 120.569 0.224 . . . . 0.0 111.379 -178.649 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 207' ' ' PRO . . . . . 0.621 ' HB3' HD23 ' A' ' 3' ' ' LEU . 37.2 Cg_endo -66.93 58.84 0.56 Allowed 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.673 2.249 . . . . 0.0 113.315 -179.429 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 208' ' ' PHE . . . . . 0.575 ' C ' ' CD1' ' B' ' 208' ' ' PHE . 0.0 OUTLIER 64.9 -3.86 0.54 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.759 0.314 . . . . 0.0 111.373 179.079 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.681 -0.236 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 120.752 0.31 . . . . 0.0 111.266 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.6 p30 44.58 -163.55 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.373 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.755 HD11 ' C ' ' A' ' 29' ' ' GLY . 5.7 mp -73.23 -72.5 0.25 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.341 0.591 . . . . 0.0 110.455 179.374 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 167.73 -159.21 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.109 -0.951 . . . . 0.0 109.087 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.78 HD21 ' HB1' ' A' ' 120' ' ' ALA . 0.0 OUTLIER -95.25 -60.98 1.55 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.887 0.375 . . . . 0.0 111.413 179.567 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.424 ' CB ' ' HA2' ' A' ' 129' ' ' GLY . 27.8 p -53.74 -45.05 70.41 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.888 -0.597 . . . . 0.0 112.242 -179.238 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ASP . . . . . 0.432 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -73.18 -62.47 1.46 Allowed 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 120.901 0.381 . . . . 0.0 110.192 -179.679 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 1.055 HD23 HD21 ' A' ' 117' ' ' LEU . 6.5 tp -45.05 -45.74 11.04 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.313 179.203 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.765 ' CG ' HD22 ' A' ' 121' ' ' LEU . 63.4 t60 -62.16 -48.78 78.58 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.581 178.487 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.46 ' HB3' ' CZ ' ' B' ' 208' ' ' PHE . 4.1 mmt180 -48.92 -54.92 13.46 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.755 -179.416 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.615 ' OE1' HD22 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -67.5 -54.89 16.24 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -179.353 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.783 HG23 HD23 ' A' ' 110' ' ' LEU . 8.6 p -55.98 -46.87 80.68 Favored 'Isoleucine or valine' 0 C--O 1.242 0.698 0 CA-C-O 121.292 0.568 . . . . 0.0 111.18 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.549 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 9.2 t -58.99 -57.97 10.74 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.965 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -58.13 -25.73 61.77 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.697 -179.863 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.567 HD22 ' HB2' ' A' ' 33' ' ' ALA . 12.9 mt -67.97 -65.37 0.7 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.687 -179.519 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.599 HG23 HD13 ' A' ' 110' ' ' LEU . 1.4 t -73.43 -25.0 20.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 120.148 -0.621 . . . . 0.0 110.977 -179.538 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.426 ' CG ' ' O ' ' A' ' 13' ' ' SER . 7.2 mm-40 -75.96 -23.42 55.37 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.253 179.384 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -154.3 57.87 0.71 Allowed 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 120.73 0.3 . . . . 0.0 111.274 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 175.89 -61.8 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.771 ' OG ' ' HB1' ' A' ' 33' ' ' ALA . 20.4 m -85.44 -77.85 0.28 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.894 0.378 . . . . 0.0 111.97 -178.867 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.565 ' H ' ' HA ' ' A' ' 16' ' ' VAL . . . 118.57 -36.64 3.52 Favored Glycine 0 N--CA 1.449 -0.473 0 N-CA-C 111.553 -0.619 . . . . 0.0 111.553 -179.0 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.405 ' O ' ' O ' ' A' ' 23' ' ' CYS . 0.2 OUTLIER -177.08 5.24 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.719 0.295 . . . . 0.0 111.636 179.895 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.633 ' HB2' HD12 ' A' ' 110' ' ' LEU . 88.5 m -52.65 -165.96 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.495 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.617 ' CB ' ' HB3' ' A' ' 34' ' ' ASN . 0.2 OUTLIER -103.77 164.47 11.66 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.142 179.758 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -109.21 136.26 13.44 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.301 -0.952 . . . . 0.0 113.716 -178.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.918 ' HB3' ' HB3' ' A' ' 32' ' ' ALA . 2.1 tmmm? -105.68 116.65 32.31 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 178.834 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.795 HD22 HG12 ' A' ' 54' ' ' VAL . 8.6 tt -104.11 146.77 28.26 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.033 0.444 . . . . 0.0 111.849 -179.05 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.512 ' NH2' HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER 153.81 64.59 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.271 -179.863 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.755 ' C ' HD11 ' A' ' 3' ' ' LEU . . . 89.94 -12.43 67.55 Favored Glycine 0 CA--C 1.519 0.289 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.764 -178.56 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.685 ' N ' HD11 ' A' ' 3' ' ' LEU . 0.2 OUTLIER -165.9 165.16 18.39 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.66 HG21 ' HB ' ' A' ' 12' ' ' VAL . 0.1 OUTLIER -110.37 121.35 63.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 C-N-CA 120.439 -0.504 . . . . 0.0 109.939 177.781 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.918 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . . . -104.07 166.5 10.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.771 -179.217 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.778 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -103.15 104.76 14.94 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.26 0.553 . . . . 0.0 111.72 -178.688 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.617 ' HB3' ' CB ' ' A' ' 24' ' ' THR . 1.1 t-20 -76.25 86.75 3.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.998 179.303 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.91 74.49 2.64 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.836 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 179.62 -36.66 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.46 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.68 ' O ' HG23 ' A' ' 38' ' ' THR . 0.2 OUTLIER -100.72 -166.62 1.33 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.794 179.862 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.68 HG23 ' O ' ' A' ' 37' ' ' THR . 0.9 OUTLIER -168.83 102.22 0.39 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.682 179.882 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.66 ' CZ ' ' HA ' ' A' ' 48' ' ' ALA . 20.6 m-30 -114.92 145.03 42.65 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -178.209 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.477 ' HG2' ' O ' ' A' ' 40' ' ' GLN . 2.1 pm0 -153.75 65.23 0.73 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.229 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.468 ' H ' ' HB3' ' A' ' 107' ' ' GLN . . . 78.31 106.39 0.19 Allowed Glycine 0 CA--C 1.519 0.332 0 CA-C-N 115.352 -0.84 . . . . 0.0 113.084 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.68 ' N ' ' HB3' ' A' ' 105' ' ' SER . 0.0 OUTLIER -154.81 -135.23 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 178.86 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.503 ' H ' HD12 ' A' ' 42' ' ' LEU . 0.1 OUTLIER -170.52 35.28 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 O-C-N 121.859 -0.525 . . . . 0.0 111.493 -179.656 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.743 ' HA ' ' HB3' ' A' ' 48' ' ' ALA . 4.9 mt 63.29 3.49 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -88.63 -56.39 3.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.916 0.389 . . . . 0.0 110.752 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.447 ' HB2' HD11 ' A' ' 42' ' ' LEU . 1.4 t -60.39 -22.59 63.51 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.727 179.636 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 135.5 46.6 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.295 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.872 ' HB2' ' OE1' ' A' ' 107' ' ' GLN . . . -102.68 -169.02 1.6 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.087 0.47 . . . . 0.0 111.457 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.8 142.08 28.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.977 179.315 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.607 ' O ' HG23 ' A' ' 54' ' ' VAL . 10.1 tt0 -44.52 -29.27 0.69 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.818 0.342 . . . . 0.0 111.654 -179.324 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.416 ' CB ' ' HG2' ' A' ' 26' ' ' LYS . 5.2 m -56.54 -65.18 0.65 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.742 -179.612 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.437 ' HG3' ' O ' ' A' ' 108' ' ' MET . 0.7 OUTLIER -53.77 -63.77 1.04 Allowed 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 111.911 0.338 . . . . 0.0 111.911 -179.164 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.649 ' CE ' HD11 ' A' ' 44' ' ' ILE . 0.7 OUTLIER -44.78 -51.89 8.98 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 120.686 0.279 . . . . 0.0 111.426 -179.802 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.795 HG12 HD22 ' A' ' 27' ' ' LEU . 74.9 t -58.81 -34.32 51.87 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 CA-C-O 121.055 0.455 . . . . 0.0 109.788 179.188 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.699 ' HA ' HD13 ' A' ' 27' ' ' LEU . 0.3 OUTLIER -63.67 -46.37 85.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.737 178.883 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.782 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -57.51 -46.61 83.58 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.455 179.195 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.436 ' OE1' HD11 ' A' ' 103' ' ' LEU . 13.8 mm-40 -62.91 -45.32 93.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.451 179.554 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.461 HG21 HD11 ' A' ' 27' ' ' LEU . 59.5 m -59.86 -57.76 11.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.917 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.96 HG23 HD12 ' A' ' 117' ' ' LEU . 7.7 p -59.04 -48.7 85.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.811 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.81 HD22 ' CD2' ' A' ' 103' ' ' LEU . 12.9 tp -54.83 -34.28 62.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.906 0.384 . . . . 0.0 110.615 179.516 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 49.2 m -72.27 -50.8 24.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.156 -179.584 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' HIS . . . . . 0.605 ' ND1' HD23 ' A' ' 5' ' ' LEU . 0.4 OUTLIER -66.63 -25.09 66.42 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 120.928 0.394 . . . . 0.0 110.733 -179.54 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 1.089 HG13 HG11 ' A' ' 66' ' ' VAL . 7.0 t -98.66 31.2 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.489 179.188 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.57 ' O ' ' HB2' ' A' ' 65' ' ' ASN . . . -68.85 61.73 0.1 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.288 -179.299 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.685 ' O ' HG22 ' A' ' 99' ' ' VAL . 2.0 m-20 142.19 -73.13 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.095 0.558 . . . . 0.0 111.407 179.722 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 1.089 HG11 HG13 ' A' ' 63' ' ' VAL . 29.2 m 39.55 -146.15 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.912 -179.092 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.484 ' O ' ' O ' ' A' ' 98' ' ' SER . 4.1 p -158.51 -24.02 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 N-CA-C 112.284 0.476 . . . . 0.0 112.284 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.737 HD12 ' O ' ' A' ' 98' ' ' SER . 0.7 OUTLIER 36.89 92.6 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 179.093 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 15.7 p -64.34 177.02 0.92 Allowed 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 178.674 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.421 ' HA ' ' O ' ' A' ' 96' ' ' GLY . 0.7 OUTLIER -42.21 -33.2 0.57 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.807 0.337 . . . . 0.0 111.329 -179.934 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -65.27 -63.81 1.01 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.468 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.675 ' HB3' HD23 ' A' ' 68' ' ' LEU . 48.5 m-20 -59.85 -33.51 71.89 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.859 0.362 . . . . 0.0 110.472 179.509 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.582 HG23 ' HB3' ' A' ' 98' ' ' SER . 2.1 m -56.48 -62.81 1.47 Allowed 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 178.596 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -57.78 -27.48 63.11 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.449 0.642 . . . . 0.0 109.28 177.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 1.085 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.1 OUTLIER -56.99 -65.15 0.67 Allowed 'General case' 0 C--O 1.238 0.469 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.302 178.956 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 1.043 HD21 HD11 ' A' ' 116' ' ' LEU . 0.5 OUTLIER -56.21 -39.06 71.87 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.434 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.428 ' O ' HG23 ' A' ' 81' ' ' VAL . 0.1 OUTLIER -55.96 -49.18 74.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.398 179.522 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -60.69 -58.1 9.89 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.423 -179.626 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.65 -61.6 1.99 Allowed 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.566 -179.388 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.533 HG22 ' O ' ' A' ' 76' ' ' LEU . 0.7 OUTLIER -49.39 -44.03 44.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.772 -179.265 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 77' ' ' LEU . 16.7 t -87.36 -12.85 10.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 111.652 0.241 . . . . 0.0 111.652 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? -37.29 154.3 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.932 0.396 . . . . 0.0 111.603 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 6.6 p-80 -58.65 90.39 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.224 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 179.94 -76.79 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.051 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.642 HD23 ' H ' ' A' ' 86' ' ' ASN . 0.2 OUTLIER -173.99 172.96 3.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.023 -179.86 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.642 ' H ' HD23 ' A' ' 85' ' ' LEU . 4.6 m-80 -91.94 177.96 6.03 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.811 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ASN . . . . . 0.467 ' HA ' ' HB2' ' A' ' 104' ' ' ARG . 25.8 t30 178.52 -38.74 0.01 OUTLIER 'General case' 0 C--O 1.241 0.645 0 CA-C-O 121.311 0.577 . . . . 0.0 110.632 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.548 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 4.1 m-85 -106.94 142.26 36.85 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.914 -179.01 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.666 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.2 OUTLIER -110.4 150.76 28.35 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 115.299 -0.864 . . . . 0.0 108.982 -179.4 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.925 HD21 HD13 ' A' ' 76' ' ' LEU . 2.0 mt -138.74 156.17 47.61 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -177.569 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.602 ' O ' ' CB ' ' A' ' 98' ' ' SER . 56.2 mmm-85 -128.19 149.8 50.29 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 114.695 -1.138 . . . . 0.0 108.536 177.866 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.79 ' O ' HG13 ' A' ' 93' ' ' VAL . 53.4 p -103.76 154.29 19.73 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.985 0.898 . . . . 0.0 113.065 -178.302 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.79 HG13 ' O ' ' A' ' 92' ' ' SER . 0.0 OUTLIER 167.29 157.17 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.433 -1.316 0 CA-C-N 113.594 -1.639 . . . . 0.0 107.531 -179.31 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.489 ' O ' ' HB3' ' A' ' 95' ' ' ASN . . . 88.72 35.52 8.39 Favored Glycine 0 C--N 1.291 -1.968 0 C-N-CA 120.068 -1.063 . . . . 0.0 112.667 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ASN . . . . . 0.489 ' HB3' ' O ' ' A' ' 94' ' ' GLY . 13.6 t30 70.51 -56.13 0.61 Allowed 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 -178.151 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.455 ' N ' ' O ' ' A' ' 94' ' ' GLY . . . -145.56 26.1 1.82 Allowed Glycine 0 N--CA 1.439 -1.141 0 CA-C-N 115.168 -0.924 . . . . 0.0 111.378 178.513 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.558 ' O ' ' O ' ' A' ' 93' ' ' VAL . 0.2 OUTLIER -104.9 166.32 10.46 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 117.097 0.448 . . . . 0.0 109.907 179.676 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.737 ' O ' HD12 ' A' ' 68' ' ' LEU . 0.6 OUTLIER -146.78 161.86 39.76 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.528 0.68 . . . . 0.0 111.451 179.942 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.685 HG22 ' O ' ' A' ' 65' ' ' ASN . 0.5 OUTLIER -103.87 155.04 5.76 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.176 179.604 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.708 HD22 ' HG ' ' A' ' 116' ' ' LEU . 1.4 tp -103.05 108.89 20.24 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-O 121.937 0.875 . . . . 0.0 112.389 -179.319 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.666 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -122.12 105.19 15.89 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.027 0 N-CA-C 104.073 -2.566 . . . . 0.0 104.073 175.49 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.742 ' O ' ' HB2' ' A' ' 103' ' ' LEU . 0.1 OUTLIER -144.34 165.15 28.72 Favored 'General case' 0 C--N 1.307 -1.265 0 C-N-CA 119.01 -1.076 . . . . 0.0 113.734 -173.917 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.81 ' CD2' HD22 ' A' ' 60' ' ' LEU . 0.5 OUTLIER 132.57 70.85 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 113.469 -1.696 . . . . 0.0 112.533 176.465 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.467 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -98.32 13.21 32.25 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.757 -1.11 . . . . 0.0 108.132 177.001 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.68 ' HB3' ' N ' ' A' ' 42' ' ' LEU . 5.0 m 160.15 172.07 0.01 OUTLIER 'General case' 0 C--O 1.231 0.099 0 CA-C-N 114.108 -1.406 . . . . 0.0 107.335 -179.151 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.505 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.4 OUTLIER -104.75 101.7 11.3 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 119.61 -0.836 . . . . 0.0 112.194 -178.965 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.872 ' OE1' ' HB2' ' A' ' 48' ' ' ALA . 1.6 mt-30 -169.6 165.23 10.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.776 178.024 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.476 ' HB3' ' HB3' ' A' ' 55' ' ' PHE . 0.0 OUTLIER -165.56 138.14 4.24 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.12 0.486 . . . . 0.0 111.799 178.48 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.549 ' CG2' HG23 ' A' ' 24' ' ' THR . 0.1 OUTLIER -103.91 159.58 15.53 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.38 178.759 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.783 HD23 HG23 ' A' ' 12' ' ' VAL . 6.8 mt -46.92 -55.55 7.87 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 121.174 -0.211 . . . . 0.0 110.908 -179.481 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.894 ' O ' HG23 ' A' ' 115' ' ' VAL . 3.5 tp-100 -46.87 -65.52 0.55 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.691 0.281 . . . . 0.0 110.826 179.708 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.907 ' O ' HD22 ' A' ' 116' ' ' LEU . 58.9 m-20 -45.52 -54.14 7.94 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 121.158 0.504 . . . . 0.0 110.867 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.479 ' HB3' HG21 ' A' ' 12' ' ' VAL . . . -44.31 -64.94 0.58 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.944 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.583 ' NZ ' ' HB ' ' A' ' 16' ' ' VAL . 0.0 OUTLIER -64.97 -22.08 66.94 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.473 -179.847 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 1.085 HG22 ' CG ' ' A' ' 75' ' ' LYS . 53.1 t -60.06 -64.94 0.51 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.815 0 CA-C-O 121.995 0.902 . . . . 0.0 109.786 179.535 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 1.043 HD11 HD21 ' A' ' 76' ' ' LEU . 0.2 OUTLIER -64.05 -35.83 82.02 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.85 179.67 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 1.055 HD21 HD23 ' A' ' 8' ' ' LEU . 0.4 OUTLIER -70.86 -19.14 62.66 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-O 121.044 0.449 . . . . 0.0 110.812 179.437 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.578 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 6.9 tp10 -75.34 -47.5 27.43 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 106.598 -1.63 . . . . 0.0 106.598 177.778 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.552 ' HB1' ' H ' ' A' ' 68' ' ' LEU . . . -77.93 -18.19 56.37 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 114.606 -1.179 . . . . 0.0 111.08 178.303 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.891 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -82.44 -52.17 7.14 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.186 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.765 HD22 ' CG ' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -63.85 -30.06 71.19 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 178.148 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.578 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 4.3 ttm-85 -71.91 -55.98 6.53 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.422 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -92.7 -29.87 15.84 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 -177.024 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' GLU . . . . . 0.406 ' CB ' ' O ' ' A' ' 120' ' ' ALA . 4.4 mm-40 -75.73 -65.99 0.84 Allowed 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.514 -0.474 . . . . 0.0 112.038 -178.382 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -95.88 -48.26 5.8 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.97 -178.807 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' GLY . . . . . 0.42 ' N ' ' O ' ' A' ' 121' ' ' LEU . . . 87.22 71.51 1.29 Allowed Glycine 0 CA--C 1.502 -0.767 0 N-CA-C 110.8 -0.92 . . . . 0.0 110.8 -178.418 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . 51.14 27.17 3.24 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 -177.491 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.32 -70.24 0.7 Allowed 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.723 -178.299 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' GLY . . . . . 0.424 ' HA2' ' CB ' ' A' ' 6' ' ' SER . . . 117.26 -38.3 3.03 Favored Glycine 0 C--N 1.333 0.409 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.379 -179.548 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 8.0 t . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.228 -0.891 . . . . 0.0 110.977 179.919 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.122 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -95.26 -30.36 14.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.803 0.335 . . . . 0.0 110.94 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -127.47 144.41 51.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.008 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 204' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 54.65 -87.36 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.941 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 206' ' ' ASP . . . . . 0.446 ' HB2' ' HD2' ' B' ' 207' ' ' PRO . 0.1 OUTLIER -156.16 166.91 15.42 Favored Pre-proline 0 C--N 1.332 -0.165 0 CA-C-O 120.653 0.263 . . . . 0.0 111.059 -179.24 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 207' ' ' PRO . . . . . 0.514 ' HB3' HD23 ' A' ' 3' ' ' LEU . 5.7 Cg_exo -38.19 -71.27 0.06 OUTLIER 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 123.426 2.751 . . . . 0.0 112.726 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 208' ' ' PHE . . . . . 0.46 ' CZ ' ' HB3' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -175.95 -171.77 0.47 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.029 179.84 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.326 0 CA-C-N 116.484 -0.326 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.1 ptp . . . . . 0 N--CA 1.488 1.444 0 CA-C-O 120.725 0.298 . . . . 0.0 111.398 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -103.91 -164.22 1.04 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.929 0.395 . . . . 0.0 111.278 -179.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.858 HD11 ' HB2' ' A' ' 7' ' ' ASP . 0.0 OUTLIER -91.38 -66.64 0.91 Allowed 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.405 -179.668 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.682 ' N ' HD13 ' A' ' 3' ' ' LEU . 39.9 t 172.81 -169.18 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 179.391 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 1.004 HD21 ' CB ' ' A' ' 120' ' ' ALA . 0.0 OUTLIER -96.7 -65.42 0.97 Allowed 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.661 -0.416 . . . . 0.0 111.406 179.049 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.4 p -51.18 -49.01 61.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.695 -179.078 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ASP . . . . . 0.858 ' HB2' HD11 ' A' ' 3' ' ' LEU . 2.9 m-20 -67.9 -44.59 76.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.904 0.383 . . . . 0.0 110.19 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 1.101 HD23 HD21 ' A' ' 117' ' ' LEU . 18.6 tp -61.53 -64.75 0.84 Allowed 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.279 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.735 ' ND1' HD22 ' A' ' 121' ' ' LEU . 25.6 t-80 -45.19 -50.53 11.43 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.392 0.615 . . . . 0.0 109.865 178.817 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.452 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 17.3 mmt85 -56.39 -51.43 68.37 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.298 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 1.139 ' HG3' HG12 ' A' ' 31' ' ' VAL . 4.6 pt20 -71.05 -53.31 15.14 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.728 -179.587 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.883 ' CA ' HG11 ' A' ' 31' ' ' VAL . 10.0 p -55.58 -50.04 69.5 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-O 120.705 0.288 . . . . 0.0 111.455 179.331 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.47 ' N ' HG13 ' A' ' 12' ' ' VAL . 4.6 t -64.51 -43.66 93.35 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.354 179.498 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.452 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -53.79 -43.92 69.69 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -179.441 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.634 HD21 HG13 ' A' ' 31' ' ' VAL . 0.1 OUTLIER -75.36 -51.13 13.88 Favored 'General case' 0 CA--C 1.517 -0.29 0 C-N-CA 119.879 -0.728 . . . . 0.0 111.102 -179.692 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.819 HG13 ' NZ ' ' A' ' 114' ' ' LYS . 8.8 p -73.92 -4.83 5.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 113.569 0.951 . . . . 0.0 113.569 -178.293 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.433 ' HG2' ' CE ' ' A' ' 114' ' ' LYS . 5.9 mm-40 -93.38 -4.71 50.98 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.221 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -153.34 -40.53 0.1 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.694 0.283 . . . . 0.0 111.278 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -89.45 -66.7 0.9 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.751 0.31 . . . . 0.0 111.268 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.767 ' CB ' HD13 ' A' ' 110' ' ' LEU . 0.7 OUTLIER -69.77 -32.74 71.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.853 -179.827 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 76.22 -56.23 3.21 Favored Glycine 0 CA--C 1.52 0.368 0 C-N-CA 120.954 -0.641 . . . . 0.0 113.67 179.118 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.471 ' HA ' ' CG2' ' A' ' 16' ' ' VAL . 0.1 OUTLIER -176.92 8.31 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.701 0.25 . . . . 0.0 111.635 -179.158 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.418 ' O ' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -56.49 -152.88 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.048 -179.599 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.676 HG21 ' HB2' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -103.62 153.16 20.92 Favored 'General case' 0 CA--C 1.52 -0.187 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.34 -179.871 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.455 ' CA ' ' HG ' ' A' ' 110' ' ' LEU . . . -113.17 124.95 6.79 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.337 -0.935 . . . . 0.0 113.459 -178.729 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.698 ' HG3' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -109.01 127.78 54.38 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 178.483 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 1.02 ' HB3' ' HA ' ' A' ' 31' ' ' VAL . 0.4 OUTLIER -164.02 165.91 22.01 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 114.864 1.431 . . . . 0.0 114.864 -178.08 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.0 mpt_? -142.65 -48.03 0.33 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 113.226 -1.806 . . . . 0.0 108.526 177.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.415 ' O ' ' HB2' ' A' ' 3' ' ' LEU . . . -130.74 4.53 5.78 Favored Glycine 0 CA--C 1.524 0.621 0 CA-C-N 115.054 -0.976 . . . . 0.0 110.752 177.468 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.799 ' O ' ' CB ' ' A' ' 27' ' ' LEU . 0.1 OUTLIER -166.36 157.41 12.94 Favored 'General case' 0 C--O 1.222 -0.372 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 -179.992 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 1.139 HG12 ' HG3' ' A' ' 11' ' ' GLN . 8.8 p -102.36 131.65 50.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 122.179 0.99 . . . . 0.0 113.22 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.698 ' HB3' ' HG3' ' A' ' 26' ' ' LYS . . . -113.38 166.0 11.91 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 113.407 -1.724 . . . . 0.0 109.411 178.574 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.578 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -103.3 135.5 44.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.306 0.574 . . . . 0.0 111.785 -178.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.428 HD22 ' H ' ' A' ' 37' ' ' THR . 8.6 t-20 -116.02 117.82 31.19 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.679 -179.575 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -123.05 -31.26 3.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.743 179.707 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -61.01 -54.45 44.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.523 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.428 ' H ' HD22 ' A' ' 34' ' ' ASN . 0.0 OUTLIER -83.65 -166.13 1.31 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.355 179.596 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 35.8 p -154.54 101.05 2.31 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.887 0.375 . . . . 0.0 111.441 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.772 ' O ' HG22 ' A' ' 109' ' ' THR . 1.6 m-85 -113.98 127.96 56.18 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.833 179.191 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -118.04 -35.01 3.97 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.265 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.58 ' HA3' ' HB3' ' A' ' 87' ' ' ASN . . . 171.54 -14.89 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.891 -0.671 . . . . 0.0 113.412 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.724 HD21 ' HB2' ' A' ' 48' ' ' ALA . 0.1 OUTLIER -44.75 174.0 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 117.332 0.566 . . . . 0.0 111.834 -179.799 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.521 HG22 ' O ' ' A' ' 43' ' ' THR . 20.8 m -109.72 46.61 1.0 Allowed 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -178.497 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.833 HD11 ' HE3' ' A' ' 53' ' ' LYS . 0.7 OUTLIER 59.94 -5.33 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 179.244 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.443 ' H ' ' C ' ' A' ' 43' ' ' THR . . . -63.76 -64.09 0.99 Allowed 'General case' 0 CA--C 1.522 -0.13 0 CA-C-O 120.969 0.414 . . . . 0.0 110.621 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.5 t -46.44 -41.64 14.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.962 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 151.55 37.16 0.03 OUTLIER Glycine 0 CA--C 1.519 0.314 0 C-N-CA 120.46 -0.876 . . . . 0.0 113.432 179.583 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.931 ' HB1' ' OE1' ' A' ' 52' ' ' GLU . . . -90.82 -171.27 2.97 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 117.151 0.476 . . . . 0.0 111.281 179.75 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.42 ' HG3' ' CZ ' ' A' ' 39' ' ' PHE . 12.4 mtp85 -115.94 -165.97 1.09 Allowed 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.523 -179.545 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.859 ' O ' HG22 ' A' ' 54' ' ' VAL . 0.6 OUTLIER -95.27 -52.45 4.17 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.311 -0.404 . . . . 0.0 112.012 -179.259 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.545 ' O ' HG23 ' A' ' 54' ' ' VAL . 1.4 p -39.96 -40.33 1.0 Allowed 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.098 0.475 . . . . 0.0 111.312 -179.592 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.931 ' OE1' ' HB1' ' A' ' 48' ' ' ALA . 0.0 OUTLIER -63.02 -66.21 0.57 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.491 179.66 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.833 ' HE3' HD11 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -46.33 -55.62 7.03 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.881 179.936 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.859 HG22 ' O ' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -54.07 -39.83 43.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.184 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.928 ' CE1' HD21 ' A' ' 27' ' ' LEU . 1.3 t80 -52.78 -49.03 66.38 Favored 'General case' 0 C--O 1.231 0.132 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.735 178.42 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.743 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -58.99 -42.81 90.93 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.305 179.119 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -58.69 -43.09 89.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.807 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.598 HG23 ' O ' ' A' ' 54' ' ' VAL . 27.2 p -64.54 -60.36 3.23 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.162 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.947 HG23 HD12 ' A' ' 117' ' ' LEU . 8.9 p -60.72 -47.53 92.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.532 -179.523 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 1.04 HD13 HD23 ' A' ' 103' ' ' LEU . 6.0 tp -58.45 -43.0 88.66 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.67 0.271 . . . . 0.0 111.409 -179.569 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 9.9 t -75.3 -34.61 61.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.289 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' HIS . . . . . 0.614 ' HB3' HD22 ' A' ' 5' ' ' LEU . 0.1 OUTLIER -70.01 -25.22 63.48 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 120.727 0.298 . . . . 0.0 110.323 179.521 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 1.077 HG12 ' HB2' ' A' ' 120' ' ' ALA . 28.0 m -91.93 -55.55 6.06 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.233 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.179 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.551 ' N ' HG23 ' A' ' 63' ' ' VAL . . . 29.88 36.66 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 O-C-N 123.38 0.425 . . . . 0.0 112.009 179.78 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.62 ' O ' HG22 ' A' ' 66' ' ' VAL . 4.5 m-20 160.25 -84.45 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.262 0.468 . . . . 0.0 112.262 -179.031 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.62 HG22 ' O ' ' A' ' 65' ' ' ASN . 22.9 m 50.97 -160.56 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.59 -178.825 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.492 ' O ' ' O ' ' A' ' 98' ' ' SER . 7.3 p -147.34 -15.48 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 -178.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.899 HD22 HD11 ' A' ' 76' ' ' LEU . 0.4 OUTLIER 29.58 95.06 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.426 0.899 . . . . 0.0 113.426 178.81 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.408 HG21 ' CZ ' ' A' ' 122' ' ' ARG . 79.4 p -62.53 -161.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 178.619 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.4 ' HG3' ' O ' ' A' ' 96' ' ' GLY . 0.0 OUTLIER -60.08 -36.52 77.56 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.03 0.443 . . . . 0.0 110.393 179.744 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.474 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 13.7 tt0 -62.72 -65.34 0.7 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.242 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.686 ' O ' HD12 ' A' ' 76' ' ' LEU . 1.3 m-20 -53.26 -36.89 61.62 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.969 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.502 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 85.4 m -57.29 -65.25 0.66 Allowed 'General case' 0 C--O 1.238 0.455 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.644 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.86 -25.97 57.67 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 177.642 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 1.069 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -59.06 -51.43 70.1 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.723 178.715 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.899 HD11 HD22 ' A' ' 68' ' ' LEU . 1.2 mp -64.44 -49.68 70.5 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 178.521 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.72 ' O ' HG12 ' A' ' 81' ' ' VAL . 2.8 mt -57.08 -32.92 66.75 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.426 179.639 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.44 ' HA ' HG12 ' A' ' 81' ' ' VAL . 0.1 OUTLIER -69.16 -49.21 58.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.686 179.798 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 79' ' ' SER . . . . . 0.423 ' O ' ' CG ' ' A' ' 83' ' ' HIS . 0.0 OUTLIER -61.17 -30.94 70.71 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.466 179.706 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.534 HG23 ' CZ ' ' A' ' 88' ' ' TYR . 0.6 OUTLIER -81.3 -61.19 2.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.207 179.953 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.72 HG12 ' O ' ' A' ' 77' ' ' LEU . 13.8 p -52.06 -33.56 16.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.767 -179.424 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.19 5.51 46.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.692 -179.722 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.423 ' CG ' ' O ' ' A' ' 79' ' ' SER . 6.4 m80 -121.92 -177.65 3.63 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.876 0.369 . . . . 0.0 110.991 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -64.77 -72.25 0.16 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.111 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.486 HD12 ' C ' ' A' ' 85' ' ' LEU . 2.9 pp -125.0 -179.94 4.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.889 0.376 . . . . 0.0 110.961 -179.842 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.405 ' HB3' ' CG2' ' A' ' 80' ' ' THR . 19.7 p30 -114.22 129.51 56.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.78 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ASN . . . . . 0.58 ' HB3' ' HA3' ' A' ' 41' ' ' GLY . 9.4 p-10 -107.42 -18.48 13.85 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.428 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.661 ' CD1' HD23 ' A' ' 76' ' ' LEU . 4.4 p90 -104.52 145.99 29.51 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 119.981 -0.687 . . . . 0.0 110.817 179.724 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.718 ' HB3' ' O ' ' A' ' 101' ' ' VAL . 0.5 OUTLIER -109.45 141.56 41.69 Favored 'General case' 0 N--CA 1.436 -1.145 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.184 -179.056 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.821 HD11 ' CB ' ' A' ' 76' ' ' LEU . 66.4 mt -126.36 165.07 19.7 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.916 0.865 . . . . 0.0 113.289 -177.438 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -153.53 130.15 10.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 113.997 -1.456 . . . . 0.0 107.223 178.447 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.704 ' O ' HG13 ' A' ' 93' ' ' VAL . 60.4 p -103.68 145.83 29.48 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 -176.681 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.704 HG13 ' O ' ' A' ' 92' ' ' SER . 3.7 m -166.21 -122.83 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-N 113.553 -1.658 . . . . 0.0 108.621 179.203 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.541 ' O ' ' N ' ' A' ' 96' ' ' GLY . . . 34.51 34.77 0.04 OUTLIER Glycine 0 C--N 1.34 0.758 0 C-N-CA 120.885 -0.674 . . . . 0.0 113.643 178.635 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ASN . . . . . 0.414 ' HB3' ' O ' ' A' ' 94' ' ' GLY . 3.2 t30 65.26 -68.66 0.11 Allowed 'General case' 0 C--O 1.231 0.081 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 -178.208 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.541 ' N ' ' O ' ' A' ' 94' ' ' GLY . . . -126.41 24.95 5.5 Favored Glycine 0 N--CA 1.443 -0.841 0 N-CA-C 110.677 -0.969 . . . . 0.0 110.677 177.762 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.425 ' HB2' HG22 ' A' ' 67' ' ' VAL . 0.0 OUTLIER -124.43 166.07 16.64 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.892 0.377 . . . . 0.0 110.551 -179.801 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.505 ' O ' HD12 ' A' ' 68' ' ' LEU . 11.2 t -142.23 154.18 44.57 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.209 0.528 . . . . 0.0 111.138 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.416 HG13 ' N ' ' A' ' 100' ' ' LEU . 1.0 OUTLIER -103.74 159.91 4.79 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 178.772 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.796 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 0.1 OUTLIER -126.47 113.74 17.23 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -179.152 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.718 ' O ' ' HB3' ' A' ' 89' ' ' ASP . 0.2 OUTLIER -105.08 108.97 26.2 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 N-CA-C 103.213 -2.884 . . . . 0.0 103.213 174.481 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.781 ' O ' ' HB2' ' A' ' 103' ' ' LEU . 13.8 p -138.54 165.11 27.7 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -173.243 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 1.04 HD23 HD13 ' A' ' 60' ' ' LEU . 0.9 OUTLIER 126.74 82.55 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 112.508 -2.133 . . . . 0.0 112.658 176.61 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.447 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -104.65 19.14 20.94 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.619 -1.173 . . . . 0.0 108.284 177.441 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.691 ' O ' HD13 ' A' ' 103' ' ' LEU . 3.5 m 157.97 175.25 0.01 OUTLIER 'General case' 0 C--O 1.231 0.116 0 N-CA-C 107.14 -1.43 . . . . 0.0 107.14 -179.046 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.421 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.6 OUTLIER -106.69 101.95 11.36 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 119.596 -0.842 . . . . 0.0 112.097 -178.988 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.743 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 1.1 mt-30 -169.04 163.47 11.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.612 178.147 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.597 ' HB2' ' HB2' ' A' ' 56' ' ' ALA . 1.0 OUTLIER -165.71 133.71 3.01 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.395 0.617 . . . . 0.0 112.347 178.76 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.772 HG22 ' O ' ' A' ' 39' ' ' PHE . 0.8 OUTLIER -103.24 159.8 15.23 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.983 -1.008 . . . . 0.0 109.316 178.823 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.767 HD13 ' CB ' ' A' ' 20' ' ' SER . 17.1 mt -46.91 -62.88 1.2 Allowed 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 121.222 -0.191 . . . . 0.0 110.92 -179.639 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.979 ' O ' HG23 ' A' ' 115' ' ' VAL . 2.3 tp-100 -44.38 -62.07 1.3 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.76 0.314 . . . . 0.0 110.499 179.456 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.452 ' O ' ' HB ' ' A' ' 115' ' ' VAL . 0.8 OUTLIER -45.42 -47.76 13.67 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 121.373 0.606 . . . . 0.0 110.436 179.529 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.591 ' CB ' ' CZ ' ' A' ' 55' ' ' PHE . . . -58.83 -65.74 0.61 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.923 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.819 ' NZ ' HG13 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -52.21 -25.72 9.88 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 121.06 -0.256 . . . . 0.0 110.898 179.825 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 1.069 HG22 ' CG ' ' A' ' 75' ' ' LYS . 88.2 t -64.39 -65.03 0.58 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.767 0 CA-C-O 122.082 0.944 . . . . 0.0 109.636 178.616 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.878 ' HB3' HG11 ' A' ' 63' ' ' VAL . 1.7 mp -63.59 -34.06 76.98 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 114.572 -1.194 . . . . 0.0 109.678 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 1.101 HD21 HD23 ' A' ' 8' ' ' LEU . 0.2 OUTLIER -72.67 -23.08 60.84 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.97 179.691 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.451 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 5.7 tt0 -71.84 -44.17 64.29 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 106.521 -1.659 . . . . 0.0 106.521 177.467 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.546 ' HB1' ' H ' ' A' ' 68' ' ' LEU . . . -77.9 -19.11 55.32 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 114.151 -1.386 . . . . 0.0 110.11 177.68 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 1.077 ' HB2' HG12 ' A' ' 63' ' ' VAL . . . -81.19 -48.07 12.59 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.928 179.557 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.735 HD22 ' ND1' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -68.8 -30.52 69.11 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.697 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.451 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 1.0 OUTLIER -74.08 -50.4 19.78 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.615 -0.72 . . . . 0.0 112.29 -179.404 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.08 -31.98 13.32 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -177.848 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -92.1 -65.61 0.99 Allowed 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -178.759 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.46 ' CB ' ' HA ' ' A' ' 121' ' ' LEU . 3.9 t -60.61 -59.05 6.02 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.614 -178.837 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' GLY . . . . . 0.472 ' C ' ' N ' ' A' ' 128' ' ' ARG . . . 53.84 47.88 63.93 Favored Glycine 0 CA--C 1.495 -1.193 0 C-N-CA 120.301 -0.952 . . . . 0.0 111.645 -179.04 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . 45.92 26.23 0.37 Allowed 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 -177.47 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ARG . . . . . 0.472 ' N ' ' C ' ' A' ' 126' ' ' GLY . 0.0 OUTLIER -114.88 -60.13 1.93 Allowed 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 114.739 -1.119 . . . . 0.0 111.208 -178.205 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . -86.16 52.32 4.51 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.739 -179.784 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 15.3 p . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.879 179.888 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.134 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 202' ' ' ASP . . . . . 0.438 ' O ' ' N ' ' B' ' 204' ' ' PTR . 15.5 m-20 -109.45 -84.62 0.55 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.542 0.21 . . . . 0.0 110.895 . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 63.93 -73.01 0.05 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.03 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 204' ' ' PTR . . . . . 0.438 ' N ' ' O ' ' B' ' 202' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -43.47 -88.39 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.877 -179.207 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 206' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -110.89 156.93 39.96 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-O 120.745 0.307 . . . . 0.0 110.919 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 207' ' ' PRO . . . . . 0.411 ' HB3' ' OE1' ' A' ' 11' ' ' GLN . 19.3 Cg_endo -57.09 -177.32 0.07 OUTLIER 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.711 2.274 . . . . 0.0 112.273 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 208' ' ' PHE . . . . . 0.452 ' CE2' ' HA ' ' A' ' 11' ' ' GLN . 68.9 m-85 61.02 154.93 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.927 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.362 0 CA-C-N 116.49 -0.323 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.765 0.317 . . . . 0.0 111.198 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -116.08 -162.78 0.86 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.846 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.708 ' HB2' HD13 ' A' ' 8' ' ' LEU . 10.5 mp -90.01 164.88 14.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.679 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 51.4 p -60.95 -162.77 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.271 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 1.017 HD21 ' HB1' ' A' ' 120' ' ' ALA . 0.0 OUTLIER -93.5 -61.25 1.59 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.619 0.247 . . . . 0.0 111.391 179.811 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.441 ' HB3' ' N ' ' A' ' 129' ' ' GLY . 1.9 p -47.33 -51.06 20.49 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -179.062 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.99 -55.72 15.31 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 121.164 0.507 . . . . 0.0 110.274 -179.346 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 1.06 HD23 HD21 ' A' ' 117' ' ' LEU . 11.6 tp -52.65 -60.06 3.71 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.425 179.309 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.762 ' ND1' HD13 ' A' ' 121' ' ' LEU . 1.7 t-80 -45.63 -56.43 5.2 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.111 178.826 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.5 -43.42 71.78 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.172 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.525 ' HA ' ' CE2' ' B' ' 208' ' ' PHE . 19.9 tp60 -58.86 -65.35 0.68 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.668 179.361 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.643 HG23 HD23 ' A' ' 110' ' ' LEU . 9.2 p -56.56 -45.8 82.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.965 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.707 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 8.8 t -60.49 -55.09 37.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.454 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.3 ttp180 -63.99 -22.73 67.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.091 -179.61 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.484 ' CD1' HG13 ' A' ' 31' ' ' VAL . 7.6 mt -73.16 -63.01 1.27 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.72 -179.535 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.706 HG23 ' HB2' ' A' ' 20' ' ' SER . 0.8 OUTLIER -70.3 -27.0 30.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.3 -179.538 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.403 ' HB2' ' O ' ' A' ' 13' ' ' SER . 8.1 mm-40 -78.14 -16.6 57.79 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.167 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -144.78 42.25 1.33 Allowed 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.84 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 173.56 -69.01 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 179.561 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.721 ' CB ' HD13 ' A' ' 110' ' ' LEU . 14.9 m -70.8 -31.75 68.6 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -178.088 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.458 ' C ' HG22 ' A' ' 16' ' ' VAL . . . 78.04 -57.8 3.96 Favored Glycine 0 CA--C 1.521 0.462 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.933 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.638 ' N ' HG22 ' A' ' 16' ' ' VAL . 0.4 OUTLIER -177.3 30.42 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 120.831 0.348 . . . . 0.0 111.05 -179.879 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -74.81 -157.96 0.07 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.938 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.548 ' HB ' ' HB3' ' A' ' 34' ' ' ASN . 4.2 m -103.53 145.17 30.43 Favored 'General case' 0 C--O 1.231 0.108 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.432 ' HA2' ' O ' ' A' ' 32' ' ' ALA . . . -104.62 134.01 11.8 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.332 -0.937 . . . . 0.0 113.706 -178.46 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 1.0 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -104.96 128.87 53.42 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.932 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.875 HD22 HG21 ' A' ' 58' ' ' THR . 0.9 OUTLIER -104.82 146.55 28.83 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.378 0.608 . . . . 0.0 112.139 -178.863 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.496 HH21 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER 169.22 55.47 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 114.924 -1.035 . . . . 0.0 108.965 179.839 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.509 ' O ' HD11 ' A' ' 3' ' ' LEU . . . 87.52 -5.48 84.95 Favored Glycine 0 CA--C 1.52 0.348 0 N-CA-C 111.231 -0.747 . . . . 0.0 111.231 -177.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -165.46 165.07 19.42 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 179.838 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.484 HG13 ' CD1' ' A' ' 15' ' ' LEU . 0.7 OUTLIER -112.76 120.96 64.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 121.432 0.634 . . . . 0.0 111.213 179.411 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 1.0 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -110.51 166.34 11.07 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.273 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.671 ' HB2' ' OG ' ' A' ' 20' ' ' SER . . . -103.58 137.43 41.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.221 0.534 . . . . 0.0 111.952 -178.81 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.548 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 2.3 t-20 -119.04 121.33 39.61 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.302 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 14.3 ttpp -121.78 -28.72 4.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.146 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -51.17 -77.19 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.961 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.482 HG22 HD22 ' A' ' 34' ' ' ASN . 7.9 t -77.45 -176.51 4.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.465 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 78.2 p -136.42 107.69 6.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.85 0.357 . . . . 0.0 111.235 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.635 ' CD1' HG23 ' A' ' 109' ' ' THR . 0.0 OUTLIER -61.18 -178.77 0.12 Allowed 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.19 179.62 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.472 ' N ' ' CG ' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -171.64 22.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.772 0.32 . . . . 0.0 111.568 179.6 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.52 ' O ' ' CB ' ' A' ' 105' ' ' SER . . . 79.16 -17.0 8.03 Favored Glycine 0 C--O 1.228 -0.255 0 CA-C-O 119.754 -0.47 . . . . 0.0 113.176 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.642 HD12 ' H ' ' A' ' 43' ' ' THR . 0.1 OUTLIER -48.08 178.15 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 117.235 0.517 . . . . 0.0 111.361 -179.935 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.678 ' C ' HD12 ' A' ' 44' ' ' ILE . 29.3 m -118.21 57.49 0.84 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.753 0.311 . . . . 0.0 111.67 -179.043 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.678 HD12 ' C ' ' A' ' 43' ' ' THR . 3.3 mp 69.93 -58.76 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.714 179.592 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.489 ' C ' ' O ' ' A' ' 44' ' ' ILE . . . -18.54 -77.27 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.61 ' HB2' HD13 ' A' ' 42' ' ' LEU . 58.8 m -43.86 -59.36 2.29 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.429 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 168.8 51.6 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.427 -0.892 . . . . 0.0 113.061 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.531 ' HB2' ' CD2' ' A' ' 42' ' ' LEU . . . -110.99 172.7 6.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.893 0.377 . . . . 0.0 111.053 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.476 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 2.2 tpm_? -91.49 158.5 16.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.713 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.707 ' O ' HG23 ' A' ' 54' ' ' VAL . 0.8 OUTLIER -71.92 -22.96 61.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.046 0.451 . . . . 0.0 110.494 179.507 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.536 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 59.9 p -63.3 -62.81 1.44 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.256 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.585 ' HB2' ' HG2' ' A' ' 107' ' ' GLN . 1.5 pm0 -44.86 -60.69 1.92 Allowed 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.592 0.234 . . . . 0.0 111.414 -179.753 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.579 ' HG2' HD11 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -52.35 -50.71 61.79 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.702 -0.226 . . . . 0.0 110.997 179.931 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.941 ' O ' HG23 ' A' ' 58' ' ' THR . 73.5 t -57.55 -39.43 69.32 Favored 'Isoleucine or valine' 0 C--O 1.231 0.105 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.645 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.518 ' O ' HG12 ' A' ' 59' ' ' VAL . 0.3 OUTLIER -61.48 -45.15 95.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.581 178.756 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.641 ' HB2' ' C ' ' A' ' 107' ' ' GLN . . . -55.11 -45.82 75.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.577 179.337 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -64.3 -41.96 96.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.045 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.941 HG23 ' O ' ' A' ' 54' ' ' VAL . 9.9 p -61.56 -57.78 10.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.882 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 1.044 HG23 HD12 ' A' ' 117' ' ' LEU . 8.7 p -65.24 -49.72 77.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.08 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.819 HD13 HD23 ' A' ' 103' ' ' LEU . 6.2 tp -50.79 -40.2 54.63 Favored 'General case' 0 C--O 1.231 0.125 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.394 179.497 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 70.2 m -67.83 -53.49 26.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.331 179.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' HIS . . . . . 0.482 ' HB3' ' CD2' ' A' ' 5' ' ' LEU . 0.3 OUTLIER -60.83 -20.63 62.04 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 121.079 0.466 . . . . 0.0 110.299 179.598 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 1.086 HG13 HG11 ' A' ' 66' ' ' VAL . 3.4 t -109.61 55.07 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.491 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.493 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . -81.04 39.6 0.51 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.44 -179.549 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.621 ' HA ' HG13 ' A' ' 99' ' ' VAL . 3.9 m-20 153.63 -65.38 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 122.652 0.381 . . . . 0.0 111.123 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 1.086 HG11 HG13 ' A' ' 63' ' ' VAL . 35.5 m 42.36 -171.09 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -179.699 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.748 HG13 ' HG3' ' A' ' 123' ' ' GLN . 16.8 m -145.2 67.64 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 CA-C-O 121.133 0.492 . . . . 0.0 110.877 -178.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.713 ' N ' ' O ' ' A' ' 98' ' ' SER . 0.7 OUTLIER -60.24 107.73 0.69 Allowed 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.995 -179.391 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.715 HG22 ' ND2' ' A' ' 97' ' ' ASN . 7.2 p -80.17 177.62 8.82 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.244 179.197 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -35.42 -37.05 0.08 Allowed 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.952 0.406 . . . . 0.0 111.401 -179.645 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.467 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 4.8 tp10 -68.38 -65.11 0.74 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.023 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.699 ' HB3' HD23 ' A' ' 68' ' ' LEU . 65.0 m-20 -58.75 -32.26 69.1 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.414 -179.622 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -64.46 -57.82 8.17 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.626 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.528 ' HA ' ' CG ' ' A' ' 77' ' ' LEU . . . -56.24 -27.88 56.54 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 177.019 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 1.073 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.4 OUTLIER -61.78 -49.08 77.81 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 114.334 -1.303 . . . . 0.0 110.976 179.184 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.765 HD13 HD23 ' A' ' 90' ' ' LEU . 0.3 OUTLIER -68.27 -52.63 31.63 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.775 0.322 . . . . 0.0 110.729 179.572 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.57 ' O ' HG12 ' A' ' 81' ' ' VAL . 3.8 pp -60.61 -26.86 67.31 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.095 -179.718 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.582 ' HA ' HG12 ' A' ' 81' ' ' VAL . 22.9 tt0 -75.87 -47.96 23.33 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.16 0.505 . . . . 0.0 110.4 179.311 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 3.1 t -61.1 -33.24 73.04 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.94 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.5 HG22 ' HA ' ' A' ' 77' ' ' LEU . 14.2 t -84.36 -46.82 11.34 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.614 -179.641 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.582 HG12 ' HA ' ' A' ' 78' ' ' GLN . 7.4 p -63.32 -30.53 49.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.72 0.295 . . . . 0.0 111.581 -179.48 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.91 -60.89 2.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.05 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -162.55 87.73 0.61 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.684 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.461 ' ND2' ' CZ ' ' A' ' 39' ' ' PHE . 8.9 t-20 -164.53 178.17 7.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.116 -179.781 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 19.2 tp -111.08 31.32 6.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.764 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 36.4 m120 55.38 88.12 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.594 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ASN . . . . . 0.403 ' ND2' ' HA3' ' A' ' 41' ' ' GLY . 2.3 p-10 -120.56 -10.36 9.25 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.894 -179.362 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.642 ' CE1' ' HE3' ' A' ' 108' ' ' MET . 25.8 m-85 -100.64 139.94 35.61 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 120.399 -0.52 . . . . 0.0 110.924 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.761 ' CG ' HG13 ' A' ' 101' ' ' VAL . 1.0 OUTLIER -117.3 149.77 39.9 Favored 'General case' 0 N--CA 1.428 -1.529 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 -179.267 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.767 HD12 ' N ' ' A' ' 90' ' ' LEU . 0.0 OUTLIER -149.36 161.72 41.5 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 121.693 0.758 . . . . 0.0 112.696 -178.883 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.42 ' O ' ' HB3' ' A' ' 98' ' ' SER . 2.6 ptm180 -140.95 135.29 31.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.501 -1.227 . . . . 0.0 108.062 178.301 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.561 ' O ' HG13 ' A' ' 93' ' ' VAL . 26.4 p -104.9 146.49 28.94 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.85 1.055 . . . . 0.0 113.85 -177.604 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.561 HG13 ' O ' ' A' ' 92' ' ' SER . 6.7 m -161.91 -131.33 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.643 0 CA-C-N 113.889 -1.505 . . . . 0.0 108.536 178.633 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.506 ' O ' ' O ' ' A' ' 93' ' ' VAL . . . 47.89 176.25 0.01 OUTLIER Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.468 -0.872 . . . . 0.0 112.683 179.135 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -84.81 45.23 1.13 Allowed 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 176.754 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.455 ' O ' ' HB ' ' A' ' 69' ' ' THR . . . 114.38 43.71 0.75 Allowed Glycine 0 N--CA 1.441 -0.968 0 N-CA-C 109.141 -1.583 . . . . 0.0 109.141 -176.773 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.715 ' ND2' HG22 ' A' ' 69' ' ' THR . 0.9 OUTLIER -142.2 167.15 22.8 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 -178.703 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.713 ' O ' ' N ' ' A' ' 68' ' ' LEU . 3.0 m -148.42 157.16 43.3 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.914 -178.766 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.621 HG13 ' HA ' ' A' ' 65' ' ' ASN . 2.5 t -104.08 150.17 7.41 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.043 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.714 HD13 ' CG ' ' A' ' 116' ' ' LEU . 0.1 OUTLIER -103.91 127.77 51.43 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 122.059 0.933 . . . . 0.0 113.198 -178.505 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.761 HG13 ' CG ' ' A' ' 89' ' ' ASP . 1.5 p -131.7 104.12 8.04 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 N-CA-C 104.295 -2.483 . . . . 0.0 104.295 174.821 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.688 ' O ' HD23 ' A' ' 103' ' ' LEU . 32.8 p -148.22 165.28 31.42 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 118.785 -1.166 . . . . 0.0 113.653 -174.621 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.872 HD13 ' O ' ' A' ' 105' ' ' SER . 0.2 OUTLIER 157.2 -83.34 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 113.661 -1.609 . . . . 0.0 111.73 176.509 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.501 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 52.4 28.12 5.53 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -179.162 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.872 ' O ' HD13 ' A' ' 103' ' ' LEU . 13.3 m 140.04 165.96 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 -178.086 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.421 ' HB3' ' HB2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -104.85 101.92 11.49 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 119.677 -0.809 . . . . 0.0 112.853 -178.093 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.641 ' C ' ' HB2' ' A' ' 56' ' ' ALA . 0.2 OUTLIER -168.61 164.73 12.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.41 177.694 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.642 ' HE3' ' CE1' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -165.58 141.91 5.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.118 0.485 . . . . 0.0 111.885 179.293 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.635 HG23 ' CD1' ' A' ' 39' ' ' PHE . 0.8 OUTLIER -104.32 165.22 11.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.258 179.47 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.721 HD13 ' CB ' ' A' ' 20' ' ' SER . 3.4 mt -49.19 -58.04 5.69 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.692 0.282 . . . . 0.0 110.502 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.953 ' O ' HG23 ' A' ' 115' ' ' VAL . 3.6 tp-100 -50.42 -64.77 0.71 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.849 0.357 . . . . 0.0 110.839 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.475 ' O ' ' HB ' ' A' ' 115' ' ' VAL . 0.8 OUTLIER -44.34 -46.67 9.41 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.17 0.51 . . . . 0.0 110.95 179.847 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.603 ' HB3' HG21 ' A' ' 12' ' ' VAL . . . -55.6 -62.45 1.68 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.424 179.416 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.707 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 3.8 ptpp? -57.83 -27.01 62.8 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.037 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 1.073 HG22 ' CG ' ' A' ' 75' ' ' LYS . 99.4 t -61.05 -62.66 1.01 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.728 0 CA-C-O 122.149 0.976 . . . . 0.0 110.25 179.569 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.936 ' HB3' HG21 ' A' ' 63' ' ' VAL . 0.1 OUTLIER -68.64 -32.7 72.75 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.156 -179.199 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 1.06 HD21 HD23 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -73.37 -22.9 60.17 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 120.901 0.382 . . . . 0.0 110.49 179.359 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.565 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 2.2 tp10 -72.49 -43.44 63.66 Favored 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 106.243 -1.762 . . . . 0.0 106.243 177.09 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.467 ' HB1' ' HB ' ' A' ' 66' ' ' VAL . . . -75.46 -22.55 57.19 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 114.309 -1.314 . . . . 0.0 109.881 177.424 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 1.017 ' HB1' HD21 ' A' ' 5' ' ' LEU . . . -79.45 -49.93 11.57 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.503 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.762 HD13 ' ND1' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -63.91 -38.32 90.64 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.86 179.806 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.565 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -79.72 -33.93 40.47 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -179.285 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.748 ' HG3' HG13 ' A' ' 67' ' ' VAL . 12.1 tm0? -95.12 -19.43 20.12 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -177.826 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -93.6 -68.76 0.78 Allowed 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 119.743 -0.783 . . . . 0.0 111.976 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.482 ' HB2' ' HA2' ' A' ' 129' ' ' GLY . 2.0 t -98.63 -65.43 0.96 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.649 0.737 . . . . 0.0 111.31 179.271 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 102.43 94.16 2.25 Favored Glycine 0 CA--C 1.494 -1.272 0 CA-C-N 114.594 -1.185 . . . . 0.0 111.747 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . 52.27 21.84 1.79 Allowed 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 -177.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -150.33 17.06 0.83 Allowed 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 115.478 -0.783 . . . . 0.0 112.616 -179.285 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' GLY . . . . . 0.482 ' HA2' ' HB2' ' A' ' 125' ' ' SER . . . -65.33 75.55 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.615 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 35.3 m . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.848 179.814 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.155 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -129.9 31.53 4.69 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.866 0.365 . . . . 0.0 110.925 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 62.62 122.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.891 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 204' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 57.6 38.15 27.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.825 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 206' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -127.05 58.26 28.51 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.986 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -53.53 149.54 30.64 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.541 2.161 . . . . 0.0 111.721 179.561 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 208' ' ' PHE . . . . . 0.525 ' CE2' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -61.89 -116.51 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.988 -179.907 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 209' ' ' NH2 . . . . . 0.464 ' N ' ' CD1' ' B' ' 208' ' ' PHE . . . . . . . . 0 C--N 1.33 -0.279 0 O-C-N 122.416 -0.177 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.6 mmt . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.824 0.345 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -148.37 -165.39 2.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.868 180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.833 ' HB2' HD13 ' A' ' 8' ' ' LEU . 4.7 mp -78.18 -175.29 4.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.623 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -103.04 153.13 20.57 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.01 179.201 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.756 ' HA ' HD23 ' A' ' 117' ' ' LEU . 75.4 mt -47.02 -61.83 1.69 Allowed 'General case' 0 CA--C 1.509 -0.607 0 CA-C-O 121.499 0.666 . . . . 0.0 110.993 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.546 ' HA ' HD13 ' A' ' 121' ' ' LEU . 5.2 t -42.77 -61.6 1.22 Allowed 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.278 -179.282 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -69.57 -56.74 6.48 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.971 0.415 . . . . 0.0 110.867 -179.42 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 1.056 HD23 HD21 ' A' ' 117' ' ' LEU . 23.5 tp -45.54 -45.84 13.66 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.751 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.748 ' CG ' HD22 ' A' ' 121' ' ' LEU . 56.4 t-80 -66.06 -40.27 90.77 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.424 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.4 -53.74 41.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.776 -1.102 . . . . 0.0 111.198 179.646 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.98 ' HG3' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -69.16 -55.39 10.79 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 120.791 0.329 . . . . 0.0 111.235 -179.795 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.875 HG22 HD13 ' A' ' 110' ' ' LEU . 3.8 p -51.9 -49.63 36.59 Favored 'Isoleucine or valine' 0 C--O 1.242 0.694 0 CA-C-O 121.22 0.533 . . . . 0.0 110.659 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.785 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 52.9 m -62.73 -41.89 99.4 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.557 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.475 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -67.25 -17.7 64.91 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.385 179.629 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.841 HD12 ' HA ' ' A' ' 12' ' ' VAL . 6.1 mt -83.14 -61.43 1.86 Allowed 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -179.795 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.566 ' CG2' ' HB3' ' A' ' 110' ' ' LEU . 0.9 OUTLIER -69.38 -34.27 61.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 C-N-CA 120.015 -0.674 . . . . 0.0 111.34 -179.068 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.45 ' HB2' ' O ' ' A' ' 13' ' ' SER . 3.5 mm-40 -69.62 -16.16 63.33 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.176 -179.507 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.475 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 2.8 pt20 -163.57 56.86 0.17 Allowed 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 120.854 -0.338 . . . . 0.0 111.44 179.301 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 176.52 -63.1 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.454 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.609 ' OG ' ' HB1' ' A' ' 33' ' ' ALA . 0.5 OUTLIER -79.08 -80.47 0.12 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.374 -179.324 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.556 ' H ' HG22 ' A' ' 16' ' ' VAL . . . 113.28 -18.7 20.69 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.481 -179.599 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.63 ' O ' ' O ' ' A' ' 23' ' ' CYS . 21.9 p-10 166.46 -14.98 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.355 0.262 . . . . 0.0 111.388 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.63 ' O ' ' O ' ' A' ' 22' ' ' ASP . 58.0 m -42.13 -164.75 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.368 0.667 . . . . 0.0 112.718 -179.386 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.562 ' HA ' ' HA ' ' A' ' 109' ' ' THR . 20.4 m -103.75 162.15 13.33 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.781 -179.387 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.678 ' HA2' HD23 ' A' ' 110' ' ' LEU . . . -105.12 135.7 12.71 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.495 -0.86 . . . . 0.0 113.912 -178.666 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.945 ' HB3' ' HB3' ' A' ' 32' ' ' ALA . 1.3 tmmm? -104.92 119.52 39.21 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 178.865 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.65 HD23 ' N ' ' A' ' 28' ' ' ARG . 1.6 tt -104.63 165.25 11.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.665 -178.881 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.65 ' N ' HD23 ' A' ' 27' ' ' LEU . 0.0 OUTLIER 140.1 56.2 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.618 1.167 . . . . 0.0 109.492 -179.862 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.729 ' C ' HD11 ' A' ' 3' ' ' LEU . . . 88.53 -4.94 85.15 Favored Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.877 -0.678 . . . . 0.0 111.764 -178.894 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.599 ' HB2' ' HA ' ' B' ' 207' ' ' PRO . 0.0 OUTLIER -165.7 165.46 18.6 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 -179.95 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.98 HG12 ' HG3' ' A' ' 11' ' ' GLN . 3.7 p -112.58 136.65 48.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.251 0.548 . . . . 0.0 110.911 178.86 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.945 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . . . -129.3 167.43 17.72 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.629 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.609 ' HB1' ' OG ' ' A' ' 20' ' ' SER . . . -102.77 121.3 42.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.235 0.541 . . . . 0.0 111.588 -178.752 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.526 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 2.4 t30 -105.05 115.7 30.72 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.542 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.02 -25.78 15.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.391 -179.848 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.54 ' O ' ' HB ' ' A' ' 37' ' ' THR . 14.0 mm-40 -42.93 -82.21 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.717 -179.314 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.865 HG23 HG23 ' A' ' 38' ' ' THR . 7.5 t 172.0 -168.79 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.879 0.371 . . . . 0.0 110.945 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.865 HG23 HG23 ' A' ' 37' ' ' THR . 2.8 p 62.77 121.04 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.96 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.713 ' O ' ' HB3' ' A' ' 107' ' ' GLN . 11.3 p90 169.15 -31.67 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.688 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.57 ' NE2' ' O ' ' A' ' 40' ' ' GLN . 0.0 OUTLIER -54.78 67.99 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.602 -0.727 . . . . 0.0 112.478 -178.704 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.605 ' N ' ' O ' ' A' ' 39' ' ' PHE . . . 36.01 87.15 0.01 OUTLIER Glycine 0 C--N 1.332 0.31 0 CA-C-N 116.018 -0.537 . . . . 0.0 113.621 179.032 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.627 HD23 ' HB2' ' A' ' 48' ' ' ALA . 0.1 OUTLIER -141.8 169.99 16.55 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 179.168 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.596 ' C ' HD12 ' A' ' 44' ' ' ILE . 0.7 OUTLIER -103.28 41.31 1.28 Allowed 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 -177.698 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.921 HG23 ' O ' ' A' ' 48' ' ' ALA . 3.4 mp 53.54 5.14 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 179.012 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.433 ' H ' ' C ' ' A' ' 43' ' ' THR . . . -74.41 -41.29 61.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.928 0.394 . . . . 0.0 110.846 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.583 ' H ' HD11 ' A' ' 42' ' ' LEU . 0.5 OUTLIER -72.31 -32.18 66.34 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.477 179.664 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.447 ' O ' HG21 ' A' ' 38' ' ' THR . . . 142.62 34.33 0.1 OUTLIER Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.618 -0.801 . . . . 0.0 113.381 179.57 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.921 ' O ' HG23 ' A' ' 44' ' ' ILE . . . -85.89 149.78 24.98 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 117.118 0.459 . . . . 0.0 111.049 179.624 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 7.4 mtm180 -81.45 159.89 24.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.738 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.609 ' O ' HG23 ' A' ' 54' ' ' VAL . 0.2 OUTLIER -67.32 -21.38 65.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.952 179.873 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.469 ' HB2' ' HA ' ' A' ' 26' ' ' LYS . 1.0 OUTLIER -61.0 -65.1 0.75 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.379 -179.585 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.462 ' N ' ' OG ' ' A' ' 51' ' ' SER . 0.0 OUTLIER -49.08 -65.84 0.5 Allowed 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.977 0.417 . . . . 0.0 110.809 -179.824 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.643 ' HA ' ' HA ' ' A' ' 107' ' ' GLN . 0.0 OUTLIER -43.82 -51.25 7.51 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.094 179.872 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.609 HG23 ' O ' ' A' ' 50' ' ' GLU . 53.4 t -61.13 -31.14 49.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.083 0.468 . . . . 0.0 110.244 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.734 ' HB3' ' HB3' ' A' ' 108' ' ' MET . 0.3 OUTLIER -66.61 -48.0 70.9 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.615 179.649 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.798 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -60.45 -45.87 92.11 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.966 0.412 . . . . 0.0 110.201 179.33 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 21.1 mm-40 -55.26 -55.55 30.09 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.604 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -67.38 -30.54 70.35 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.005 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.768 HG11 HD23 ' A' ' 116' ' ' LEU . 0.9 OUTLIER -60.56 -57.09 13.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.258 -179.556 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 1.009 HD21 ' CE2' ' A' ' 88' ' ' TYR . 42.3 mt -75.49 -34.71 60.89 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 121.339 0.59 . . . . 0.0 111.335 -179.666 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 45.5 m -57.83 -42.12 83.71 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.18 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' HIS . . . . . 0.486 ' HB3' HD21 ' A' ' 5' ' ' LEU . 0.1 OUTLIER -75.62 -50.27 16.02 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-O 120.751 0.31 . . . . 0.0 110.611 179.94 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.922 HG12 ' CB ' ' A' ' 120' ' ' ALA . 11.6 m -60.06 -50.37 80.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.943 0.401 . . . . 0.0 110.55 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.522 ' N ' HG23 ' A' ' 63' ' ' VAL . . . 34.92 34.71 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.56 -0.745 . . . . 0.0 112.148 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.72 ' O ' HG22 ' A' ' 66' ' ' VAL . 0.5 OUTLIER 163.47 -81.12 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -179.679 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.834 HG13 ' HB ' ' A' ' 63' ' ' VAL . 11.3 m 54.63 -160.15 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 122.725 0.41 . . . . 0.0 110.911 -177.564 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.573 HG22 ' CB ' ' A' ' 97' ' ' ASN . 9.9 p -151.72 -28.02 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.72 HD22 ' CD1' ' A' ' 76' ' ' LEU . 0.3 OUTLIER 32.27 95.24 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.976 -0.556 . . . . 0.0 112.407 179.193 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.668 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 14.5 p -66.11 -117.67 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.69 179.701 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.455 ' N ' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER -95.06 -38.94 10.4 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.062 0.458 . . . . 0.0 110.963 179.974 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -64.0 -61.12 2.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.089 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.717 ' HB3' HD23 ' A' ' 68' ' ' LEU . 0.8 OUTLIER -59.27 -30.26 68.16 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.21 -179.646 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.455 HG22 ' HB3' ' A' ' 98' ' ' SER . 0.9 OUTLIER -63.39 -59.05 5.2 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 178.323 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -57.52 -24.75 57.78 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.292 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 1.006 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.1 OUTLIER -62.25 -56.88 14.2 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 114.742 -1.117 . . . . 0.0 110.066 178.773 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.727 HD21 HD13 ' A' ' 100' ' ' LEU . 0.4 OUTLIER -59.23 -38.58 80.32 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.33 0.586 . . . . 0.0 109.438 178.613 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.416 ' O ' HG23 ' A' ' 81' ' ' VAL . 0.1 OUTLIER -57.9 -48.7 79.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.078 -0.965 . . . . 0.0 111.35 -179.817 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.8 mm-40 -72.42 -42.42 65.11 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.311 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 4.7 p -68.91 -27.63 65.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.272 -179.704 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.492 HG22 ' HA ' ' A' ' 86' ' ' ASN . 81.2 m -95.39 -38.66 10.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.573 -179.626 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.518 HG12 ' O ' ' A' ' 81' ' ' VAL . 17.6 t -95.06 -4.38 10.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -179.092 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -34.81 -57.87 0.53 Allowed 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -179.426 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 2.9 p-80 -176.95 44.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.869 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 23.7 m120 -158.27 171.2 20.63 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.998 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -59.95 130.12 45.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.072 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.492 ' HA ' HG22 ' A' ' 80' ' ' THR . 0.7 OUTLIER -60.7 110.0 1.19 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.169 179.396 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ASN . . . . . 0.414 HD22 ' N ' ' A' ' 41' ' ' GLY . 14.2 p30 -103.91 -19.4 14.25 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 116.078 -0.51 . . . . 0.0 112.062 -178.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 1.009 ' CE2' HD21 ' A' ' 60' ' ' LEU . 2.4 m-85 -99.62 148.95 23.78 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 120.329 -0.548 . . . . 0.0 111.485 -179.331 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.686 ' O ' ' O ' ' A' ' 101' ' ' VAL . 0.0 OUTLIER -119.68 148.64 43.14 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.509 -179.116 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.689 HD12 ' N ' ' A' ' 90' ' ' LEU . 0.0 OUTLIER -148.9 150.61 33.25 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.307 0.575 . . . . 0.0 112.18 -179.335 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 18.0 tpt180 -121.94 141.65 51.1 Favored 'General case' 0 C--O 1.221 -0.435 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.074 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.805 ' O ' HG13 ' A' ' 93' ' ' VAL . 55.4 p -104.71 145.85 29.78 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.879 1.066 . . . . 0.0 113.879 -177.866 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.805 HG13 ' O ' ' A' ' 92' ' ' SER . 3.6 m -171.12 -125.76 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.553 0 CA-C-N 113.297 -1.774 . . . . 0.0 107.908 179.204 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.599 ' HA3' ' ND2' ' A' ' 97' ' ' ASN . . . 31.47 39.19 0.04 OUTLIER Glycine 0 CA--C 1.522 0.528 0 N-CA-C 114.583 0.593 . . . . 0.0 114.583 178.079 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 41.44 31.18 0.16 Allowed 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 117.314 0.557 . . . . 0.0 111.203 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 139.69 0.18 2.07 Favored Glycine 0 N--CA 1.447 -0.577 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.919 -179.247 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.668 ' HA ' ' HA ' ' A' ' 69' ' ' THR . 0.0 OUTLIER -108.87 166.22 10.98 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.847 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.526 ' O ' ' O ' ' A' ' 67' ' ' VAL . 1.5 t -137.39 165.4 26.32 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.431 0.634 . . . . 0.0 111.165 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -103.68 147.63 9.67 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 179.225 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.733 HD23 HG21 ' A' ' 63' ' ' VAL . 7.6 tp -103.77 105.76 16.06 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 121.909 0.862 . . . . 0.0 113.302 -177.646 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.686 ' O ' ' O ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -123.14 120.57 60.77 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 N-CA-C 103.743 -2.688 . . . . 0.0 103.743 175.467 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.716 ' OG ' HD11 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -157.96 166.17 33.27 Favored 'General case' 0 C--N 1.305 -1.341 0 C-N-CA 117.529 -1.669 . . . . 0.0 114.395 -173.895 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.984 HD23 HD12 ' A' ' 60' ' ' LEU . 0.1 OUTLIER 161.9 -90.16 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.105 0 CA-C-N 113.502 -1.681 . . . . 0.0 111.835 175.59 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.555 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 53.75 27.61 7.2 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 -179.416 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.555 ' CB ' ' O ' ' A' ' 104' ' ' ARG . 17.6 m 133.99 160.5 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.552 1.141 . . . . 0.0 108.1 -178.543 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.569 ' O ' ' HG3' ' A' ' 107' ' ' GLN . 1.0 OUTLIER -104.82 101.0 10.62 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 120.038 -0.665 . . . . 0.0 112.243 -178.703 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.798 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 5.5 mt-30 -169.85 159.82 8.16 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.415 177.392 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.734 ' HB3' ' HB3' ' A' ' 55' ' ' PHE . 2.4 tpt -158.56 153.73 25.47 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.629 0.604 . . . . 0.0 112.629 179.683 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.7 HG22 ' CD1' ' A' ' 39' ' ' PHE . 0.1 OUTLIER -115.47 165.29 13.15 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.857 178.662 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.875 HD13 HG22 ' A' ' 12' ' ' VAL . 0.2 OUTLIER -50.94 -55.78 15.58 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.696 0.284 . . . . 0.0 111.288 -179.933 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.743 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 3.3 tp-100 -49.17 -65.96 0.48 Allowed 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.355 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.782 ' O ' HD22 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -49.57 -56.94 8.14 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.025 0.44 . . . . 0.0 110.83 -179.224 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.622 ' HB1' ' CZ ' ' A' ' 55' ' ' PHE . . . -40.44 -54.57 2.44 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.843 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.785 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -67.31 -33.34 75.07 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.099 179.708 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 1.006 HG22 ' CG ' ' A' ' 75' ' ' LYS . 54.9 t -54.36 -61.69 0.91 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.746 0 CA-C-O 121.756 0.788 . . . . 0.0 110.72 179.697 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.782 HD22 ' O ' ' A' ' 112' ' ' ASP . 0.1 OUTLIER -62.26 -43.2 99.37 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.177 -179.534 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 1.056 HD21 HD23 ' A' ' 8' ' ' LEU . 0.7 OUTLIER -66.99 -19.08 65.66 Favored 'General case' 0 CA--C 1.51 -0.565 0 C-N-CA 120.764 -0.375 . . . . 0.0 111.156 179.624 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.744 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 10.1 tt0 -70.7 -54.18 12.81 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 106.095 -1.817 . . . . 0.0 106.095 176.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.511 ' O ' ' HB2' ' A' ' 123' ' ' GLN . . . -69.83 -18.86 63.47 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.478 -1.237 . . . . 0.0 110.675 177.819 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.922 ' CB ' HG12 ' A' ' 63' ' ' VAL . . . -79.88 -62.72 1.6 Allowed 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 121.151 0.5 . . . . 0.0 110.432 179.543 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.748 HD22 ' CG ' ' A' ' 9' ' ' HIS . 0.1 OUTLIER -60.01 -24.78 64.76 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.525 -179.619 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.744 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -87.01 -41.69 13.68 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -179.903 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.511 ' HB2' ' O ' ' A' ' 119' ' ' ALA . 1.1 tm0? -84.8 -29.76 25.14 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -178.463 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -95.24 -65.97 0.94 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.543 0.571 . . . . 0.0 112.543 -178.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.35 -4.71 44.93 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.423 -178.17 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' GLY . . . . . 0.579 ' N ' ' O ' ' A' ' 121' ' ' LEU . . . 42.53 74.49 0.18 Allowed Glycine 0 C--N 1.331 0.289 0 C-N-CA 120.518 -0.848 . . . . 0.0 111.788 -178.806 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.571 ' HB3' ' O ' ' A' ' 126' ' ' GLY . . . 80.18 -48.87 0.34 Allowed 'General case' 0 CA--C 1.52 -0.176 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 -177.729 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ARG . . . . . 0.428 ' HG2' ' CB ' ' A' ' 6' ' ' SER . 0.0 OUTLIER 172.38 106.75 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.646 178.229 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 44.03 25.7 0.72 Allowed Glycine 0 CA--C 1.519 0.306 0 CA-C-N 115.62 -0.718 . . . . 0.0 113.042 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.187 -0.911 . . . . 0.0 110.82 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.097 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -149.4 -177.39 5.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.789 0.328 . . . . 0.0 110.862 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -149.37 -172.02 4.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.886 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 204' ' ' PTR . . . . . 0.456 ' HE1' ' CE ' ' A' ' 26' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 53.41 -91.19 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.331 178.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 206' ' ' ASP . . . . . 0.42 ' HA ' ' HD2' ' B' ' 207' ' ' PRO . 17.9 m-20 -45.53 105.88 0.5 Allowed Pre-proline 0 N--CA 1.463 0.186 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -178.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 207' ' ' PRO . . . . . 0.599 ' HA ' ' HB2' ' A' ' 30' ' ' ASN . 12.3 Cg_endo -55.77 -177.35 0.05 OUTLIER 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 122.438 2.092 . . . . 0.0 112.026 179.566 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 208' ' ' PHE . . . . . 0.445 ' HA ' ' HB3' ' A' ' 11' ' ' GLN . 25.6 m-85 61.9 -82.11 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.956 179.869 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.657 -0.247 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.9 ptt? . . . . . 0 N--CA 1.488 1.446 0 CA-C-O 120.658 0.266 . . . . 0.0 111.412 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.626 ' CG ' HD21 ' A' ' 27' ' ' LEU . 30.4 t30 -125.8 168.04 14.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.874 0.369 . . . . 0.0 110.679 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.719 HD11 ' C ' ' A' ' 29' ' ' GLY . 0.3 OUTLIER -66.57 172.28 4.3 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.374 -179.487 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 53.5 p -74.0 -151.34 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.877 179.165 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.838 HD23 ' CE1' ' A' ' 9' ' ' HIS . 1.1 mt -95.27 -66.56 0.9 Allowed 'General case' 0 CA--C 1.504 -0.826 0 CA-C-O 121.531 0.681 . . . . 0.0 111.757 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.524 ' HB2' ' CG ' ' A' ' 128' ' ' ARG . 0.0 OUTLIER -35.73 -46.78 0.46 Allowed 'General case' 0 N--CA 1.435 -1.223 0 CA-C-N 115.205 -0.907 . . . . 0.0 112.914 -178.422 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ASP . . . . . 0.421 ' HB2' ' CG ' ' B' ' 207' ' ' PRO . 0.7 OUTLIER -78.97 -42.49 26.68 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -179.584 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.858 HD23 HD21 ' A' ' 117' ' ' LEU . 11.2 tp -64.23 -35.47 80.93 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.545 0.688 . . . . 0.0 110.868 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 1.006 ' CD2' HD23 ' A' ' 117' ' ' LEU . 3.4 m170 -79.62 -43.1 23.52 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.727 -1.124 . . . . 0.0 110.873 -178.917 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.492 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 5.2 mmt85 -60.2 -37.57 80.66 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 178.375 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.836 ' HG2' HG13 ' A' ' 31' ' ' VAL . 5.9 tt0 -65.59 -65.91 0.61 Allowed 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.455 178.665 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.757 ' O ' HG12 ' A' ' 16' ' ' VAL . 7.4 p -55.08 -48.11 76.39 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.517 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.504 ' N ' HG13 ' A' ' 12' ' ' VAL . 83.9 p -54.81 -60.05 3.9 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.383 -179.454 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.492 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -53.97 -48.19 70.58 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -178.698 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.942 ' CD1' HD22 ' A' ' 110' ' ' LEU . 0.2 OUTLIER -60.28 -57.75 11.43 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 119.61 -0.836 . . . . 0.0 111.084 -179.267 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.828 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 9.9 p -69.28 -11.67 15.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -178.627 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.729 ' HG2' ' HE3' ' A' ' 114' ' ' LYS . 3.8 mm-40 -95.6 -4.36 44.68 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -148.83 -47.17 0.15 Allowed 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -87.81 -61.33 1.74 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -178.888 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.828 ' HB2' ' HA ' ' A' ' 16' ' ' VAL . 4.6 m -73.76 -47.24 40.5 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.037 -0.529 . . . . 0.0 112.318 -178.479 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 85.07 -39.85 2.99 Favored Glycine 0 CA--C 1.519 0.308 0 C-N-CA 120.519 -0.848 . . . . 0.0 111.782 -178.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.754 ' O ' HD12 ' A' ' 110' ' ' LEU . 7.5 t70 -170.59 -66.44 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.569 ' O ' ' O ' ' A' ' 22' ' ' ASP . 0.1 OUTLIER 28.46 -159.22 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.624 0.769 . . . . 0.0 112.506 178.945 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.746 ' HA ' HG22 ' A' ' 109' ' ' THR . 0.1 OUTLIER -104.03 156.08 18.15 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.063 -0.718 . . . . 0.0 109.063 179.005 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.444 ' H ' ' HA ' ' A' ' 109' ' ' THR . . . -104.68 119.69 6.33 Favored Glycine 0 N--CA 1.443 -0.85 0 C-N-CA 120.172 -1.013 . . . . 0.0 113.184 -178.551 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.99 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -104.58 115.5 30.46 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 178.67 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.626 HD21 ' CG ' ' A' ' 2' ' ' ASN . 2.8 tt -110.09 151.8 26.77 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.574 0.702 . . . . 0.0 112.605 -177.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.462 ' HG2' ' C ' ' A' ' 27' ' ' LEU . 4.9 ptp180 160.78 52.49 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 114.63 -1.168 . . . . 0.0 108.888 179.7 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.719 ' C ' HD11 ' A' ' 3' ' ' LEU . . . 100.76 -6.81 57.27 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.137 -178.24 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.414 ' HA ' ' NE2' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -166.36 165.55 17.14 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 179.868 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.836 HG13 ' HG2' ' A' ' 11' ' ' GLN . 0.2 OUTLIER -116.77 122.53 70.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.227 0.537 . . . . 0.0 110.432 178.709 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.99 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -120.22 167.1 12.6 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.008 -179.387 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.753 ' HB2' ' OG ' ' A' ' 20' ' ' SER . . . -102.2 127.72 49.02 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.274 0.559 . . . . 0.0 111.542 -179.024 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.425 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 4.4 t-20 -111.89 132.53 54.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.643 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.1 -22.04 3.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.228 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -57.72 -23.52 52.29 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.427 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 4.6 t -154.97 155.04 33.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.062 0.458 . . . . 0.0 110.626 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 23.2 p -81.84 -122.63 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.609 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.551 ' CZ ' HG23 ' A' ' 109' ' ' THR . 0.2 OUTLIER -176.32 -85.48 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 121.351 -0.14 . . . . 0.0 111.131 179.962 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.537 ' O ' ' C ' ' A' ' 41' ' ' GLY . 0.0 OUTLIER 56.06 88.68 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 122.45 0.3 . . . . 0.0 111.141 179.667 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.537 ' C ' ' O ' ' A' ' 40' ' ' GLN . . . 14.4 98.41 0.0 OUTLIER Glycine 0 C--N 1.346 1.108 0 O-C-N 123.498 0.499 . . . . 0.0 112.738 -179.193 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.819 HD11 ' HB2' ' A' ' 46' ' ' SER . 6.2 tp -151.08 159.9 44.22 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.481 -0.192 . . . . 0.0 110.481 -178.157 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.447 ' C ' ' H ' ' A' ' 45' ' ' ALA . 0.0 OUTLIER -107.37 33.1 4.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.942 0.401 . . . . 0.0 111.282 -179.457 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.747 HD12 ' HB3' ' A' ' 48' ' ' ALA . 0.9 OUTLIER 59.13 -0.54 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.13 179.777 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.447 ' H ' ' C ' ' A' ' 43' ' ' THR . . . -77.97 -40.94 37.74 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.914 0.388 . . . . 0.0 110.719 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.819 ' HB2' HD11 ' A' ' 42' ' ' LEU . 0.5 OUTLIER -71.25 -31.16 67.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.712 179.81 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 143.92 52.92 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.989 179.634 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.747 ' HB3' HD12 ' A' ' 44' ' ' ILE . . . -121.09 -173.72 2.67 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.739 0.304 . . . . 0.0 111.256 179.795 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 14.7 ttm180 -109.74 139.4 44.84 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.091 -179.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.71 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 12.2 mt-10 -56.66 -18.1 11.08 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.412 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.658 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 0.8 OUTLIER -71.97 -56.98 4.71 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.316 -179.91 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.424 ' HB3' ' HG2' ' A' ' 107' ' ' GLN . 41.4 mt-10 -48.25 -44.23 33.19 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.033 0.444 . . . . 0.0 110.796 179.641 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.71 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -65.59 -58.69 5.15 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.507 -179.971 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.568 HG22 ' O ' ' A' ' 50' ' ' GLU . 14.1 m -49.27 -45.2 18.03 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-O 121.051 0.453 . . . . 0.0 110.352 179.823 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.783 ' CE1' ' HB1' ' A' ' 113' ' ' ALA . 0.2 OUTLIER -55.38 -53.62 53.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.827 178.649 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.696 ' HB2' ' C ' ' A' ' 107' ' ' GLN . . . -48.28 -45.85 35.16 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.577 179.176 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -64.07 -45.82 87.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.887 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.423 ' OG1' ' HA ' ' A' ' 55' ' ' PHE . 0.6 OUTLIER -64.35 -53.68 44.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.289 -179.528 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.857 HG23 HD12 ' A' ' 117' ' ' LEU . 4.6 p -60.66 -38.28 78.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.064 179.544 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.559 HD13 ' O ' ' A' ' 102' ' ' SER . 7.2 tp -61.23 -39.14 89.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.845 0.355 . . . . 0.0 110.268 178.843 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 33.8 m -69.53 -60.42 2.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.905 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' HIS . . . . . 0.541 ' HB3' HD21 ' A' ' 5' ' ' LEU . 14.2 m-70 -52.94 -27.67 19.97 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.837 0.351 . . . . 0.0 111.226 -179.387 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 1.103 HG21 ' HB3' ' A' ' 116' ' ' LEU . 3.8 t -102.41 46.78 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.045 -179.918 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.629 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . -76.56 57.77 1.27 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.412 -179.681 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.629 ' CB ' ' O ' ' A' ' 64' ' ' ALA . 26.0 t-20 132.31 -63.68 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.21 0.604 . . . . 0.0 111.381 179.632 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 1.089 HG11 HG13 ' A' ' 63' ' ' VAL . 35.4 m 42.47 -137.28 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.602 -179.455 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.51 ' O ' ' O ' ' A' ' 98' ' ' SER . 2.8 p -158.89 -31.95 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 121.027 0.441 . . . . 0.0 111.926 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.719 HD12 ' O ' ' A' ' 98' ' ' SER . 0.7 OUTLIER 40.85 95.67 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.647 179.226 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 22.0 p -66.78 -165.38 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.91 -34.15 71.36 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.017 0.437 . . . . 0.0 110.697 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -68.19 -51.33 46.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.63 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.692 ' O ' HD12 ' A' ' 76' ' ' LEU . 3.3 m-20 -60.46 -42.12 95.54 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.779 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 70.6 m -61.89 -44.64 96.39 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-O 121.103 0.478 . . . . 0.0 110.122 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.516 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . . . -68.81 -28.98 67.24 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 178.055 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 1.024 ' CG ' HG12 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -56.4 -57.52 11.95 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 114.061 -1.427 . . . . 0.0 109.834 178.354 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 1.014 HD22 HD21 ' A' ' 90' ' ' LEU . 5.9 mp -62.64 -53.43 54.66 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.164 179.244 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.834 ' O ' HG22 ' A' ' 81' ' ' VAL . 0.3 OUTLIER -54.52 -32.12 57.54 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.72 -179.763 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.476 ' NE2' ' OE1' ' A' ' 111' ' ' GLN . 0.6 OUTLIER -67.87 -65.03 0.74 Allowed 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.917 0.389 . . . . 0.0 109.994 179.115 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.03 -22.46 60.73 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.743 179.282 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.733 HG23 ' O ' ' A' ' 85' ' ' LEU . 31.4 m -72.56 -64.98 0.85 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.967 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.834 HG22 ' O ' ' A' ' 77' ' ' LEU . 27.4 m -68.76 -14.78 18.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.728 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.21 -68.55 0.18 Allowed 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.668 0.271 . . . . 0.0 111.556 -179.804 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 10.6 t-80 -136.04 68.64 1.44 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.852 0.358 . . . . 0.0 111.251 -179.749 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 47.27 70.26 0.43 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.431 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.733 ' O ' HG23 ' A' ' 80' ' ' THR . 2.1 tm? -130.76 75.37 1.65 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.708 179.749 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 19.2 p30 -103.35 25.22 9.84 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.611 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 37.3 p-10 -74.61 -14.56 60.79 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.176 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.632 ' CG ' ' HB2' ' A' ' 102' ' ' SER . 2.8 m-85 -103.13 139.69 38.32 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.835 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.763 ' CG ' HG13 ' A' ' 101' ' ' VAL . 0.7 OUTLIER -109.63 146.24 35.11 Favored 'General case' 0 N--CA 1.436 -1.134 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -178.985 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 1.014 HD21 HD22 ' A' ' 76' ' ' LEU . 36.7 mt -136.01 153.58 51.33 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 113.364 0.875 . . . . 0.0 113.364 -177.449 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.444 ' O ' ' CB ' ' A' ' 98' ' ' SER . 25.2 ttp180 -130.71 142.65 50.43 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 114.69 -1.141 . . . . 0.0 108.193 178.031 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.455 ' O ' HG13 ' A' ' 93' ' ' VAL . 3.8 p -104.66 140.64 37.74 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 113.796 1.036 . . . . 0.0 113.796 -178.084 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.456 HG23 ' N ' ' A' ' 94' ' ' GLY . 27.8 m -159.78 -137.49 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.82 0 CA-C-N 113.833 -1.53 . . . . 0.0 107.769 178.376 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.531 ' O ' ' N ' ' A' ' 96' ' ' GLY . . . 31.49 36.97 0.03 OUTLIER Glycine 0 N--CA 1.46 0.265 0 C-N-CA 121.563 -0.351 . . . . 0.0 113.631 178.788 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ASN . . . . . 0.425 ' N ' ' O ' ' A' ' 93' ' ' VAL . 44.6 t30 64.32 -69.83 0.08 Allowed 'General case' 0 C--O 1.231 0.111 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 -178.457 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.531 ' N ' ' O ' ' A' ' 94' ' ' GLY . . . -121.1 22.89 7.86 Favored Glycine 0 N--CA 1.445 -0.749 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 177.84 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.414 ' ND2' ' HA3' ' A' ' 94' ' ' GLY . 0.3 OUTLIER -114.95 166.12 12.13 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 110.221 -0.289 . . . . 0.0 110.221 -179.817 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.719 ' O ' HD12 ' A' ' 68' ' ' LEU . 0.9 OUTLIER -140.73 164.01 31.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.485 0.659 . . . . 0.0 111.308 -179.927 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.533 HG22 ' O ' ' A' ' 65' ' ' ASN . 0.5 OUTLIER -104.19 151.21 6.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 178.954 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.93 HD13 ' CD1' ' A' ' 116' ' ' LEU . 1.0 OUTLIER -103.94 111.54 24.13 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -178.995 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.763 HG13 ' CG ' ' A' ' 89' ' ' ASP . 1.4 p -124.27 104.68 14.26 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 104.352 -2.462 . . . . 0.0 104.352 175.143 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.632 ' HB2' ' CG ' ' A' ' 88' ' ' TYR . 9.0 p -148.92 165.35 31.84 Favored 'General case' 0 C--N 1.311 -1.106 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -173.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.541 HD13 ' O ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 158.62 -91.08 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.077 0 CA-C-N 113.07 -1.877 . . . . 0.0 111.864 176.03 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.512 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 56.87 23.07 7.72 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 -178.641 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.541 ' O ' HD13 ' A' ' 103' ' ' LEU . 5.1 m 138.9 168.22 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.859 1.264 . . . . 0.0 108.154 -178.52 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.428 ' O ' ' O ' ' A' ' 42' ' ' LEU . 1.3 m-20 -104.89 102.59 12.11 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.082 -0.647 . . . . 0.0 112.348 -179.076 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.702 HE21 ' HB1' ' A' ' 48' ' ' ALA . 4.5 mt-30 -168.1 157.47 9.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.699 177.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.492 ' HG2' ' HB2' ' A' ' 113' ' ' ALA . 0.0 OUTLIER -165.64 145.03 6.4 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.21 0.529 . . . . 0.0 112.293 179.268 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.746 HG22 ' HA ' ' A' ' 24' ' ' THR . 0.7 OUTLIER -104.26 163.47 12.39 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 178.256 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.942 HD22 ' CD1' ' A' ' 15' ' ' LEU . 5.2 mt -52.8 -61.39 2.32 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 120.165 -0.614 . . . . 0.0 109.838 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.799 ' O ' HG13 ' A' ' 115' ' ' VAL . 2.5 tp60 -40.15 -63.38 0.62 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 120.713 0.292 . . . . 0.0 110.603 179.145 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 1.023 ' O ' HG22 ' A' ' 115' ' ' VAL . 8.0 m-20 -51.5 -58.51 6.1 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 121.265 0.555 . . . . 0.0 110.154 179.384 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.805 ' O ' HD13 ' A' ' 117' ' ' LEU . . . -48.4 -39.87 23.93 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.12 0.486 . . . . 0.0 110.108 178.798 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.729 ' HE3' ' HG2' ' A' ' 17' ' ' GLN . 0.0 OUTLIER -72.22 -26.97 62.24 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.877 179.729 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 1.024 HG12 ' CG ' ' A' ' 75' ' ' LYS . 10.8 m -70.48 -51.82 34.44 Favored 'Isoleucine or valine' 0 C--O 1.249 1.038 0 CA-C-O 121.406 0.622 . . . . 0.0 111.892 -179.079 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 1.103 ' HB3' HG21 ' A' ' 63' ' ' VAL . 0.5 OUTLIER -70.0 -37.84 75.82 Favored 'General case' 0 N--CA 1.439 -1.017 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 179.433 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 1.006 HD23 ' CD2' ' A' ' 9' ' ' HIS . 5.1 mp -65.6 -32.28 73.77 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.905 178.89 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 26.4 tp10 -62.17 -53.24 58.14 Favored 'General case' 0 C--N 1.31 -1.112 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 178.51 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.579 ' HB1' ' H ' ' A' ' 68' ' ' LEU . . . -74.47 -16.56 60.85 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 119.382 -0.927 . . . . 0.0 110.741 177.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.985 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -77.99 -61.51 1.98 Allowed 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.409 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.847 HD12 ' N ' ' A' ' 129' ' ' GLY . 0.4 OUTLIER -56.55 -34.71 67.36 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 118.736 -1.186 . . . . 0.0 108.785 178.111 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.532 ' HA ' ' HA3' ' A' ' 129' ' ' GLY . 0.1 OUTLIER -55.03 -65.28 0.61 Allowed 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 114.918 -1.037 . . . . 0.0 112.223 179.797 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.77 -13.25 24.27 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -177.977 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 124' ' ' GLU . . . . . 0.596 ' HB2' ' O ' ' A' ' 120' ' ' ALA . 5.0 mm-40 -97.68 -67.06 0.86 Allowed 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 -177.449 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.677 ' HB2' ' HA ' ' A' ' 121' ' ' LEU . 10.1 t -47.78 -59.93 2.95 Favored 'General case' 0 CA--C 1.5 -0.981 0 CA-C-N 114.293 -1.321 . . . . 0.0 112.496 -176.458 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 65.32 3.7 13.92 Favored Glycine 0 N--CA 1.433 -1.566 0 N-CA-C 108.792 -1.723 . . . . 0.0 108.792 -175.781 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.566 ' HB3' ' OG ' ' A' ' 125' ' ' SER . . . -94.04 -33.43 13.4 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 178.551 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ARG . . . . . 0.524 ' CG ' ' HB2' ' A' ' 6' ' ' SER . 24.9 mmt180 -142.53 -33.39 0.47 Allowed 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 114.708 -1.133 . . . . 0.0 111.06 178.969 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' GLY . . . . . 0.847 ' N ' HD12 ' A' ' 121' ' ' LEU . . . -86.58 5.88 83.68 Favored Glycine 0 C--N 1.349 1.252 0 C-N-CA 118.798 -1.668 . . . . 0.0 112.64 179.436 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.221 -0.895 . . . . 0.0 111.022 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 201' ' ' ACE . . . . . 0.787 ' H2 ' ' O ' ' B' ' 204' ' ' PTR . . . . . . . . 0 C--O 1.231 0.095 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 59.99 147.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.813 0.34 . . . . 0.0 110.834 . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 62.22 -80.65 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.938 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 204' ' ' PTR . . . . . 0.787 ' O ' ' H2 ' ' B' ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -108.21 -87.79 0.49 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.323 -179.631 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 206' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -58.44 108.05 1.17 Allowed Pre-proline 0 C--N 1.332 -0.194 0 CA-C-O 120.502 0.192 . . . . 0.0 110.9 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 207' ' ' PRO . . . . . 0.498 ' HB3' HD22 ' A' ' 3' ' ' LEU . 33.6 Cg_endo -64.09 90.14 0.16 Allowed 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.284 1.989 . . . . 0.0 112.532 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 208' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 178.65 85.01 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.903 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 116.533 -0.303 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.444 ' N ' ' H1 ' ' B' ' 201' ' ' ACE . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.893 0.378 . . . . 0.0 111.177 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.659 HD22 HD22 ' A' ' 8' ' ' LEU . 38.0 t30 -57.89 164.26 2.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.885 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.578 HD12 ' OD1' ' A' ' 2' ' ' ASN . 0.0 OUTLIER -79.88 -76.02 0.23 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.098 179.579 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.503 ' O ' ' CB ' ' A' ' 8' ' ' LEU . 36.1 t -178.48 -151.72 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.766 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.567 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 23.1 mt -96.04 -64.7 1.03 Allowed 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 121.365 0.602 . . . . 0.0 111.453 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.448 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 0.9 OUTLIER -36.19 -59.16 0.64 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.766 -1.106 . . . . 0.0 112.958 -178.288 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ASP . . . . . 0.408 ' O ' ' HB3' ' A' ' 10' ' ' ARG . 0.7 OUTLIER -73.32 -54.32 8.66 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 120.757 0.313 . . . . 0.0 110.733 -179.387 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.983 HD23 HD21 ' A' ' 117' ' ' LEU . 46.0 tp -42.5 -51.19 5.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.254 0.549 . . . . 0.0 110.166 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.74 ' CG ' HD22 ' A' ' 121' ' ' LEU . 9.6 t60 -64.34 -46.53 83.07 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 177.836 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.448 ' HB2' ' O ' ' A' ' 6' ' ' SER . 0.0 OUTLIER -50.84 -57.15 9.15 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.21 -1.359 . . . . 0.0 111.741 -179.545 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.663 ' HG3' HG22 ' A' ' 31' ' ' VAL . 2.3 pt20 -65.41 -51.37 60.78 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -179.145 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.876 HG23 HD23 ' A' ' 110' ' ' LEU . 8.9 p -58.75 -46.22 90.82 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-O 121.206 0.527 . . . . 0.0 110.614 179.765 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.845 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 24.5 t -56.56 -49.2 75.53 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.329 179.649 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.8 ttt85 -63.82 -30.5 71.59 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.952 0.405 . . . . 0.0 110.533 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.721 HD12 ' HA ' ' A' ' 12' ' ' VAL . 6.4 mt -67.56 -65.47 0.68 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.353 -179.422 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.499 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 0.9 OUTLIER -68.04 -27.7 38.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -178.566 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.401 ' HB2' ' O ' ' A' ' 13' ' ' SER . 1.8 mm-40 -87.09 -9.95 54.12 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.672 -179.523 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -151.94 38.44 0.59 Allowed 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 120.821 -0.351 . . . . 0.0 111.925 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 179.35 -67.69 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 179.733 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.565 ' CB ' HD13 ' A' ' 110' ' ' LEU . 15.3 m -72.33 -40.34 67.5 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -178.219 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.432 ' H ' ' HA ' ' A' ' 16' ' ' VAL . . . 82.3 -50.42 4.32 Favored Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.374 -0.917 . . . . 0.0 112.192 -179.06 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -175.93 30.69 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.74 0.305 . . . . 0.0 111.412 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.46 ' HB2' ' HB3' ' A' ' 20' ' ' SER . 1.0 OUTLIER -79.22 -163.14 0.46 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.503 179.734 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.626 ' HA ' HG22 ' A' ' 109' ' ' THR . 40.5 m -104.13 149.44 25.23 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.413 ' CA ' ' HG ' ' A' ' 110' ' ' LEU . . . -107.21 145.29 16.0 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.2 -1.0 . . . . 0.0 113.639 -178.803 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.657 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 0.0 OUTLIER -108.86 123.6 49.31 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 178.939 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.759 HD23 ' N ' ' A' ' 28' ' ' ARG . 6.6 tt -104.27 163.52 12.36 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -178.304 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.759 ' N ' HD23 ' A' ' 27' ' ' LEU . 0.1 OUTLIER 145.86 58.67 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.425 1.09 . . . . 0.0 109.368 179.966 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.477 ' HA2' ' HG ' ' A' ' 3' ' ' LEU . . . 75.91 6.7 82.84 Favored Glycine 0 C--N 1.335 0.524 0 C-N-CA 120.109 -1.043 . . . . 0.0 110.727 -177.939 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.408 ' HB3' ' CB ' ' B' ' 204' ' ' PTR . 0.1 OUTLIER -166.12 165.9 17.43 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 -179.52 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.765 ' CG1' HD12 ' A' ' 8' ' ' LEU . 0.7 OUTLIER -131.89 118.09 36.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.522 0.677 . . . . 0.0 111.215 178.763 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.647 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -104.92 166.07 10.63 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.901 -179.38 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.547 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -103.9 116.36 32.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.239 0.542 . . . . 0.0 111.344 -179.528 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.404 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 5.9 t30 -97.74 120.59 38.4 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.718 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.0 ttpp -114.15 -25.47 8.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.986 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -60.01 -55.0 39.45 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.818 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.57 -169.44 2.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.548 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.492 ' O ' ' HB3' ' A' ' 39' ' ' PHE . 29.7 p -132.67 -43.17 0.91 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.465 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.649 ' CD1' HG23 ' A' ' 109' ' ' THR . 0.0 OUTLIER 91.2 175.02 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.269 0.628 . . . . 0.0 110.746 -179.545 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.602 ' HB2' HD22 ' A' ' 85' ' ' LEU . 0.1 OUTLIER 150.08 62.82 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.878 0.871 . . . . 0.0 109.803 -179.667 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.772 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . 67.27 -88.78 0.16 Allowed Glycine 0 CA--C 1.522 0.511 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.072 -178.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.75 HD23 ' HB2' ' A' ' 48' ' ' ALA . 13.6 tp 42.86 172.07 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 117.41 0.605 . . . . 0.0 111.915 179.257 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -127.85 34.79 4.57 Favored 'General case' 0 C--N 1.329 -0.285 0 O-C-N 121.81 -0.556 . . . . 0.0 111.655 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.972 HD13 ' HB3' ' A' ' 48' ' ' ALA . 30.2 mm 56.61 7.34 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 179.487 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -91.6 -31.23 15.97 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.723 0.297 . . . . 0.0 111.456 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.62 ' HB2' HD11 ' A' ' 42' ' ' LEU . 0.3 OUTLIER -91.78 -53.26 4.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.22 -179.828 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.74 ' H ' HD21 ' A' ' 42' ' ' LEU . . . 177.52 71.36 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.585 -0.816 . . . . 0.0 112.799 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.972 ' HB3' HD13 ' A' ' 44' ' ' ILE . . . -135.31 161.67 34.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.674 0.273 . . . . 0.0 110.775 179.731 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 29.4 mtt180 -93.83 134.22 36.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.115 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.619 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 7.0 mt-10 -51.29 -27.0 8.27 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.164 0.507 . . . . 0.0 110.732 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.507 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 31.1 p -69.82 -57.87 4.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.346 179.542 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.465 ' OE1' ' NE2' ' A' ' 107' ' ' GLN . 40.3 mt-10 -44.28 -50.69 8.85 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.183 179.666 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.619 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -65.04 -51.73 59.92 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.425 -179.815 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 50' ' ' GLU . 53.7 t -56.6 -37.48 52.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.84 ' CE1' ' HB1' ' A' ' 113' ' ' ALA . 0.2 OUTLIER -59.96 -47.61 85.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.179 -0.918 . . . . 0.0 109.429 178.746 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.752 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -54.79 -64.55 0.8 Allowed 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.83 178.75 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.4 ' O ' ' CB ' ' A' ' 61' ' ' SER . 2.6 mm-40 -39.87 -48.73 2.35 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.814 179.25 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.485 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 0.9 OUTLIER -65.19 -54.05 35.53 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.557 179.787 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.872 HG23 HD12 ' A' ' 117' ' ' LEU . 0.6 OUTLIER -48.42 -41.15 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 N-CA-C 112.562 0.579 . . . . 0.0 112.562 -178.74 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.739 ' CD1' HD21 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -93.36 -17.06 23.98 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.414 -0.515 . . . . 0.0 110.674 179.875 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.485 ' HB2' ' HA ' ' A' ' 58' ' ' THR . 1.8 m -66.57 -63.21 1.12 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.702 178.847 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' HIS . . . . . 0.503 ' CE1' ' HA ' ' A' ' 59' ' ' VAL . 4.7 p-80 -64.19 -43.34 95.38 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 121.159 0.504 . . . . 0.0 109.674 179.572 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.855 HG22 ' HB2' ' A' ' 120' ' ' ALA . 4.8 t -54.77 -60.03 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.555 178.35 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.532 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 40.45 26.06 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 115.374 -0.83 . . . . 0.0 113.152 178.673 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.681 ' H ' HG12 ' A' ' 63' ' ' VAL . 7.3 t30 149.92 -68.89 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 122.788 0.435 . . . . 0.0 110.848 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.769 ' CG2' HG13 ' A' ' 63' ' ' VAL . 23.4 m 45.24 -162.5 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.723 ' HB ' ' HB3' ' A' ' 97' ' ' ASN . 10.7 m -142.16 77.05 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.099 0 CA-C-O 121.012 0.434 . . . . 0.0 110.432 -178.666 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 1.094 HD22 HD11 ' A' ' 76' ' ' LEU . 0.2 OUTLIER -70.93 80.73 0.65 Allowed 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.971 -179.026 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.694 HG22 ' O ' ' A' ' 96' ' ' GLY . 69.0 p -48.11 166.61 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 178.363 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -39.81 -35.02 0.3 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.043 0.449 . . . . 0.0 111.753 -179.491 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.444 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 3.2 tp10 -64.19 -48.2 76.85 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.189 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.682 ' O ' HD12 ' A' ' 76' ' ' LEU . 81.0 m-20 -70.96 -52.13 21.64 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.447 179.612 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.668 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 89.9 m -45.68 -39.41 7.91 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.136 0.493 . . . . 0.0 110.207 178.69 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.461 ' HA ' ' HG ' ' A' ' 77' ' ' LEU . . . -73.65 -41.85 62.17 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 178.203 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.951 ' HB3' ' CG2' ' A' ' 115' ' ' VAL . 0.1 OUTLIER -50.29 -44.97 54.14 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 113.684 -1.598 . . . . 0.0 108.636 176.971 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 1.094 HD11 HD22 ' A' ' 68' ' ' LEU . 2.1 mp -64.24 -54.14 38.13 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.561 178.282 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.694 ' O ' HG12 ' A' ' 81' ' ' VAL . 5.1 mt -49.18 -39.87 31.05 Favored 'General case' 0 C--N 1.34 0.192 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 179.273 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.503 ' HA ' HG12 ' A' ' 81' ' ' VAL . 16.1 mt-30 -59.96 -53.33 59.1 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.75 178.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' SER . . . . . 0.542 ' CB ' ' HG3' ' A' ' 111' ' ' GLN . 0.0 OUTLIER -49.26 -49.25 44.24 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.297 179.337 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.85 -59.54 2.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.808 -179.144 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.694 HG12 ' O ' ' A' ' 77' ' ' LEU . 9.0 p -51.28 -23.06 2.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.794 -179.465 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -43.25 -42.29 4.27 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.469 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.42 ' CE1' ' OD1' ' A' ' 84' ' ' ASN . 1.9 t60 -117.9 -91.48 0.55 Allowed 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.031 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.42 ' OD1' ' CE1' ' A' ' 83' ' ' HIS . 43.0 p-10 178.05 93.2 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 120.801 0.334 . . . . 0.0 110.947 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.602 HD22 ' HB2' ' A' ' 40' ' ' GLN . 0.6 OUTLIER -179.05 -170.35 0.18 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.874 179.811 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -147.98 69.3 1.12 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.017 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ASN . . . . . 0.473 ' O ' ' HB2' ' A' ' 104' ' ' ARG . 5.6 p-10 -79.24 -45.08 20.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.565 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.636 ' HE2' HD12 ' A' ' 90' ' ' LEU . 0.3 OUTLIER -80.64 132.57 35.62 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-O 121.216 0.531 . . . . 0.0 112.053 -179.474 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.792 ' O ' ' O ' ' A' ' 101' ' ' VAL . 0.5 OUTLIER -105.96 125.83 51.46 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 104.891 -2.263 . . . . 0.0 104.891 176.611 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.636 HD12 ' HE2' ' A' ' 88' ' ' TYR . 3.1 mt -122.17 134.49 54.72 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 115.45 1.648 . . . . 0.0 115.45 -174.276 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.8 ttt-85 -129.04 104.49 7.6 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 104.628 -2.36 . . . . 0.0 104.628 175.273 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.434 ' CB ' ' HB3' ' A' ' 98' ' ' SER . 2.7 m -104.21 165.35 11.11 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 115.842 1.793 . . . . 0.0 115.842 -174.119 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.704 HG23 ' HA ' ' A' ' 98' ' ' SER . 0.2 OUTLIER -126.68 27.29 2.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 111.733 -2.485 . . . . 0.0 107.023 178.23 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.539 ' O ' ' N ' ' A' ' 96' ' ' GLY . . . -2.48 -59.02 0.0 OUTLIER Glycine 0 CA--C 1.509 -0.29 0 CA-C-N 112.027 -2.352 . . . . 0.0 115.615 -177.68 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ASN . . . . . 0.475 ' N ' ' O ' ' A' ' 93' ' ' VAL . 1.9 m120 -62.99 61.88 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.781 0.324 . . . . 0.0 111.271 -179.005 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.694 ' O ' HG22 ' A' ' 69' ' ' THR . . . 119.46 -23.9 8.3 Favored Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.585 -0.817 . . . . 0.0 114.625 178.756 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.723 ' HB3' ' HB ' ' A' ' 67' ' ' VAL . 0.2 OUTLIER -165.36 168.75 16.5 Favored 'General case' 0 C--O 1.216 -0.704 0 CA-C-N 118.876 1.338 . . . . 0.0 112.34 -178.329 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.704 ' HA ' HG23 ' A' ' 93' ' ' VAL . 3.9 m -155.25 142.34 19.25 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.239 178.714 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.433 HG13 ' HA ' ' A' ' 65' ' ' ASN . 84.1 t -104.12 133.45 48.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.835 -177.755 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 1.053 HD11 ' HB3' ' A' ' 102' ' ' SER . 3.3 tm? -104.42 120.9 42.29 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 113.848 1.055 . . . . 0.0 113.848 -178.205 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.792 ' O ' ' O ' ' A' ' 89' ' ' ASP . 1.5 p -124.07 103.91 13.29 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 N-CA-C 103.686 -2.709 . . . . 0.0 103.686 174.299 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' SER . . . . . 1.053 ' HB3' HD11 ' A' ' 100' ' ' LEU . 1.2 t -144.2 165.58 27.44 Favored 'General case' 0 CA--C 1.492 -1.255 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -173.934 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.739 HD21 ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER 161.86 -81.71 0.0 OUTLIER 'General case' 0 N--CA 1.428 -1.549 0 CA-C-N 112.669 -2.059 . . . . 0.0 110.744 175.78 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.574 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 46.66 31.46 1.4 Allowed 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.341 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.584 ' HB3' ' N ' ' A' ' 42' ' ' LEU . 58.3 m 129.68 164.82 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.597 1.159 . . . . 0.0 108.453 -178.219 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.553 ' HB3' ' HB2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -104.96 102.19 11.72 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -177.737 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.772 ' HB2' ' O ' ' A' ' 41' ' ' GLY . 7.9 mt-30 -169.43 162.59 10.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.84 177.26 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.556 ' HB2' ' HB2' ' A' ' 56' ' ' ALA . 1.2 tpt -164.76 147.34 8.47 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.363 -0.535 . . . . 0.0 112.002 178.495 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.649 HG23 ' CD1' ' A' ' 39' ' ' PHE . 0.3 OUTLIER -109.25 164.84 12.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.348 179.474 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.876 HD23 HG23 ' A' ' 12' ' ' VAL . 1.0 OUTLIER -50.44 -53.9 26.1 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.199 0.523 . . . . 0.0 110.17 179.316 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.832 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 1.9 tp-100 -51.22 -65.94 0.47 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.281 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.6 ' HA ' HG12 ' A' ' 115' ' ' VAL . 1.2 t0 -50.14 -47.48 54.19 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-O 121.542 0.687 . . . . 0.0 110.782 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.862 ' HA ' HG21 ' A' ' 59' ' ' VAL . . . -53.47 -50.16 65.93 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.86 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.845 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -70.67 -33.58 71.09 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.797 -178.648 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.951 ' CG2' ' HB3' ' A' ' 75' ' ' LYS . 4.0 p -62.45 -52.18 63.08 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.104 0 C-N-CA 119.082 -1.047 . . . . 0.0 110.229 179.524 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.731 HD22 HG13 ' A' ' 59' ' ' VAL . 3.1 mp -64.2 -39.77 94.69 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-N 114.44 -1.255 . . . . 0.0 110.182 -178.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.983 HD21 HD23 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -74.26 -16.67 60.94 Favored 'General case' 0 CA--C 1.511 -0.52 0 C-N-CA 120.369 -0.532 . . . . 0.0 111.161 178.99 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.715 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 0.0 OUTLIER -72.17 -47.96 46.94 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 106.152 -1.795 . . . . 0.0 106.152 176.77 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.423 ' O ' ' HB2' ' A' ' 123' ' ' GLN . . . -72.46 -28.19 62.77 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.846 177.102 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.855 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -68.89 -62.35 1.42 Allowed 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.948 179.571 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.74 HD22 ' CG ' ' A' ' 9' ' ' HIS . 0.1 OUTLIER -60.47 -37.57 81.44 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.718 -179.502 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.715 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.1 OUTLIER -70.17 -34.46 73.02 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -179.836 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.606 ' HB2' HG22 ' A' ' 67' ' ' VAL . 0.0 OUTLIER -90.95 -26.63 19.17 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.554 0.575 . . . . 0.0 112.554 -178.542 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -95.68 -66.26 0.92 Allowed 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 -178.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -95.85 -65.5 0.97 Allowed 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -178.081 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' GLY . . . . . 0.642 ' N ' ' O ' ' A' ' 121' ' ' LEU . . . 86.62 75.84 1.26 Allowed Glycine 0 N--CA 1.448 -0.534 0 N-CA-C 111.076 -0.81 . . . . 0.0 111.076 -178.702 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.601 ' HB3' ' O ' ' A' ' 126' ' ' GLY . . . 84.42 -33.57 0.06 Allowed 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 -177.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 166.34 108.98 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.625 178.795 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . -153.49 23.4 0.75 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.623 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 26.0 p . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.926 179.969 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 201' ' ' ACE . . . . . 0.444 ' H1 ' ' N ' ' A' ' 1' ' ' MET . . . . . . . . 0 C--O 1.232 0.132 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -152.69 121.02 6.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.791 0.329 . . . . 0.0 110.93 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -151.97 131.38 12.93 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.906 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 204' ' ' PTR . . . . . 0.599 ' N ' ' HD2' ' B' ' 204' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -86.76 53.47 2.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.952 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 206' ' ' ASP . . . . . . . . . . . . . 11.3 p30 175.65 97.72 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.93 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -45.04 168.78 0.03 OUTLIER 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 122.832 2.355 . . . . 0.0 112.431 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 208' ' ' PHE . . . . . 0.46 ' CZ ' ' HA ' ' A' ' 11' ' ' GLN . 88.6 m-85 62.0 159.59 0.06 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.839 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.465 -0.334 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.431 0 CA-C-O 120.791 0.329 . . . . 0.0 111.112 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 5.4 p30 47.29 -166.81 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.137 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 1.008 HD11 HD13 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -95.48 -94.98 0.18 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.383 179.048 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.433 ' O ' ' HB2' ' A' ' 8' ' ' LEU . 40.6 t -141.96 -168.74 2.76 Favored 'General case' 0 C--N 1.335 -0.062 0 CA-C-O 120.742 0.306 . . . . 0.0 110.592 179.459 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.884 HD23 HD23 ' A' ' 117' ' ' LEU . 0.8 OUTLIER -95.51 -66.18 0.93 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.457 0.646 . . . . 0.0 111.397 -179.914 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.415 ' OG ' ' HA3' ' A' ' 129' ' ' GLY . 0.9 OUTLIER -64.58 -37.55 87.95 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.492 -178.698 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ASP . . . . . 0.512 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 0.5 OUTLIER -66.12 -52.25 50.3 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 178.469 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 1.008 HD13 HD11 ' A' ' 3' ' ' LEU . 42.5 tp -49.24 -54.22 17.82 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.113 178.328 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.598 ' CG ' HD22 ' A' ' 121' ' ' LEU . 42.7 t-80 -53.45 -41.44 66.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.883 178.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.512 ' HB2' ' O ' ' A' ' 7' ' ' ASP . 3.1 mmt85 -56.47 -57.76 10.93 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.691 -179.506 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.814 ' HG3' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -64.81 -49.95 68.65 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 120.444 -0.502 . . . . 0.0 111.624 -179.313 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.957 HG23 HD23 ' A' ' 110' ' ' LEU . 9.8 p -60.08 -47.9 90.06 Favored 'Isoleucine or valine' 0 C--O 1.24 0.578 0 CA-C-O 121.119 0.485 . . . . 0.0 110.803 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.658 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 53.0 m -63.59 -49.35 73.7 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.28 179.305 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.443 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 13.3 mtp180 -61.76 -23.5 66.21 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.414 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.622 HD12 ' HA ' ' A' ' 12' ' ' VAL . 8.7 mt -72.61 -61.89 1.64 Allowed 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 121.009 0.433 . . . . 0.0 110.656 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.711 HG13 ' C ' ' A' ' 21' ' ' GLY . 23.1 t -70.24 -30.92 45.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.242 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.437 ' CG ' ' O ' ' A' ' 13' ' ' SER . 0.4 OUTLIER -71.71 -19.09 62.1 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.132 -179.51 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.443 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 1.8 pt20 -155.63 50.4 0.55 Allowed 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.697 178.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -178.75 -66.5 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.814 0.34 . . . . 0.0 111.885 179.511 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.462 ' HB2' ' HA ' ' A' ' 16' ' ' VAL . 1.8 m -77.27 -81.37 0.09 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.536 -178.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.711 ' C ' HG13 ' A' ' 16' ' ' VAL . . . 124.55 -45.25 1.19 Allowed Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 121.081 -0.581 . . . . 0.0 111.802 -179.591 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 179.94 32.08 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.101 0.477 . . . . 0.0 110.141 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.418 ' HB3' ' O ' ' A' ' 34' ' ' ASN . 21.4 m -80.36 -163.3 0.54 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.202 -179.586 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.753 HG21 ' CD2' ' A' ' 39' ' ' PHE . 20.5 m -104.56 142.34 34.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.946 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -105.3 139.91 14.86 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.437 -0.887 . . . . 0.0 113.49 -178.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.919 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -110.59 135.38 51.32 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 179.193 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.58 HD23 ' N ' ' A' ' 28' ' ' ARG . 4.4 tt -104.89 160.58 14.9 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -178.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.58 ' N ' HD23 ' A' ' 27' ' ' LEU . 0.0 OUTLIER 158.75 55.31 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.202 -179.947 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.431 ' O ' HD23 ' A' ' 3' ' ' LEU . . . 76.7 2.74 77.18 Favored Glycine 0 C--N 1.334 0.426 0 N-CA-C 110.632 -0.987 . . . . 0.0 110.632 -177.561 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.446 ' ND2' ' O ' ' B' ' 207' ' ' PRO . 0.1 OUTLIER -166.18 165.47 17.58 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 -179.845 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.814 HG12 ' HG3' ' A' ' 11' ' ' GLN . 1.7 p -116.35 128.92 73.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 121.4 0.619 . . . . 0.0 111.205 178.851 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.919 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -115.56 165.68 12.75 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.076 -0.965 . . . . 0.0 110.416 179.759 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.591 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -104.0 137.99 41.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.199 0.524 . . . . 0.0 111.855 -179.327 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.526 HD21 HG23 ' A' ' 37' ' ' THR . 2.9 t30 -122.27 113.81 19.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.319 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.86 -23.53 10.52 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.258 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -50.92 -45.02 60.29 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.891 0.377 . . . . 0.0 110.742 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.579 HG21 ' CE1' ' A' ' 39' ' ' PHE . 10.2 t -128.2 -158.12 0.86 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.259 179.404 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 26.0 p -155.11 100.93 2.21 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.953 0.406 . . . . 0.0 111.036 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.867 ' O ' HG23 ' A' ' 109' ' ' THR . 10.9 m-85 -86.26 131.85 34.13 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.682 0.754 . . . . 0.0 111.911 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.654 ' H ' ' NE2' ' A' ' 107' ' ' GLN . 0.1 OUTLIER -160.03 81.88 0.71 Allowed 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.519 -1.218 . . . . 0.0 109.811 179.728 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.41 ' H ' ' CB ' ' A' ' 107' ' ' GLN . . . 69.32 101.34 0.04 OUTLIER Glycine 0 CA--C 1.525 0.662 0 CA-C-N 115.954 -0.566 . . . . 0.0 113.179 -179.705 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.743 ' HB2' ' NE2' ' A' ' 107' ' ' GLN . 0.0 OUTLIER -159.71 -144.34 0.11 Allowed 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 110.256 -0.275 . . . . 0.0 110.256 179.096 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.587 ' H ' HD12 ' A' ' 42' ' ' LEU . 0.2 OUTLIER -162.19 21.95 0.1 Allowed 'General case' 0 CA--C 1.529 0.145 0 O-C-N 121.832 -0.543 . . . . 0.0 112.088 -179.515 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.655 ' HA ' ' HB3' ' A' ' 48' ' ' ALA . 1.8 mp 66.44 4.45 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 179.512 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.62 -57.15 3.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.902 0.382 . . . . 0.0 111.184 -179.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.0 p -61.63 -59.6 4.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.989 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -179.78 76.81 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.327 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.677 ' HB1' ' OE2' ' A' ' 52' ' ' GLU . . . -138.4 -158.61 0.87 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.552 0.215 . . . . 0.0 111.151 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.415 ' O ' ' OE2' ' A' ' 52' ' ' GLU . 9.6 mtm180 -140.5 -174.54 3.99 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 120.874 0.369 . . . . 0.0 111.253 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.764 ' O ' HG23 ' A' ' 54' ' ' VAL . 21.7 tt0 -85.29 -30.83 23.44 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.979 0.418 . . . . 0.0 111.212 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.592 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 0.3 OUTLIER -59.14 -65.31 0.69 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.842 -179.999 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.677 ' OE2' ' HB1' ' A' ' 48' ' ' ALA . 0.1 OUTLIER -35.59 -65.38 0.25 Allowed 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.662 179.947 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.502 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -51.08 -52.31 44.75 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.522 179.822 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.764 HG23 ' O ' ' A' ' 50' ' ' GLU . 94.6 t -55.91 -35.35 40.18 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 CA-C-O 121.007 0.432 . . . . 0.0 109.941 179.104 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.675 ' O ' HG12 ' A' ' 59' ' ' VAL . 0.2 OUTLIER -70.86 -45.23 64.81 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.409 179.299 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.567 ' HB2' ' HB2' ' A' ' 108' ' ' MET . . . -61.77 -46.93 87.44 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.39 179.48 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 -62.82 -44.04 97.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.648 179.618 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.505 ' OG1' HD13 ' A' ' 27' ' ' LEU . 16.7 p -64.53 -56.54 13.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.933 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 1.082 HG23 HD12 ' A' ' 117' ' ' LEU . 12.3 p -60.4 -44.18 95.55 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.59 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.808 HD13 HD23 ' A' ' 103' ' ' LEU . 4.7 tp -55.96 -42.77 76.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.903 0.383 . . . . 0.0 110.226 179.293 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 62.7 m -61.83 -58.77 6.68 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.832 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 10.8 m-70 -55.16 -32.74 62.38 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.136 0.493 . . . . 0.0 110.312 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 1.09 HG13 HG11 ' A' ' 66' ' ' VAL . 3.6 t -100.26 59.2 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.282 179.393 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.492 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . -83.4 34.67 0.48 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.61 -179.509 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.522 ' HA ' HG22 ' A' ' 99' ' ' VAL . 7.4 t-20 153.82 -61.78 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 122.855 0.462 . . . . 0.0 110.379 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 1.09 HG11 HG13 ' A' ' 63' ' ' VAL . 18.8 m 40.77 -163.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 1.006 HG22 ' HB2' ' A' ' 123' ' ' GLN . 29.3 m -148.44 75.23 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.437 -1.112 0 CA-C-O 120.939 0.399 . . . . 0.0 111.131 -178.777 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.929 ' CD2' HD11 ' A' ' 76' ' ' LEU . 0.3 OUTLIER -65.0 98.73 0.31 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.874 -179.849 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.832 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 1.4 p -66.92 -172.3 0.18 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.61 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.72 -34.62 12.41 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 120.97 0.414 . . . . 0.0 110.702 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.591 ' O ' ' HE2' ' A' ' 75' ' ' LYS . 0.1 OUTLIER -72.28 -65.72 0.74 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.41 179.776 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.866 ' O ' HD12 ' A' ' 76' ' ' LEU . 0.6 OUTLIER -52.84 -33.98 51.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.45 179.583 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.787 HG23 ' O ' ' A' ' 68' ' ' LEU . 11.7 p -62.55 -55.87 23.25 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 178.02 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.67 -24.39 61.15 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 108.609 -0.885 . . . . 0.0 108.609 177.065 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 1.087 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -62.52 -65.2 0.72 Allowed 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.733 -1.122 . . . . 0.0 109.981 178.716 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.929 HD11 ' CD2' ' A' ' 68' ' ' LEU . 4.3 mp -50.73 -39.94 53.09 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 178.464 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.816 ' O ' HG22 ' A' ' 81' ' ' VAL . 0.5 OUTLIER -54.86 -64.17 0.92 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.706 178.875 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.43 ' HA ' HG22 ' A' ' 81' ' ' VAL . 5.7 tt0 -58.52 -52.39 65.84 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.832 -179.438 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' SER . . . . . 0.486 ' CB ' ' HG2' ' A' ' 111' ' ' GLN . 1.3 t -53.83 -27.65 30.96 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.485 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.578 HG22 ' HA ' ' A' ' 85' ' ' LEU . 89.0 m -93.45 -61.82 1.49 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.321 -179.326 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.816 HG22 ' O ' ' A' ' 77' ' ' LEU . 34.0 m -51.62 -23.83 3.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.829 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -44.57 -60.86 1.78 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.723 0.297 . . . . 0.0 111.313 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -119.37 -78.41 0.59 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.879 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -98.42 134.9 40.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.689 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.578 ' HA ' HG22 ' A' ' 80' ' ' THR . 0.6 OUTLIER -121.4 78.48 1.43 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.182 -179.786 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 176.97 39.61 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.426 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ASN . . . . . 0.515 ' HA ' ' HB2' ' A' ' 104' ' ' ARG . 0.1 OUTLIER -129.48 -44.41 1.24 Allowed 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 120.986 -0.286 . . . . 0.0 111.187 179.636 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.511 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 5.0 m-85 -92.4 138.43 31.52 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 120.257 -0.577 . . . . 0.0 111.026 -179.623 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.788 ' CG ' HG13 ' A' ' 101' ' ' VAL . 1.2 t0 -120.23 148.01 44.22 Favored 'General case' 0 N--CA 1.436 -1.129 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -179.129 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.768 HD12 ' N ' ' A' ' 90' ' ' LEU . 0.0 OUTLIER -147.72 165.44 30.49 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -177.966 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.594 ' O ' ' CB ' ' A' ' 98' ' ' SER . 10.9 ttm105 -137.4 158.72 43.8 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 114.414 -1.266 . . . . 0.0 108.869 178.705 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.794 ' O ' HG13 ' A' ' 93' ' ' VAL . 56.8 p -104.42 159.35 15.8 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.714 0.769 . . . . 0.0 112.567 -179.013 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.794 HG13 ' O ' ' A' ' 92' ' ' SER . 0.0 OUTLIER 162.3 149.36 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 CA-C-N 113.931 -1.486 . . . . 0.0 108.17 -179.057 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.576 ' HA3' ' ND2' ' A' ' 97' ' ' ASN . . . 100.38 27.25 7.76 Favored Glycine 0 C--N 1.296 -1.687 0 C-N-CA 120.01 -1.09 . . . . 0.0 113.311 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 51.47 22.41 1.49 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.161 0.505 . . . . 0.0 109.646 -178.65 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.467 ' O ' ' HA ' ' A' ' 69' ' ' THR . . . 149.6 2.95 0.29 Allowed Glycine 0 N--CA 1.443 -0.861 0 CA-C-N 115.698 -0.683 . . . . 0.0 113.111 -179.357 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.832 ' HA ' ' HA ' ' A' ' 69' ' ' THR . 0.8 OUTLIER -104.61 166.94 10.06 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 118.16 0.98 . . . . 0.0 109.959 179.364 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.594 ' CB ' ' O ' ' A' ' 91' ' ' ARG . 0.2 OUTLIER -140.79 164.53 29.97 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.493 0.663 . . . . 0.0 110.878 179.663 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.522 HG22 ' HA ' ' A' ' 65' ' ' ASN . 0.5 OUTLIER -104.2 145.61 12.73 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.328 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.713 HD13 ' CD1' ' A' ' 116' ' ' LEU . 0.3 OUTLIER -103.55 104.88 15.0 Favored 'General case' 0 CA--C 1.507 -0.695 0 C-N-CA 119.431 -0.908 . . . . 0.0 112.557 -179.131 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.788 HG13 ' CG ' ' A' ' 89' ' ' ASP . 1.3 p -116.35 103.24 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.186 0 N-CA-C 103.256 -2.868 . . . . 0.0 103.256 173.896 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.638 ' O ' HD23 ' A' ' 103' ' ' LEU . 0.1 OUTLIER -144.85 163.6 33.59 Favored 'General case' 0 C--N 1.303 -1.452 0 C-N-CA 119.131 -1.028 . . . . 0.0 112.597 -174.613 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.808 HD23 HD13 ' A' ' 60' ' ' LEU . 0.1 OUTLIER 159.45 -82.3 0.0 OUTLIER 'General case' 0 N--CA 1.435 -1.197 0 CA-C-N 113.801 -1.545 . . . . 0.0 111.39 176.967 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.569 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 46.28 32.98 1.65 Allowed 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.999 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.659 ' HB3' ' N ' ' A' ' 42' ' ' LEU . 52.7 m 129.55 162.96 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.674 1.19 . . . . 0.0 108.104 -178.021 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.412 ' HB3' ' HB3' ' A' ' 53' ' ' LYS . 0.7 OUTLIER -104.84 102.11 11.67 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 119.838 -0.745 . . . . 0.0 112.394 -178.865 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.743 ' NE2' ' HB2' ' A' ' 42' ' ' LEU . 1.3 mt-30 -168.29 127.98 1.24 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.397 177.698 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.567 ' HB2' ' HB2' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -130.85 143.29 50.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.353 0.597 . . . . 0.0 112.324 -179.575 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.867 HG23 ' O ' ' A' ' 39' ' ' PHE . 0.3 OUTLIER -104.55 165.12 11.27 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.432 179.378 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.957 HD23 HG23 ' A' ' 12' ' ' VAL . 0.3 OUTLIER -53.75 -59.53 4.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.779 0.323 . . . . 0.0 110.673 179.983 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.867 ' O ' HG23 ' A' ' 115' ' ' VAL . 1.7 tp-100 -49.26 -59.57 3.57 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 121.1 0.476 . . . . 0.0 110.986 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.878 ' O ' HD22 ' A' ' 116' ' ' LEU . 1.3 m-20 -50.68 -47.47 58.86 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.139 0.495 . . . . 0.0 110.59 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.599 ' HB1' ' CE1' ' A' ' 55' ' ' PHE . . . -49.94 -60.04 3.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.692 179.426 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.663 ' NZ ' HG22 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -66.13 -21.5 66.34 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.153 179.87 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 1.087 HG22 ' CG ' ' A' ' 75' ' ' LYS . 46.0 t -62.62 -61.64 1.55 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.82 0 CA-C-O 121.876 0.846 . . . . 0.0 109.839 179.521 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.9 ' CB ' HG21 ' A' ' 63' ' ' VAL . 0.0 OUTLIER -63.99 -39.8 94.94 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 114.8 -1.091 . . . . 0.0 109.879 179.837 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 1.082 HD12 HG23 ' A' ' 59' ' ' VAL . 0.2 OUTLIER -71.06 -18.63 62.55 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.946 179.86 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.563 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 2.7 tt0 -71.99 -54.09 10.98 Favored 'General case' 0 N--CA 1.441 -0.923 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 176.815 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -71.33 -22.56 61.91 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 114.679 -1.146 . . . . 0.0 111.028 177.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.783 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -76.01 -54.42 6.89 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.214 179.754 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.598 HD22 ' CG ' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -63.71 -27.94 69.56 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.83 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.563 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -73.18 -43.7 61.01 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.917 -0.583 . . . . 0.0 112.064 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 1.006 ' HB2' HG22 ' A' ' 67' ' ' VAL . 1.5 tt0 -95.11 -25.79 16.29 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 113.496 0.924 . . . . 0.0 113.496 -178.169 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' GLU . . . . . 0.402 ' CG ' ' O ' ' A' ' 120' ' ' ALA . 2.5 mm-40 -85.24 -66.41 0.9 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 -177.551 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.415 ' CB ' ' HB2' ' A' ' 128' ' ' ARG . 4.7 p -96.08 -48.3 5.73 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.989 0.423 . . . . 0.0 112.079 -178.652 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 121' ' ' LEU . . . 92.73 70.6 1.15 Allowed Glycine 0 CA--C 1.501 -0.825 0 N-CA-C 110.796 -0.922 . . . . 0.0 110.796 -178.221 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.507 ' HA ' HD12 ' A' ' 121' ' ' LEU . . . 51.05 27.3 3.22 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 -177.333 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ARG . . . . . 0.415 ' HB2' ' CB ' ' A' ' 125' ' ' SER . 0.0 OUTLIER -92.46 -73.88 0.54 Allowed 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.909 -1.042 . . . . 0.0 111.415 -178.347 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 129' ' ' GLY . . . . . 0.415 ' HA3' ' OG ' ' A' ' 6' ' ' SER . . . 77.33 19.03 77.33 Favored Glycine 0 C--N 1.332 0.31 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.648 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 18.5 t . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.867 -179.996 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.134 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -99.97 118.33 36.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.822 0.344 . . . . 0.0 110.985 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -176.72 151.28 0.89 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.874 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 204' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -45.82 -79.84 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.685 -179.45 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 206' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -112.68 148.77 40.0 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 120.796 0.331 . . . . 0.0 111.281 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 207' ' ' PRO . . . . . 0.446 ' O ' ' ND2' ' A' ' 30' ' ' ASN . 1.9 Cg_endo -40.72 -74.6 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 123.573 2.848 . . . . 0.0 113.123 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 208' ' ' PHE . . . . . 0.56 ' CD2' ' NE2' ' A' ' 11' ' ' GLN . 7.8 m-85 -49.8 97.29 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.803 0.335 . . . . 0.0 111.112 -179.67 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.362 0 CA-C-N 116.529 -0.305 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 ptp . . . . . 0 N--CA 1.488 1.446 0 CA-C-O 120.869 0.366 . . . . 0.0 111.153 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.408 ' HB3' ' CG2' ' A' ' 58' ' ' THR . 5.4 p30 -145.46 -163.5 1.73 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.776 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 1.115 ' O ' HD22 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -138.57 103.11 4.78 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 121.221 0.534 . . . . 0.0 111.225 179.816 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.612 ' O ' ' O ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER 40.15 175.1 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.707 0.765 . . . . 0.0 112.853 179.679 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.739 HD22 ' HA ' ' A' ' 121' ' ' LEU . 0.3 OUTLIER -95.93 -65.84 0.95 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.718 179.308 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.418 ' HB2' HD13 ' A' ' 121' ' ' LEU . 1.0 OUTLIER -60.18 -33.05 71.67 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.677 -1.147 . . . . 0.0 111.706 -179.113 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -65.48 -50.49 65.13 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 178.706 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.888 HD23 HD11 ' A' ' 117' ' ' LEU . 22.3 tp -55.32 -44.58 75.95 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.887 179.252 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.504 ' HB2' ' HB3' ' A' ' 117' ' ' LEU . 29.5 t-80 -64.82 -41.32 95.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.557 0.694 . . . . 0.0 110.0 179.238 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.485 ' HB3' ' CE1' ' B' ' 208' ' ' PHE . 1.5 mtt180 -57.91 -50.13 74.38 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.996 -179.34 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.671 ' HG3' ' CG1' ' A' ' 31' ' ' VAL . 1.4 pt20 -66.63 -56.67 9.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.487 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.969 ' HA ' HD12 ' A' ' 15' ' ' LEU . 10.8 p -53.74 -48.32 61.17 Favored 'Isoleucine or valine' 0 C--O 1.242 0.704 0 CA-C-O 121.322 0.582 . . . . 0.0 111.142 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.679 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 62.7 m -62.52 -40.46 96.84 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.256 -179.798 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.466 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 1.2 tpm_? -64.69 -30.89 71.92 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.979 0.418 . . . . 0.0 110.095 -179.797 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.969 HD12 ' HA ' ' A' ' 12' ' ' VAL . 4.6 mt -71.33 -65.08 0.8 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.844 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.721 ' CG2' ' HB3' ' A' ' 110' ' ' LEU . 50.2 t -58.77 -45.95 91.02 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.403 0 C-N-CA 120.556 -0.458 . . . . 0.0 111.434 -179.003 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.45 ' CG ' ' O ' ' A' ' 13' ' ' SER . 6.1 mm-40 -62.7 -12.69 25.29 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.604 -178.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.466 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 3.6 pt20 -170.59 60.18 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.163 0 CA-C-O 120.786 0.326 . . . . 0.0 111.56 178.678 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.534 ' N ' ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER 177.79 -58.72 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 179.817 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.1 m -87.93 -79.63 0.29 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.853 0.359 . . . . 0.0 111.748 -178.729 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.414 ' O ' ' CB ' ' A' ' 22' ' ' ASP . . . 107.64 54.11 0.65 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.726 -179.689 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.582 ' H ' HG13 ' A' ' 16' ' ' VAL . 0.0 OUTLIER 83.2 0.43 1.13 Allowed 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 179.338 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -60.73 -167.03 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 110.37 -0.233 . . . . 0.0 110.37 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.514 ' HA ' HG22 ' A' ' 109' ' ' THR . 12.7 m -104.47 138.31 41.05 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.528 ' CA ' ' HG ' ' A' ' 110' ' ' LEU . . . -114.57 156.24 15.79 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.209 -0.996 . . . . 0.0 113.236 -179.067 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.905 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -114.73 151.04 34.35 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.35 -0.241 . . . . 0.0 110.35 179.407 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.769 ' O ' HD23 ' A' ' 27' ' ' LEU . 5.9 tt -130.18 106.93 8.93 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.141 0.496 . . . . 0.0 112.037 -179.588 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.612 ' HG2' ' HD2' ' A' ' 26' ' ' LYS . 0.2 OUTLIER -134.33 52.28 2.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.584 -0.734 . . . . 0.0 109.253 178.457 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.413 ' O ' ' HG ' ' A' ' 3' ' ' LEU . . . 83.79 4.22 88.94 Favored Glycine 0 C--N 1.332 0.358 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 -176.774 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.453 ' O ' ' NZ ' ' A' ' 26' ' ' LYS . 0.2 OUTLIER -166.07 166.7 17.0 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 106.701 -1.592 . . . . 0.0 106.701 -179.512 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.847 HG13 HD11 ' A' ' 15' ' ' LEU . 11.3 p -113.54 137.96 44.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 C-N-CA 120.003 -0.679 . . . . 0.0 112.281 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.905 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -126.74 164.88 20.35 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.654 178.656 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -104.51 148.19 26.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.139 0.495 . . . . 0.0 111.623 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 42.2 t30 -135.97 117.52 14.85 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.301 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.14 3.33 9.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.4 -179.774 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -61.46 -53.08 61.14 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.951 0.405 . . . . 0.0 110.537 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.537 ' C ' HG22 ' A' ' 38' ' ' THR . 0.0 OUTLIER -128.04 -89.37 0.53 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.193 179.626 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.596 ' O ' ' HB3' ' A' ' 39' ' ' PHE . 0.1 OUTLIER 166.01 -105.45 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 110.259 -0.275 . . . . 0.0 110.259 179.457 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.742 ' CZ ' HD13 ' A' ' 85' ' ' LEU . 0.1 OUTLIER 169.25 -164.46 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 179.63 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.565 ' HB3' ' O ' ' A' ' 39' ' ' PHE . 0.1 OUTLIER 150.86 55.44 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.371 0.669 . . . . 0.0 110.441 179.833 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.559 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . 67.1 -65.39 0.21 Allowed Glycine 0 CA--C 1.523 0.578 0 C-N-CA 120.995 -0.621 . . . . 0.0 112.616 -179.379 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.804 ' O ' ' HB3' ' A' ' 105' ' ' SER . 0.4 OUTLIER 24.28 -138.83 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.203 0.601 . . . . 0.0 112.58 179.444 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.521 HG23 ' O ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -172.64 22.43 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 O-C-N 121.849 -0.532 . . . . 0.0 112.065 -179.934 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.709 HD12 ' N ' ' A' ' 44' ' ' ILE . 1.3 mp 63.37 2.42 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 120.822 0.344 . . . . 0.0 111.687 179.561 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.93 -22.15 25.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.839 0.352 . . . . 0.0 111.003 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.45 ' CB ' HD21 ' A' ' 42' ' ' LEU . 0.3 OUTLIER -101.8 -30.91 11.01 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.397 -179.705 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 177.94 -30.03 0.07 OUTLIER Glycine 0 CA--C 1.519 0.342 0 C-N-CA 120.169 -1.015 . . . . 0.0 113.556 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.718 ' HB2' ' NE2' ' A' ' 107' ' ' GLN . . . -48.32 173.46 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 117.1 0.45 . . . . 0.0 111.488 -179.584 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.438 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 23.0 mtp85 -121.89 173.24 7.63 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.527 -179.592 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.87 ' O ' HG22 ' A' ' 54' ' ' VAL . 0.8 OUTLIER -66.81 -29.97 70.05 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.115 0.483 . . . . 0.0 110.54 179.762 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.536 ' CB ' ' CB ' ' A' ' 26' ' ' LYS . 0.3 OUTLIER -49.75 -65.18 0.61 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.461 179.548 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.505 ' HB2' ' HG2' ' A' ' 107' ' ' GLN . 0.2 OUTLIER -52.56 -62.21 1.79 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.264 -179.15 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.593 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -46.68 -59.14 3.22 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 -178.563 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.87 HG22 ' O ' ' A' ' 50' ' ' GLU . 15.9 m -51.91 -47.36 41.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.46 0 CA-C-O 120.887 0.375 . . . . 0.0 110.732 -179.783 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.567 ' HE2' HG23 ' A' ' 31' ' ' VAL . 0.1 OUTLIER -57.29 -46.68 82.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.553 179.156 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.691 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -54.69 -50.99 66.94 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-O 120.85 0.357 . . . . 0.0 110.681 179.52 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -57.92 -40.24 79.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.4 179.599 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.47 HG22 ' CD2' ' A' ' 62' ' ' HIS . 0.9 OUTLIER -67.28 -63.98 0.95 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.978 179.791 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.919 ' O ' HG22 ' A' ' 63' ' ' VAL . 14.4 p -53.36 -40.88 42.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.793 0.33 . . . . 0.0 110.342 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.852 HD13 ' CD2' ' A' ' 103' ' ' LEU . 0.5 OUTLIER -64.09 -38.8 92.37 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.758 179.464 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 61.3 m -72.69 -44.86 61.23 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.167 179.688 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' HIS . . . . . 0.47 ' CD2' HG22 ' A' ' 58' ' ' THR . 53.3 m-70 -51.72 -54.4 28.74 Favored 'General case' 0 CA--C 1.521 -0.163 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.126 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 1.041 HG12 HG11 ' A' ' 66' ' ' VAL . 0.0 OUTLIER -54.11 -78.8 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.806 179.266 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.61 ' H ' HG23 ' A' ' 63' ' ' VAL . . . 60.96 17.0 7.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.354 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.557 ' O ' HG22 ' A' ' 66' ' ' VAL . 1.3 m-20 153.1 -68.22 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 122.765 0.426 . . . . 0.0 110.943 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 1.041 HG11 HG12 ' A' ' 63' ' ' VAL . 23.1 m 49.01 -164.95 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.054 -179.473 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.813 ' HB ' ' HB3' ' A' ' 97' ' ' ASN . 15.8 m -152.26 50.26 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.169 0 CA-C-O 121.129 0.49 . . . . 0.0 110.842 -178.52 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.886 HD22 ' CD1' ' A' ' 76' ' ' LEU . 1.0 OUTLIER -43.33 103.93 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.343 -179.485 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.497 HG22 ' O ' ' A' ' 96' ' ' GLY . 15.7 p -71.67 -164.82 0.13 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.773 178.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.1 -34.91 68.8 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.912 0.386 . . . . 0.0 110.808 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -70.69 -50.07 40.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.076 0.465 . . . . 0.0 110.434 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.833 ' HB3' HD23 ' A' ' 68' ' ' LEU . 66.7 m-20 -66.71 -36.25 82.05 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.641 179.774 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 38.8 m -65.87 -40.78 91.94 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.05 0.452 . . . . 0.0 109.812 178.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.13 -27.11 62.41 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 177.543 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 1.035 ' HG3' HG12 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -57.1 -59.72 4.67 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 114.044 -1.434 . . . . 0.0 109.642 178.228 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.907 HD21 HD21 ' A' ' 100' ' ' LEU . 3.2 mp -61.65 -49.89 74.71 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 178.707 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.593 ' O ' HG12 ' A' ' 81' ' ' VAL . 0.1 OUTLIER -44.07 -58.45 2.82 Favored 'General case' 0 CA--C 1.523 -0.086 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.263 179.948 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.543 ' HA ' HG12 ' A' ' 81' ' ' VAL . 25.8 mt-30 -61.07 -44.42 97.4 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.401 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' SER . . . . . 0.586 ' O ' HD11 ' A' ' 85' ' ' LEU . 1.0 OUTLIER -62.1 -22.44 65.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.96 179.649 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.589 HG22 ' O ' ' A' ' 85' ' ' LEU . 0.9 OUTLIER -94.54 -40.07 10.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.278 -179.66 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.593 HG12 ' O ' ' A' ' 77' ' ' LEU . 14.5 p -85.3 -6.02 10.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.936 -179.589 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.37 -72.82 0.08 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.808 0.337 . . . . 0.0 111.235 -179.756 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 10.1 t-80 -118.98 39.96 3.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.179 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 57.65 106.07 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.026 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.742 HD13 ' CZ ' ' A' ' 39' ' ' PHE . 1.3 pp -177.08 97.07 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.787 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -97.45 30.89 2.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.894 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 22.1 p-10 -66.04 -17.11 64.48 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.302 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.429 ' OH ' ' HG3' ' A' ' 108' ' ' MET . 24.8 m-85 -98.43 139.45 34.15 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 120.841 0.353 . . . . 0.0 110.376 179.545 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.686 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.4 OUTLIER -112.87 144.74 41.91 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 179.301 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.73 HD21 HD22 ' A' ' 100' ' ' LEU . 14.7 mt -137.62 132.46 33.05 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 114.618 1.34 . . . . 0.0 114.618 -176.399 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.558 ' HB3' ' HB ' ' A' ' 99' ' ' VAL . 4.1 ttp180 -104.78 165.48 11.04 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 105.291 -2.114 . . . . 0.0 105.291 175.137 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.608 ' HA ' ' HA ' ' A' ' 98' ' ' SER . 9.7 p -134.33 164.15 28.05 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 116.235 1.939 . . . . 0.0 116.235 -177.258 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.676 ' C ' ' O ' ' A' ' 97' ' ' ASN . 1.5 t -140.04 22.4 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.429 0 CA-C-N 111.5 -2.591 . . . . 0.0 107.142 178.148 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.473 ' N ' ' O ' ' A' ' 97' ' ' ASN . . . 69.14 -170.58 41.09 Favored Glycine 0 N--CA 1.439 -1.149 0 CA-C-N 113.265 -1.789 . . . . 0.0 116.26 -178.698 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -48.6 -36.68 16.22 Favored 'General case' 0 CA--C 1.506 -0.739 0 CA-C-N 113.896 -1.152 . . . . 0.0 108.846 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.497 ' O ' HG22 ' A' ' 69' ' ' THR . . . -62.62 -43.64 98.71 Favored Glycine 0 N--CA 1.431 -1.687 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 177.772 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.813 ' HB3' ' HB ' ' A' ' 67' ' ' VAL . 0.0 OUTLIER -165.27 168.64 16.77 Favored 'General case' 0 N--CA 1.433 -1.325 0 CA-C-O 121.842 0.83 . . . . 0.0 113.019 179.675 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.624 ' CA ' HG23 ' A' ' 93' ' ' VAL . 1.6 m -152.92 149.91 28.72 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 114.434 -1.257 . . . . 0.0 107.758 178.699 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.558 ' HB ' ' HB3' ' A' ' 91' ' ' ARG . 38.9 t -104.07 156.1 5.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 C-N-CA 120.634 -0.427 . . . . 0.0 111.787 -177.259 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.907 HD21 HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -109.2 128.14 54.8 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -177.899 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.686 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 17.7 t -141.3 104.31 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.929 0 N-CA-C 104.712 -2.329 . . . . 0.0 104.712 174.935 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.53 ' O ' HD23 ' A' ' 103' ' ' LEU . 0.1 OUTLIER -145.78 165.23 29.45 Favored 'General case' 0 C--N 1.311 -1.082 0 C-N-CA 118.495 -1.282 . . . . 0.0 113.788 -174.909 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.852 ' CD2' HD13 ' A' ' 60' ' ' LEU . 0.0 OUTLIER 154.51 -89.36 0.0 OUTLIER 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 113.456 -1.702 . . . . 0.0 111.358 176.896 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.533 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 59.07 21.33 9.26 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 -179.52 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.804 ' HB3' ' O ' ' A' ' 42' ' ' LEU . 5.4 m 140.92 173.26 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.432 1.093 . . . . 0.0 108.612 -178.767 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.81 102.22 11.78 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 119.986 -0.685 . . . . 0.0 112.545 -178.834 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.718 ' NE2' ' HB2' ' A' ' 48' ' ' ALA . 2.2 tt0 -168.15 165.06 13.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.4 177.621 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.744 ' CE ' ' HB2' ' A' ' 113' ' ' ALA . 2.1 ttp -165.75 147.45 7.2 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.062 0.458 . . . . 0.0 111.916 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.7 HG23 ' CD1' ' A' ' 39' ' ' PHE . 0.6 OUTLIER -114.7 161.38 18.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.794 178.867 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.721 ' HB3' ' CG2' ' A' ' 16' ' ' VAL . 18.2 mt -50.35 -59.22 4.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.89 0.376 . . . . 0.0 110.61 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.904 ' O ' HG13 ' A' ' 115' ' ' VAL . 2.9 tp-100 -45.13 -64.63 0.67 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.935 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.855 ' O ' HG22 ' A' ' 115' ' ' VAL . 0.4 OUTLIER -51.31 -38.14 51.4 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-O 121.526 0.679 . . . . 0.0 110.405 179.516 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.744 ' HB2' ' CE ' ' A' ' 108' ' ' MET . . . -55.05 -52.36 63.44 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.116 179.672 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.796 ' HZ2' HG22 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -79.63 -20.57 46.47 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.824 -178.866 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 1.035 HG12 ' HG3' ' A' ' 75' ' ' LYS . 9.0 m -65.17 -50.63 72.94 Favored 'Isoleucine or valine' 0 C--O 1.244 0.767 0 CA-C-O 122.129 0.966 . . . . 0.0 109.243 179.173 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.943 HD12 HG23 ' A' ' 115' ' ' VAL . 7.5 mp -69.31 -45.67 68.98 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 114.298 -1.319 . . . . 0.0 109.548 178.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.888 HD11 HD23 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -68.89 -15.2 63.43 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.805 179.328 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.648 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 8.6 tp10 -74.03 -51.74 14.91 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 106.295 -1.742 . . . . 0.0 106.295 177.101 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.497 ' HB2' ' OD2' ' A' ' 72' ' ' ASP . . . -72.34 -28.8 63.27 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.572 177.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.778 ' HA ' HG12 ' A' ' 66' ' ' VAL . . . -69.27 -55.16 11.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.98 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.739 ' HA ' HD22 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -64.24 -48.93 73.92 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.262 -179.73 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.648 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -59.28 -39.88 84.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.906 -179.833 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.584 ' HG3' HG13 ' A' ' 67' ' ' VAL . 12.0 tm0? -84.84 -34.04 22.74 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -178.381 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -96.48 -68.4 0.8 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -177.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.24 -66.4 0.9 Allowed 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -178.219 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' GLY . . . . . 0.602 ' N ' ' O ' ' A' ' 121' ' ' LEU . . . 96.7 -61.35 1.18 Allowed Glycine 0 N--CA 1.449 -0.438 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.882 -179.009 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -112.51 38.63 2.69 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.389 0.614 . . . . 0.0 109.776 178.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ARG . . . . . 0.404 ' NE ' ' HB3' ' A' ' 4' ' ' SER . 0.0 OUTLIER 71.05 111.35 0.06 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.778 -179.431 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 50.2 23.67 6.09 Favored Glycine 0 CA--C 1.517 0.213 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.793 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 11.2 p . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.258 -0.877 . . . . 0.0 110.933 -179.998 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.122 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -111.86 -43.05 3.67 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.85 0.357 . . . . 0.0 110.895 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 60.76 -174.09 0.12 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.019 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 204' ' ' PTR . . . . . 0.551 ' HE2' ' CE ' ' A' ' 26' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 21.3 p30 -135.32 49.76 2.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.843 0.354 . . . . 0.0 110.935 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 206' ' ' ASP . . . . . 0.431 ' O ' ' N ' ' B' ' 208' ' ' PHE . 2.5 m-20 58.37 163.98 0.08 OUTLIER Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.65 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 207' ' ' PRO . . . . . 0.47 ' HB3' HD23 ' A' ' 3' ' ' LEU . 34.8 Cg_endo -63.38 62.83 0.18 Allowed 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.777 2.318 . . . . 0.0 112.974 -179.675 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 208' ' ' PHE . . . . . 0.597 ' HB3' ' HB3' ' A' ' 11' ' ' GLN . 0.0 OUTLIER 44.23 18.17 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 121.023 0.44 . . . . 0.0 111.904 179.37 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 209' ' ' NH2 . . . . . 0.421 ' N ' ' O ' ' B' ' 207' ' ' PRO . . . . . . . . 0 C--N 1.329 -0.32 0 O-C-N 122.289 -0.257 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.417 ' O ' ' N ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.416 0 CA-C-O 120.681 0.277 . . . . 0.0 111.228 . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.554 ' ND2' HD22 ' A' ' 8' ' ' LEU . 0.7 OUTLIER 41.46 -90.67 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.832 -179.991 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.494 HD11 ' CA ' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -159.69 -46.37 0.05 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.831 0.348 . . . . 0.0 110.983 -179.752 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 169.59 138.65 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.423 -179.855 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 1.07 HD21 ' HB1' ' A' ' 120' ' ' ALA . 0.0 OUTLIER -55.97 -65.46 0.6 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.739 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p -49.98 -42.8 49.72 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.092 0.405 . . . . 0.0 112.092 -179.025 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ASP . . . . . 0.422 ' O ' ' NE2' ' A' ' 11' ' ' GLN . 1.4 m-20 -73.42 -60.51 2.21 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 121.116 0.484 . . . . 0.0 110.009 179.724 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.932 HD23 HD11 ' A' ' 117' ' ' LEU . 12.4 tp -47.0 -44.18 20.03 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.394 179.157 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.734 ' CG ' HD22 ' A' ' 121' ' ' LEU . 38.4 t-80 -65.26 -44.84 86.8 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.644 0.735 . . . . 0.0 109.35 178.477 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.467 ' HB3' ' CZ ' ' B' ' 208' ' ' PHE . 12.8 mmt85 -54.78 -54.67 39.08 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.772 -1.104 . . . . 0.0 111.584 -179.383 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.627 ' HG3' HG22 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -65.95 -48.14 72.32 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 120.951 -0.3 . . . . 0.0 111.757 -179.274 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.035 HG23 HD23 ' A' ' 110' ' ' LEU . 9.6 p -63.52 -49.6 81.89 Favored 'Isoleucine or valine' 0 C--O 1.243 0.725 0 CA-C-O 121.056 0.455 . . . . 0.0 111.266 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.654 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 72.8 m -56.41 -57.88 10.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.38 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.456 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 30.8 ttm180 -59.69 -35.47 74.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.149 0.5 . . . . 0.0 110.628 -179.645 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.573 ' CD1' HG23 ' A' ' 31' ' ' VAL . 10.6 mt -56.92 -65.33 0.63 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.866 -0.606 . . . . 0.0 112.155 -179.487 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.635 HG22 ' HB3' ' A' ' 20' ' ' SER . 1.4 t -70.93 -26.44 27.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 C-N-CA 120.276 -0.57 . . . . 0.0 110.724 -179.429 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.47 ' CG ' ' O ' ' A' ' 13' ' ' SER . 8.1 mm-40 -72.83 -21.87 60.89 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.367 179.596 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.456 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 11.7 pt20 -161.66 60.85 0.26 Allowed 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.767 0.317 . . . . 0.0 111.189 179.323 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 176.39 -61.62 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.778 179.64 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.652 ' OG ' ' HB1' ' A' ' 33' ' ' ALA . 0.4 OUTLIER -78.43 -81.28 0.1 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.78 0.324 . . . . 0.0 111.647 -179.229 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 106.06 60.32 0.61 Allowed Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.327 -179.519 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.8 t70 68.76 28.4 5.53 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.783 0.325 . . . . 0.0 111.142 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -91.02 -162.92 0.96 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.369 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.691 HG23 HG22 ' A' ' 109' ' ' THR . 0.0 OUTLIER -103.96 165.24 11.17 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 179.579 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.521 ' HA2' ' O ' ' A' ' 32' ' ' ALA . . . -133.67 153.02 20.67 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.013 -1.089 . . . . 0.0 113.276 -179.182 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.736 ' HG3' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -116.9 131.38 56.97 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 179.491 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.512 HD21 ' HA ' ' A' ' 2' ' ' ASN . 1.9 tt -105.93 146.75 29.6 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.168 0.509 . . . . 0.0 111.777 -179.526 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.584 ' NH2' HG11 ' A' ' 54' ' ' VAL . 0.0 OUTLIER 171.31 53.94 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.032 -179.935 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 86.27 -0.65 87.34 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 110.261 -1.135 . . . . 0.0 110.261 -177.287 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.482 ' HA ' ' HA ' ' B' ' 207' ' ' PRO . 0.1 OUTLIER -165.95 165.49 18.05 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 179.683 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.627 HG22 ' HG3' ' A' ' 11' ' ' GLN . 0.9 OUTLIER -121.02 116.62 50.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 C-N-CA 120.151 -0.62 . . . . 0.0 111.351 179.794 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.736 ' HB3' ' HG3' ' A' ' 26' ' ' LYS . . . -104.74 166.99 10.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.596 -179.694 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.652 ' HB1' ' OG ' ' A' ' 20' ' ' SER . . . -102.8 138.42 39.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.345 0.593 . . . . 0.0 111.872 -178.778 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 17.5 t30 -118.98 118.08 30.52 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.487 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.74 -29.79 5.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.226 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -59.38 -44.33 92.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.924 0.392 . . . . 0.0 110.911 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 30.6 p -121.33 -174.86 2.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.711 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 45.3 p -124.0 -115.64 0.29 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.14 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.56 ' CG ' ' N ' ' A' ' 40' ' ' GLN . 0.4 OUTLIER -171.47 -84.81 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.529 179.712 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.684 ' HB3' HD13 ' A' ' 85' ' ' LEU . 0.1 OUTLIER 80.74 32.26 0.15 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 122.726 0.41 . . . . 0.0 112.001 179.872 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.512 ' CA ' ' HB3' ' A' ' 105' ' ' SER . . . 71.55 -20.11 0.83 Allowed Glycine 0 CA--C 1.526 0.746 0 C-N-CA 121.286 -0.483 . . . . 0.0 113.447 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.902 HD11 ' HB2' ' A' ' 46' ' ' SER . 7.0 tp -25.95 140.33 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.292 0.637 . . . . 0.0 112.635 179.175 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -99.15 30.47 3.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.392 -179.799 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.624 HD11 ' HD2' ' A' ' 53' ' ' LYS . 1.2 mp 67.5 3.24 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 179.79 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.71 -27.97 23.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.692 0.282 . . . . 0.0 111.475 -179.549 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.902 ' HB2' HD11 ' A' ' 42' ' ' LEU . 0.3 OUTLIER -91.32 -36.21 13.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.511 -179.632 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 156.13 48.49 0.01 OUTLIER Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.368 -0.92 . . . . 0.0 113.163 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.721 ' HB1' HE21 ' A' ' 107' ' ' GLN . . . -119.15 -172.46 2.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.851 0.358 . . . . 0.0 110.749 179.566 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -119.69 129.32 54.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.132 179.268 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.917 ' O ' HG22 ' A' ' 54' ' ' VAL . 2.6 mt-10 -43.42 -30.06 0.51 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.96 0.41 . . . . 0.0 111.043 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.648 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -51.32 -59.92 3.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.303 179.769 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.618 ' CB ' ' HG2' ' A' ' 107' ' ' GLN . 3.3 mm-40 -53.57 -40.07 65.31 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.348 0.594 . . . . 0.0 109.886 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.624 ' HD2' HD11 ' A' ' 44' ' ' ILE . 0.1 OUTLIER -62.79 -65.49 0.68 Allowed 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.941 179.254 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.94 ' O ' HG23 ' A' ' 58' ' ' THR . 0.5 OUTLIER -51.37 -40.65 24.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 CA-C-O 120.862 0.363 . . . . 0.0 110.319 179.919 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.583 ' CZ ' ' HB1' ' A' ' 113' ' ' ALA . 0.8 OUTLIER -56.76 -44.86 82.2 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 178.586 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.716 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -56.61 -60.21 3.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.145 0.498 . . . . 0.0 109.794 178.56 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.452 ' O ' ' CB ' ' A' ' 61' ' ' SER . 2.0 mm-40 -46.95 -37.38 8.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.323 179.547 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.94 HG23 ' O ' ' A' ' 54' ' ' VAL . 26.3 p -66.87 -50.78 61.41 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.608 -179.423 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 1.007 ' CG1' HD12 ' A' ' 117' ' ' LEU . 0.1 OUTLIER -62.2 -46.33 96.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 120.187 -0.605 . . . . 0.0 112.349 -179.065 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.664 HD11 HD21 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -73.86 -28.48 61.6 Favored 'General case' 0 CA--C 1.515 -0.404 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.412 -179.313 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.452 ' CB ' ' O ' ' A' ' 57' ' ' GLN . 7.0 t -65.26 -54.58 27.22 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.019 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' HIS . . . . . 0.49 ' HB3' ' CD2' ' A' ' 5' ' ' LEU . 1.5 m170 -69.06 -20.86 64.11 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 177.894 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 1.07 HG22 ' HB2' ' A' ' 120' ' ' ALA . 94.3 t -110.73 60.19 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.039 178.833 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.408 ' O ' ' ND2' ' A' ' 65' ' ' ASN . . . -80.77 21.94 0.63 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.137 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.408 ' ND2' ' O ' ' A' ' 64' ' ' ALA . 0.4 OUTLIER 164.95 -53.08 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.908 0.385 . . . . 0.0 110.387 -179.55 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.94 ' CG1' HG13 ' A' ' 63' ' ' VAL . 27.2 m 43.49 -134.87 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.895 179.727 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.526 ' O ' ' O ' ' A' ' 98' ' ' SER . 3.5 p -156.4 -31.74 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 C-N-CA 120.586 -0.446 . . . . 0.0 111.835 -179.836 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 1.077 HD22 HD11 ' A' ' 76' ' ' LEU . 1.1 mt 37.84 98.73 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.434 -0.803 . . . . 0.0 113.052 178.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 33.9 p -73.46 -179.0 3.26 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.236 -0.654 . . . . 0.0 109.236 178.169 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.49 -34.09 3.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.998 0.428 . . . . 0.0 110.964 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -64.92 -63.06 1.2 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.929 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.92 ' O ' HD12 ' A' ' 76' ' ' LEU . 0.6 OUTLIER -55.86 -39.3 71.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.761 -179.899 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.67 -59.84 4.29 Favored 'General case' 0 C--O 1.241 0.625 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.794 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.507 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . . . -56.9 -28.86 62.43 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 177.579 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 1.083 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -60.91 -54.82 40.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.651 -1.159 . . . . 0.0 110.412 179.057 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 1.077 HD11 HD22 ' A' ' 68' ' ' LEU . 4.0 mp -60.71 -54.09 49.46 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.674 179.651 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.72 ' O ' HG22 ' A' ' 81' ' ' VAL . 3.7 pp -57.88 -29.2 64.85 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 120.462 -0.495 . . . . 0.0 110.583 -179.738 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.631 ' N ' HD12 ' A' ' 77' ' ' LEU . 44.4 tt0 -66.26 -59.41 3.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.985 0.421 . . . . 0.0 110.215 179.063 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 84.1 p -57.91 -28.25 64.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.799 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 4.3 m -80.95 -59.26 2.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.284 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.72 HG22 ' O ' ' A' ' 77' ' ' LEU . 25.0 m -55.6 -26.07 19.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.582 -179.684 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.31 -30.08 0.76 Allowed 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.814 0.34 . . . . 0.0 111.237 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -147.17 149.21 32.53 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.747 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 22.8 m-20 -62.46 83.69 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.915 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.684 HD13 ' HB3' ' A' ' 40' ' ' GLN . 1.6 tt -177.72 114.8 0.08 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.016 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 35.4 t30 -105.04 107.86 19.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.636 179.787 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 30.6 p30 -115.71 -20.36 10.13 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.556 -179.646 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.515 ' CG ' ' HB3' ' A' ' 102' ' ' SER . 0.9 OUTLIER -99.06 141.75 31.42 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.226 -179.499 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.664 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.0 OUTLIER -113.42 139.55 48.82 Favored 'General case' 0 N--CA 1.436 -1.157 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 179.945 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.682 HD11 ' CB ' ' A' ' 76' ' ' LEU . 22.8 mt -137.37 147.18 45.31 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 112.909 0.707 . . . . 0.0 112.909 -177.583 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.439 ' O ' ' CB ' ' A' ' 98' ' ' SER . 25.9 mtm180 -125.32 142.69 51.35 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 177.797 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.534 ' O ' HG13 ' A' ' 93' ' ' VAL . 4.0 p -105.3 139.13 40.41 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 113.49 0.922 . . . . 0.0 113.49 -178.567 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.534 HG13 ' O ' ' A' ' 92' ' ' SER . 20.5 m -161.59 -133.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.774 0 CA-C-N 113.674 -1.603 . . . . 0.0 107.641 178.548 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.483 ' O ' ' N ' ' A' ' 96' ' ' GLY . . . 34.41 34.86 0.04 OUTLIER Glycine 0 CA--C 1.518 0.23 0 C-N-CA 121.088 -0.577 . . . . 0.0 113.491 178.585 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ASN . . . . . 0.41 ' N ' ' O ' ' A' ' 93' ' ' VAL . 35.8 t30 66.67 -67.57 0.16 Allowed 'General case' 0 N--CA 1.461 0.117 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -178.222 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.483 ' N ' ' O ' ' A' ' 94' ' ' GLY . . . -126.13 21.12 6.2 Favored Glycine 0 N--CA 1.446 -0.698 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 177.831 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.453 ' OD1' ' HA3' ' A' ' 94' ' ' GLY . 0.2 OUTLIER -114.55 166.67 11.46 Favored 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 122.153 0.181 . . . . 0.0 110.545 -179.686 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.526 ' O ' ' O ' ' A' ' 67' ' ' VAL . 0.9 OUTLIER -135.78 165.43 25.62 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.523 0.678 . . . . 0.0 111.384 -179.895 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.415 ' N ' ' O ' ' A' ' 91' ' ' ARG . 0.6 OUTLIER -103.52 148.92 7.88 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.227 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.903 ' HB2' HD11 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -103.72 108.34 19.59 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 -177.699 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.664 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -127.04 106.18 15.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 N-CA-C 104.735 -2.32 . . . . 0.0 104.735 175.378 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.569 ' OG ' ' N ' ' A' ' 89' ' ' ASP . 37.2 m -151.49 164.66 36.3 Favored 'General case' 0 C--N 1.309 -1.184 0 C-N-CA 117.922 -1.511 . . . . 0.0 114.776 -174.57 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.664 HD21 HD11 ' A' ' 60' ' ' LEU . 0.0 OUTLIER 157.16 -90.92 0.0 OUTLIER 'General case' 0 N--CA 1.435 -1.2 0 CA-C-N 112.877 -1.965 . . . . 0.0 111.745 175.635 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.665 ' O ' ' HB2' ' A' ' 105' ' ' SER . 0.0 OUTLIER 60.74 12.36 3.69 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 120.692 -0.403 . . . . 0.0 109.97 -179.218 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.665 ' HB2' ' O ' ' A' ' 104' ' ' ARG . 0.3 OUTLIER 157.94 162.25 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 -178.948 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.572 ' HB3' ' HG3' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -107.3 101.03 10.44 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 119.482 -0.887 . . . . 0.0 112.793 -179.08 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.721 HE21 ' HB1' ' A' ' 48' ' ' ALA . 2.2 tt0 -169.12 164.33 11.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.714 177.033 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.496 ' HB2' ' HB2' ' A' ' 56' ' ' ALA . 0.7 OUTLIER -165.16 147.88 8.1 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 179.68 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.691 HG22 HG23 ' A' ' 24' ' ' THR . 2.3 p -107.92 165.22 11.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.751 179.04 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 1.035 HD23 HG23 ' A' ' 12' ' ' VAL . 2.6 mt -56.21 -53.2 59.93 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.716 -0.393 . . . . 0.0 110.18 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.874 ' O ' HG23 ' A' ' 115' ' ' VAL . 1.1 tp60 -49.22 -65.57 0.54 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.985 0.422 . . . . 0.0 110.089 179.431 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.889 ' O ' HD22 ' A' ' 116' ' ' LEU . 0.6 OUTLIER -48.71 -43.34 37.2 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.883 179.201 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.712 ' HB3' HG21 ' A' ' 12' ' ' VAL . . . -52.51 -62.7 1.47 Allowed 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.928 179.361 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.654 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -62.65 -26.98 68.91 Favored 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.75 179.975 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 1.083 HG22 ' CG ' ' A' ' 75' ' ' LYS . 59.1 t -56.89 -65.3 0.41 Allowed 'Isoleucine or valine' 0 C--O 1.248 0.99 0 CA-C-O 122.252 1.025 . . . . 0.0 110.495 179.101 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.889 HD22 ' O ' ' A' ' 112' ' ' ASP . 0.0 OUTLIER -60.33 -41.43 93.53 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 114.554 -1.203 . . . . 0.0 109.349 -179.7 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 1.035 HD23 HD13 ' A' ' 5' ' ' LEU . 0.2 OUTLIER -67.41 -18.39 65.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.001 179.169 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.654 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 0.9 OUTLIER -73.23 -44.59 59.29 Favored 'General case' 0 CA--C 1.503 -0.845 0 N-CA-C 106.721 -1.585 . . . . 0.0 106.721 177.968 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.509 ' HB1' ' H ' ' A' ' 68' ' ' LEU . . . -78.04 -28.6 49.05 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.106 177.88 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 1.07 ' HB1' HD21 ' A' ' 5' ' ' LEU . . . -69.37 -53.99 16.75 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.46 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.771 HD12 ' H ' ' A' ' 127' ' ' ALA . 0.0 OUTLIER -65.08 -44.47 88.79 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.765 179.869 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.654 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -56.62 -46.2 81.07 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.638 179.819 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.401 ' N ' ' HG2' ' A' ' 122' ' ' ARG . 19.9 mm100 -86.96 -28.94 22.41 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -177.846 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 124' ' ' GLU . . . . . 0.462 ' CG ' ' O ' ' A' ' 120' ' ' ALA . 0.5 OUTLIER -96.04 -67.03 0.87 Allowed 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 113.761 1.023 . . . . 0.0 113.761 -177.992 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.484 ' HA ' ' HA2' ' A' ' 129' ' ' GLY . 0.0 OUTLIER -96.24 -66.32 0.91 Allowed 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -177.275 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 126' ' ' GLY . . . . . 0.59 ' O ' ' HB3' ' A' ' 127' ' ' ALA . . . 80.7 77.55 0.98 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.943 -0.646 . . . . 0.0 111.597 -178.769 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.771 ' H ' HD12 ' A' ' 121' ' ' LEU . . . 87.31 -32.15 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 122.942 0.497 . . . . 0.0 110.379 -178.821 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 128' ' ' ARG . . . . . 0.45 ' CB ' ' O ' ' A' ' 127' ' ' ALA . 0.7 OUTLIER 158.64 43.17 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 121.353 0.596 . . . . 0.0 110.523 178.972 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 129' ' ' GLY . . . . . 0.484 ' HA2' ' HA ' ' A' ' 125' ' ' SER . . . 62.14 16.72 54.04 Favored Glycine 0 C--N 1.316 -0.537 0 C-N-CA 120.72 -0.752 . . . . 0.0 111.868 -179.026 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.202 -0.904 . . . . 0.0 110.8 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.109 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -167.9 84.27 0.2 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.844 0.354 . . . . 0.0 110.926 . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.6 -167.64 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.713 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 204' ' ' PTR . . . . . 0.406 ' CD1' ' HE3' ' A' ' 26' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -145.91 -94.77 0.09 Allowed 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 121.093 -0.243 . . . . 0.0 111.56 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 206' ' ' ASP . . . . . 0.504 ' O ' ' N ' ' B' ' 208' ' ' PHE . 1.2 m-20 -145.96 157.69 50.04 Favored Pre-proline 0 C--N 1.334 -0.102 0 CA-C-O 120.551 0.215 . . . . 0.0 110.995 -179.698 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 207' ' ' PRO . . . . . 0.482 ' HA ' ' HA ' ' A' ' 30' ' ' ASN . 12.7 Cg_endo -55.15 71.44 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 123.371 2.714 . . . . 0.0 113.292 -179.621 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 208' ' ' PHE . . . . . 0.504 ' N ' ' O ' ' B' ' 206' ' ' ASP . 0.2 OUTLIER 163.97 -31.41 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.73 179.333 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.458 -0.337 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 54.1 mtp . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.829 0.347 . . . . 0.0 111.179 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.428 ' CB ' HG21 ' A' ' 58' ' ' THR . 0.0 OUTLIER -97.62 -166.06 1.34 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.88 179.924 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 1.023 HD11 HD13 ' A' ' 8' ' ' LEU . 0.2 OUTLIER -106.91 -176.01 2.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.238 179.133 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -59.66 -176.91 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.905 0.384 . . . . 0.0 111.109 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 1.096 HD21 ' HB1' ' A' ' 120' ' ' ALA . 0.1 OUTLIER -90.72 -62.77 1.38 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.218 179.718 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.456 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 93.0 p -44.14 -38.51 3.72 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.773 -179.41 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.42 -47.61 32.72 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.878 0.37 . . . . 0.0 110.138 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 1.084 HD23 HD21 ' A' ' 117' ' ' LEU . 26.9 tp -60.4 -48.71 80.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.117 179.313 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.882 ' ND1' HD22 ' A' ' 121' ' ' LEU . 35.9 t-80 -61.99 -40.59 96.15 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 178.654 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.456 ' HB2' ' O ' ' A' ' 6' ' ' SER . 7.8 mtp180 -60.32 -55.13 37.35 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.34 179.815 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.67 ' HG3' ' CG1' ' A' ' 31' ' ' VAL . 2.6 pt20 -60.56 -55.42 33.55 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.643 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.793 ' O ' HG23 ' A' ' 16' ' ' VAL . 14.6 p -56.63 -51.71 62.79 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 CA-C-O 120.854 0.359 . . . . 0.0 111.371 179.774 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.624 ' HA ' ' HE2' ' A' ' 114' ' ' LYS . 44.1 t -65.05 -23.85 67.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 0.0 112.021 -179.669 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -77.54 -40.67 41.76 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 120.721 -0.392 . . . . 0.0 111.429 -179.014 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.884 HD13 HD21 ' A' ' 110' ' ' LEU . 0.0 OUTLIER -72.0 -46.84 55.73 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 119.472 -0.891 . . . . 0.0 109.224 179.343 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.933 HG22 ' HB3' ' A' ' 110' ' ' LEU . 42.0 t -57.84 -55.85 19.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.529 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.444 ' HG2' ' HE3' ' A' ' 114' ' ' LYS . 0.0 OUTLIER -70.5 -6.48 36.41 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.154 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.455 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 7.3 pt20 -171.87 64.47 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.586 -0.446 . . . . 0.0 111.883 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.455 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 1.9 tt0 174.58 -59.62 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.112 179.467 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.72 ' CB ' HD13 ' A' ' 110' ' ' LEU . 58.5 m -102.06 -42.32 6.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.402 -179.348 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 94.15 -46.7 2.22 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.643 -0.789 . . . . 0.0 111.766 -179.158 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.422 ' O ' ' O ' ' A' ' 23' ' ' CYS . 0.0 OUTLIER -176.71 12.5 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 111.636 0.236 . . . . 0.0 111.636 179.794 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.944 ' O ' HG22 ' A' ' 109' ' ' THR . 48.2 m -57.06 -154.08 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.935 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.746 HG21 ' CD2' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -104.28 151.13 23.78 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 121.068 0.461 . . . . 0.0 111.061 -179.727 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -104.81 135.97 12.83 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.651 -0.785 . . . . 0.0 113.481 -178.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.986 ' HB3' ' HB3' ' A' ' 32' ' ' ALA . 2.5 tmtm? -104.7 120.65 41.84 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.098 -0.705 . . . . 0.0 109.098 179.078 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.562 HD13 ' HA ' ' A' ' 55' ' ' PHE . 0.4 OUTLIER -104.42 145.86 29.67 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.44 0.638 . . . . 0.0 112.578 -178.488 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 162.23 63.97 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.621 179.692 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.694 ' O ' HD23 ' A' ' 3' ' ' LEU . . . 76.03 -4.45 46.53 Favored Glycine 0 C--N 1.336 0.569 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.098 -177.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.792 HD21 ' N ' ' B' ' 209' ' ' NH2 . 0.1 OUTLIER -166.36 166.23 16.72 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 -179.927 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.827 ' CG1' HD11 ' A' ' 15' ' ' LEU . 13.9 p -111.04 143.71 20.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.193 0.52 . . . . 0.0 111.592 178.667 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.986 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . . . -124.9 165.32 18.28 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.538 178.625 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -104.82 115.3 30.07 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -178.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.579 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 13.1 t-20 -102.55 136.67 41.95 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.659 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.1 ptmt -154.43 36.32 0.42 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.044 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -115.4 -23.06 9.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.265 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.515 ' C ' HG23 ' A' ' 38' ' ' THR . 3.4 m -125.99 -47.72 1.64 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.997 0.427 . . . . 0.0 110.88 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.515 HG23 ' C ' ' A' ' 37' ' ' THR . 2.5 p 82.83 86.46 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 122.046 0.927 . . . . 0.0 111.469 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.746 ' CD2' HG21 ' A' ' 24' ' ' THR . 2.0 m-85 -82.02 131.85 35.25 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 113.952 -1.477 . . . . 0.0 110.575 179.348 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -115.74 -34.57 4.78 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.439 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.547 ' O ' ' HB2' ' A' ' 105' ' ' SER . . . 151.98 50.75 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 N-CA-C 111.372 -0.691 . . . . 0.0 111.372 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.797 HD11 ' H ' ' A' ' 46' ' ' SER . 0.0 OUTLIER -108.14 -173.8 2.37 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.962 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.661 ' H ' HD12 ' A' ' 42' ' ' LEU . 94.1 m -119.08 67.43 0.79 Allowed 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -178.016 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.798 ' HA ' ' HB3' ' A' ' 48' ' ' ALA . 1.0 OUTLIER 45.76 5.97 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 178.591 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.511 ' N ' ' O ' ' A' ' 43' ' ' THR . . . -72.0 -57.35 4.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.693 0.282 . . . . 0.0 111.584 -179.145 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.797 ' H ' HD11 ' A' ' 42' ' ' LEU . 0.2 OUTLIER -58.31 -61.31 2.67 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.867 0.365 . . . . 0.0 110.687 -179.773 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -179.69 31.06 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.672 179.775 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.798 ' HB3' ' HA ' ' A' ' 44' ' ' ILE . . . -80.58 -166.91 1.18 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.014 0.435 . . . . 0.0 111.216 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.537 ' N ' ' OE2' ' A' ' 52' ' ' GLU . 3.2 mmt180 -137.82 -159.15 0.93 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.165 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.918 ' O ' HG22 ' A' ' 54' ' ' VAL . 3.6 mp0 -95.17 -30.71 13.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.594 0.235 . . . . 0.0 111.606 -179.803 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.512 ' CB ' ' HG2' ' A' ' 26' ' ' LYS . 0.6 OUTLIER -62.04 -45.41 93.67 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.283 -0.417 . . . . 0.0 112.051 -179.228 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.537 ' OE2' ' N ' ' A' ' 49' ' ' ARG . 0.8 OUTLIER -59.28 -65.24 0.7 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.029 0.443 . . . . 0.0 110.294 179.94 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.697 ' HE2' HD11 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -46.44 -59.44 2.96 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.604 179.648 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.918 HG22 ' O ' ' A' ' 50' ' ' GLU . 11.7 m -49.09 -44.12 16.08 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-O 120.988 0.423 . . . . 0.0 110.308 179.561 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.588 ' HE2' HG23 ' A' ' 31' ' ' VAL . 0.4 OUTLIER -53.5 -53.14 55.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.805 178.768 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.735 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -55.07 -46.44 75.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.811 179.447 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -66.12 -42.25 89.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.221 0.534 . . . . 0.0 110.561 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.428 HG21 ' CB ' ' A' ' 2' ' ' ASN . 93.0 m -60.01 -47.54 85.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.956 -179.858 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.813 ' CG2' HD12 ' A' ' 117' ' ' LEU . 11.1 p -69.96 -38.03 74.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.853 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.624 HD13 ' O ' ' A' ' 102' ' ' SER . 4.0 tp -59.29 -37.59 78.06 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 121.146 0.498 . . . . 0.0 109.766 179.551 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 15.5 t -72.2 -52.96 14.08 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.032 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' HIS . . . . . 0.545 ' HB3' HD22 ' A' ' 5' ' ' LEU . 7.2 m-70 -55.49 -35.06 65.15 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 121.092 0.472 . . . . 0.0 110.322 179.573 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 1.031 HG13 ' CG1' ' A' ' 66' ' ' VAL . 57.0 t -83.7 -69.97 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.176 179.172 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.493 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 42.82 28.67 0.14 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.605 178.9 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.529 ' H ' HG12 ' A' ' 63' ' ' VAL . 0.7 OUTLIER 157.37 -75.97 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.782 0 CA-C-O 120.709 0.29 . . . . 0.0 111.647 179.853 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 1.031 ' CG1' HG13 ' A' ' 63' ' ' VAL . 35.4 m 46.52 -139.25 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.614 -179.475 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.506 ' O ' ' O ' ' A' ' 98' ' ' SER . 3.5 p -158.05 -20.84 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -179.199 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.659 HD23 ' HB3' ' A' ' 72' ' ' ASP . 2.0 mp 36.68 90.13 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 179.705 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 30.5 p -67.18 -173.69 0.29 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 179.006 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.506 ' NE2' ' N ' ' A' ' 71' ' ' GLU . 0.0 OUTLIER -49.5 -30.49 8.43 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.954 0.406 . . . . 0.0 110.749 179.99 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.506 ' N ' ' NE2' ' A' ' 70' ' ' GLN . 0.6 OUTLIER -65.09 -65.04 0.72 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.691 179.661 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.659 ' HB3' HD23 ' A' ' 68' ' ' LEU . 0.9 OUTLIER -54.95 -35.06 63.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.978 -179.942 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.0 m -59.36 -61.69 2.44 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 109.125 -0.695 . . . . 0.0 109.125 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.529 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . . . -56.86 -26.24 58.24 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 121.501 0.667 . . . . 0.0 109.241 177.744 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 1.057 ' CG ' HG22 ' A' ' 115' ' ' VAL . 1.0 OUTLIER -62.18 -62.32 1.85 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.718 -1.128 . . . . 0.0 111.005 179.4 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 1.025 HD13 HD21 ' A' ' 90' ' ' LEU . 0.6 OUTLIER -59.33 -49.52 77.5 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.691 179.891 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.632 HD12 ' C ' ' A' ' 77' ' ' LEU . 1.5 pp -61.16 -29.43 69.78 Favored 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.222 179.653 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.1 -56.95 11.28 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 178.73 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' SER . . . . . 0.456 ' O ' HD23 ' A' ' 85' ' ' LEU . 0.1 OUTLIER -59.13 -29.2 67.23 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.289 179.113 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.498 ' HA ' ' CB ' ' A' ' 85' ' ' LEU . 51.6 m -68.01 -65.1 0.74 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.181 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.487 HG12 ' O ' ' A' ' 77' ' ' LEU . 10.9 p -60.05 -24.3 29.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.25 -179.831 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 2.5 mtpp -64.64 -66.58 0.52 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.831 -179.438 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' HIS . . . . . 0.439 ' O ' ' N ' ' A' ' 85' ' ' LEU . 36.1 m170 -131.19 106.76 8.54 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.227 0.455 . . . . 0.0 112.227 -179.004 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 36.53 -89.74 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.191 179.038 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.743 HD11 ' HD2' ' A' ' 88' ' ' TYR . 0.0 OUTLIER 75.31 -140.91 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.83 -179.992 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.505 ' CB ' ' O ' ' A' ' 85' ' ' LEU . 3.7 t-20 89.31 35.76 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.171 0.51 . . . . 0.0 110.172 -179.235 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ASN . . . . . 0.576 ' ND2' ' O ' ' A' ' 103' ' ' LEU . 5.1 t-20 -121.81 -27.0 4.74 Favored 'General case' 0 C--O 1.251 1.162 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.006 -179.704 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 1.315 ' HA ' ' OG ' ' A' ' 102' ' ' SER . 95.0 m-85 -99.13 125.42 44.66 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 115.608 -0.724 . . . . 0.0 112.179 -178.353 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.787 ' CG ' HG13 ' A' ' 101' ' ' VAL . 0.7 OUTLIER -104.64 136.54 43.98 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 -179.966 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 1.025 HD21 HD13 ' A' ' 76' ' ' LEU . 30.6 mt -129.48 155.08 46.3 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 -176.352 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.716 ' HB2' HG12 ' A' ' 99' ' ' VAL . 0.0 OUTLIER -132.31 161.71 32.86 Favored 'General case' 0 C--O 1.215 -0.746 0 CA-C-N 114.703 -1.135 . . . . 0.0 108.558 177.585 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.794 ' O ' HG13 ' A' ' 93' ' ' VAL . 22.9 p -103.64 158.64 16.23 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.882 0.849 . . . . 0.0 112.676 -178.87 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.794 HG13 ' O ' ' A' ' 92' ' ' SER . 0.0 OUTLIER 166.18 151.05 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.437 -1.117 0 CA-C-N 113.695 -1.593 . . . . 0.0 107.884 -179.141 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.629 ' HA3' ' ND2' ' A' ' 97' ' ' ASN . . . 91.51 19.89 39.76 Favored Glycine 0 C--N 1.291 -1.957 0 C-N-CA 119.899 -1.143 . . . . 0.0 112.901 -179.63 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 74.02 -46.96 0.63 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.825 -0.805 . . . . 0.0 108.825 -178.1 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.434 ' H ' ' C ' ' A' ' 94' ' ' GLY . . . -141.58 15.2 2.69 Favored Glycine 0 N--CA 1.441 -0.983 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.852 178.848 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.629 ' ND2' ' HA3' ' A' ' 94' ' ' GLY . 0.5 OUTLIER -105.46 166.64 10.29 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 117.252 0.526 . . . . 0.0 109.831 179.25 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.689 ' CB ' ' O ' ' A' ' 91' ' ' ARG . 0.2 OUTLIER -139.27 164.98 28.39 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.294 0.569 . . . . 0.0 110.784 179.772 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.716 HG12 ' HB2' ' A' ' 91' ' ' ARG . 0.5 OUTLIER -104.2 152.25 6.57 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.292 179.636 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.679 HD13 ' CD1' ' A' ' 116' ' ' LEU . 7.5 tp -103.19 105.24 15.48 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 121.638 0.732 . . . . 0.0 112.56 -178.598 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.787 HG13 ' CG ' ' A' ' 89' ' ' ASP . 1.6 p -123.68 110.04 24.8 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.96 0 N-CA-C 104.982 -2.229 . . . . 0.0 104.982 175.761 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' SER . . . . . 1.315 ' OG ' ' HA ' ' A' ' 88' ' ' TYR . 2.5 t -166.85 166.79 15.42 Favored 'General case' 0 CA--C 1.495 -1.171 0 N-CA-C 115.27 1.582 . . . . 0.0 115.27 -174.178 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.637 ' O ' ' C ' ' A' ' 104' ' ' ARG . 0.1 OUTLIER 168.99 -45.41 0.01 OUTLIER 'General case' 0 N--CA 1.435 -1.215 0 CA-C-N 113.721 -1.581 . . . . 0.0 112.09 174.032 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.637 ' C ' ' O ' ' A' ' 103' ' ' LEU . 0.0 OUTLIER 16.1 81.25 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.671 0 O-C-N 123.58 0.55 . . . . 0.0 110.044 178.457 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.636 ' O ' HD13 ' A' ' 103' ' ' LEU . 0.7 OUTLIER 86.02 -166.43 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 -176.28 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.615 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -132.42 101.74 5.46 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 119.989 -0.684 . . . . 0.0 110.629 179.368 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.735 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 1.5 mt-30 -169.13 165.51 11.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.441 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.699 ' SD ' HG11 ' A' ' 59' ' ' VAL . 0.7 OUTLIER -159.87 143.09 14.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.488 0.661 . . . . 0.0 112.588 178.505 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.944 HG22 ' O ' ' A' ' 23' ' ' CYS . 0.2 OUTLIER -104.31 164.77 11.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.572 -1.195 . . . . 0.0 109.048 178.31 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.933 ' HB3' HG22 ' A' ' 16' ' ' VAL . 2.4 mt -57.32 -51.77 68.03 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.708 0.289 . . . . 0.0 111.044 -179.368 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.909 ' O ' HG23 ' A' ' 115' ' ' VAL . 2.9 tp-100 -54.7 -61.45 2.3 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.576 179.364 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.833 ' O ' HD22 ' A' ' 116' ' ' LEU . 11.7 m-20 -44.07 -53.81 6.04 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-O 121.074 0.464 . . . . 0.0 111.295 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.602 ' HB3' HG21 ' A' ' 12' ' ' VAL . . . -49.92 -60.27 3.08 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.188 179.33 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.638 ' HD2' HG11 ' A' ' 16' ' ' VAL . 0.2 OUTLIER -54.02 -32.49 54.45 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.414 179.473 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 1.057 HG22 ' CG ' ' A' ' 75' ' ' LYS . 48.1 t -61.99 -65.36 0.51 Allowed 'Isoleucine or valine' 0 C--O 1.241 0.63 0 CA-C-O 121.737 0.78 . . . . 0.0 111.912 -178.518 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.833 HD22 ' O ' ' A' ' 112' ' ' ASP . 0.3 OUTLIER -63.32 -34.12 77.0 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.298 -178.941 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 1.084 HD21 HD23 ' A' ' 8' ' ' LEU . 0.6 OUTLIER -73.15 -21.92 60.61 Favored 'General case' 0 CA--C 1.512 -0.498 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.549 178.898 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.567 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 6.5 tp10 -70.17 -46.89 63.7 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 106.267 -1.753 . . . . 0.0 106.267 177.134 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.545 ' HB2' ' OD2' ' A' ' 72' ' ' ASP . . . -74.36 -24.25 59.14 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.085 -1.416 . . . . 0.0 110.236 177.852 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 1.096 ' HB1' HD21 ' A' ' 5' ' ' LEU . . . -77.01 -50.72 12.49 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.471 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.882 HD22 ' ND1' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -62.68 -38.88 92.09 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.715 179.383 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.567 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.1 OUTLIER -73.7 -38.34 64.89 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.313 -179.558 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 29.6 mm100 -89.89 -24.88 21.24 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -178.033 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' GLU . . . . . 0.405 ' HG3' HD23 ' A' ' 5' ' ' LEU . 20.5 mm-40 -84.72 -66.97 0.83 Allowed 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.415 -179.245 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 9.5 t -96.94 -54.3 3.24 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.363 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 108.25 63.27 0.56 Allowed Glycine 0 CA--C 1.498 -1.012 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 -178.456 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . 49.22 28.03 2.06 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 -177.195 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.74 -57.98 1.95 Allowed 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 114.789 -1.096 . . . . 0.0 111.59 -178.076 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 129' ' ' GLY . . . . . 0.408 ' HA2' ' HB3' ' A' ' 6' ' ' SER . . . 110.62 -21.77 23.03 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.462 -179.413 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 19.3 p . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.218 -0.896 . . . . 0.0 111.12 179.942 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.114 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 61.11 -81.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.726 0.298 . . . . 0.0 110.969 . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -146.15 162.4 38.07 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.839 0.352 . . . . 0.0 110.723 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 204' ' ' PTR . . . . . 0.437 ' HB3' ' HB3' ' A' ' 30' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 37.0 m-20 44.62 -90.44 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.773 -0.649 . . . . 0.0 112.548 179.179 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 206' ' ' ASP . . . . . 0.432 ' CB ' ' HD2' ' B' ' 207' ' ' PRO . 1.9 m-20 -110.18 165.93 11.73 Favored Pre-proline 0 CA--C 1.528 0.125 0 CA-C-O 120.911 0.386 . . . . 0.0 111.682 -178.841 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 207' ' ' PRO . . . . . 0.515 ' HB3' ' NE2' ' A' ' 11' ' ' GLN . 11.0 Cg_endo -52.89 164.87 1.4 Allowed 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 123.216 2.61 . . . . 0.0 112.698 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 208' ' ' PHE . . . . . 0.558 ' C ' HD21 ' A' ' 30' ' ' ASN . 95.0 m-85 64.87 -15.42 0.09 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.435 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 209' ' ' NH2 . . . . . 0.792 ' N ' HD21 ' A' ' 30' ' ' ASN . . . . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 116.736 -0.211 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.765 0.317 . . . . 0.0 111.277 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -158.34 -162.3 1.11 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.765 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.861 HD22 ' OE1' ' A' ' 11' ' ' GLN . 5.4 mp -85.49 -99.29 0.06 Allowed 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.735 179.773 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.418 ' O ' ' CB ' ' A' ' 8' ' ' LEU . 1.4 m -168.33 161.05 11.84 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 179.672 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.807 HD21 ' HB3' ' A' ' 62' ' ' HIS . 21.7 mt -56.82 -65.08 0.68 Allowed 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 121.37 0.605 . . . . 0.0 111.002 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.8 t -46.71 -45.4 19.47 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-N 115.165 -0.925 . . . . 0.0 112.091 -178.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.23 -64.5 1.12 Allowed 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.805 0.336 . . . . 0.0 110.65 -179.682 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.8 HD23 ' CD2' ' A' ' 117' ' ' LEU . 5.6 tp -44.27 -42.35 6.57 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.258 179.351 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.481 ' HA ' HG12 ' A' ' 12' ' ' VAL . 37.6 t-80 -70.51 -44.19 68.13 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.325 178.364 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.473 ' HB3' ' CZ ' ' B' ' 208' ' ' PHE . 11.3 mmt180 -55.67 -53.66 53.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.768 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.861 ' OE1' HD22 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -63.46 -54.78 31.19 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 120.885 -0.326 . . . . 0.0 111.253 -179.88 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.941 ' HA ' HD12 ' A' ' 15' ' ' LEU . 13.2 p -54.19 -48.58 66.1 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 CA-C-O 121.189 0.519 . . . . 0.0 110.942 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.632 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 60.8 m -62.96 -33.78 76.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.484 -0.78 . . . . 0.0 112.101 -179.519 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.404 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -74.28 -29.0 61.46 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.318 -179.295 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.941 HD12 ' HA ' ' A' ' 12' ' ' VAL . 0.5 OUTLIER -75.84 -50.77 14.16 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.517 179.628 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.873 ' CG2' ' HB3' ' A' ' 110' ' ' LEU . 69.6 t -66.71 -54.42 25.6 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.408 0 CA-C-O 121.202 0.525 . . . . 0.0 111.519 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 13' ' ' SER . 0.3 OUTLIER -63.23 -8.59 8.61 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.767 -178.46 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -141.88 25.12 1.98 Allowed 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 120.996 -0.282 . . . . 0.0 111.594 179.322 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.453 ' N ' ' O ' ' A' ' 15' ' ' LEU . 3.8 tt0 179.73 -69.93 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.944 ' CB ' HD13 ' A' ' 110' ' ' LEU . 0.7 OUTLIER -83.44 68.83 9.89 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.992 0.425 . . . . 0.0 111.917 -178.161 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -36.41 -34.55 0.09 OUTLIER Glycine 0 CA--C 1.521 0.441 0 CA-C-N 115.73 -0.668 . . . . 0.0 114.009 -179.732 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -166.57 9.04 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -179.508 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.55 ' HB2' ' HB3' ' A' ' 20' ' ' SER . 96.2 m -53.72 -171.26 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.708 0.289 . . . . 0.0 110.819 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.594 HG21 ' HB3' ' A' ' 39' ' ' PHE . 8.2 m -103.57 148.04 26.46 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 179.829 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.403 ' HA2' ' O ' ' A' ' 32' ' ' ALA . . . -104.51 144.23 15.8 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.095 -1.05 . . . . 0.0 113.507 -178.67 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.938 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -112.35 126.45 55.29 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 179.17 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.846 HD12 ' HA ' ' A' ' 55' ' ' PHE . 0.4 OUTLIER -104.67 144.2 32.05 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.308 0.575 . . . . 0.0 111.893 -178.846 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.441 ' H ' HD23 ' A' ' 27' ' ' LEU . 0.0 OUTLIER 171.12 57.28 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.135 179.891 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.841 ' C ' HD11 ' A' ' 3' ' ' LEU . . . 84.52 -2.25 88.13 Favored Glycine 0 N--CA 1.451 -0.35 0 N-CA-C 111.129 -0.788 . . . . 0.0 111.129 -177.883 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.569 ' N ' HD11 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -166.45 165.5 16.97 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 179.731 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.708 HG22 ' HG3' ' A' ' 11' ' ' GLN . 1.3 m -119.78 117.8 54.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 C-N-CA 119.857 -0.737 . . . . 0.0 111.487 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.938 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -108.26 166.87 10.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.111 -179.296 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.736 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -103.33 132.24 49.75 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.221 0.534 . . . . 0.0 111.485 -179.305 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.403 ' O ' ' HB3' ' A' ' 23' ' ' CYS . 5.2 t30 -115.33 121.24 42.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.67 -179.52 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.5 tttt -113.69 -10.88 13.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.512 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -79.91 -66.78 0.83 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.781 0.324 . . . . 0.0 111.27 -179.704 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.6 168.93 17.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.332 -179.531 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 61.6 p -131.48 114.58 15.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.496 179.836 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.729 ' CZ ' HG22 ' A' ' 109' ' ' THR . 0.0 OUTLIER -79.59 -179.72 7.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.19 -179.586 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.502 ' N ' ' CG ' ' A' ' 39' ' ' PHE . 0.8 OUTLIER 165.63 36.28 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.512 179.716 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.496 ' C ' ' HB2' ' A' ' 107' ' ' GLN . . . 89.37 -34.83 3.86 Favored Glycine 0 CA--C 1.52 0.375 0 CA-C-N 115.76 -0.655 . . . . 0.0 112.367 -179.33 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.622 HD21 ' HB3' ' A' ' 46' ' ' SER . 0.4 OUTLIER -21.0 139.51 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.404 0.681 . . . . 0.0 112.785 179.579 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.9 27.41 1.82 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.599 -179.791 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.825 HG23 ' O ' ' A' ' 48' ' ' ALA . 8.7 mm 65.65 5.6 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -87.24 -29.12 21.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.777 0.322 . . . . 0.0 111.439 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.622 ' HB3' HD21 ' A' ' 42' ' ' LEU . 1.3 t -87.21 -32.52 19.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.081 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.41 40.16 0.03 OUTLIER Glycine 0 CA--C 1.518 0.281 0 C-N-CA 120.462 -0.875 . . . . 0.0 113.197 179.836 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.825 ' O ' HG23 ' A' ' 44' ' ' ILE . . . -106.86 169.28 8.64 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.841 0.32 . . . . 0.0 110.846 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.453 ' C ' HD12 ' A' ' 44' ' ' ILE . 14.9 mtp180 -87.98 132.13 34.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.844 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.63 ' O ' HG23 ' A' ' 54' ' ' VAL . 7.9 tt0 -52.12 -30.46 26.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.056 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.51 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 19.5 p -61.31 -55.11 35.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.969 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.524 ' CB ' ' HG2' ' A' ' 107' ' ' GLN . 13.8 mt-10 -51.6 -44.36 62.81 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.082 0.468 . . . . 0.0 110.411 179.733 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.469 ' HG3' ' HB3' ' A' ' 106' ' ' ASP . 0.1 OUTLIER -56.57 -62.52 1.67 Allowed 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.33 178.945 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.63 HG23 ' O ' ' A' ' 50' ' ' GLU . 33.5 t -49.81 -32.04 7.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 121.167 0.508 . . . . 0.0 110.33 179.262 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.846 ' HA ' HD12 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -64.98 -48.02 75.47 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.362 179.306 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.438 ' HB2' ' C ' ' A' ' 107' ' ' GLN . . . -59.27 -39.12 81.89 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-O 121.028 0.442 . . . . 0.0 110.061 179.118 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 4.0 mm100 -69.21 -33.85 73.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.943 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.403 HG21 HD11 ' A' ' 27' ' ' LEU . 48.3 m -75.59 -50.97 13.94 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 120.911 0.386 . . . . 0.0 110.505 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.765 HG13 ' O ' ' A' ' 55' ' ' PHE . 3.0 m -62.75 -37.33 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.694 179.737 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.776 HD13 HD23 ' A' ' 103' ' ' LEU . 4.9 tp -70.14 -44.51 68.71 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.556 179.415 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 74.8 m -60.85 -62.23 2.01 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.612 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' HIS . . . . . 0.807 ' HB3' HD21 ' A' ' 5' ' ' LEU . 1.9 m-70 -49.33 -43.27 43.52 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 121.08 0.467 . . . . 0.0 110.703 -179.768 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 1.011 HG11 HD23 ' A' ' 100' ' ' LEU . 67.7 t -74.2 -80.15 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.242 179.228 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.539 ' HB3' ' O ' ' A' ' 63' ' ' VAL . . . 75.21 -26.02 0.2 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.358 -0.383 . . . . 0.0 112.005 179.389 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.442 ' O ' HG22 ' A' ' 66' ' ' VAL . 1.5 p30 -170.03 -51.99 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.065 0.46 . . . . 0.0 110.396 -179.197 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.993 ' CG1' HG13 ' A' ' 63' ' ' VAL . 35.9 m 46.56 -139.72 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.555 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.532 ' O ' ' O ' ' A' ' 98' ' ' SER . 3.4 p -153.47 -24.85 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 N-CA-C 113.367 0.876 . . . . 0.0 113.367 -179.259 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.843 HD23 ' HB3' ' A' ' 72' ' ' ASP . 1.5 mp 34.07 98.42 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 112.659 0.615 . . . . 0.0 112.659 179.432 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.594 HG23 ' NH1' ' A' ' 122' ' ' ARG . 68.8 p -60.66 -122.94 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 179.081 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.35 -39.54 9.98 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.347 0.594 . . . . 0.0 109.869 179.139 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.501 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 2.1 tt0 -59.6 -64.92 0.77 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.215 -179.886 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.843 ' HB3' HD23 ' A' ' 68' ' ' LEU . 96.1 m-20 -52.44 -33.14 42.77 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.237 -179.676 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 97.8 m -61.62 -63.9 1.12 Allowed 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.66 -24.25 60.84 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 177.667 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 1.082 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.2 OUTLIER -59.23 -65.09 0.72 Allowed 'General case' 0 C--O 1.234 0.261 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.428 179.017 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 1.097 HD13 HD21 ' A' ' 90' ' ' LEU . 0.4 OUTLIER -58.55 -38.92 78.84 Favored 'General case' 0 CA--C 1.52 -0.206 0 N-CA-C 109.425 -0.584 . . . . 0.0 109.425 178.981 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.791 ' O ' HG12 ' A' ' 81' ' ' VAL . 0.1 OUTLIER -50.75 -49.83 57.1 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.726 179.648 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -67.36 -53.04 33.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.878 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.33 -21.54 59.93 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.161 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.407 HG22 ' CB ' ' A' ' 85' ' ' LEU . 45.8 m -94.32 -49.07 5.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.145 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.791 HG12 ' O ' ' A' ' 77' ' ' LEU . 7.2 p -76.7 -6.11 8.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.74 -179.833 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 10.6 ptmm? -46.62 -33.19 3.99 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.899 0.381 . . . . 0.0 111.134 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -179.23 -57.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.785 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -101.08 75.88 1.7 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.734 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.632 HD23 HG23 ' A' ' 81' ' ' VAL . 0.2 OUTLIER -84.16 85.13 7.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.052 179.995 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -173.39 37.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.391 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 16.5 p-10 -125.77 -52.33 1.57 Allowed 'General case' 0 C--O 1.234 0.269 0 C-N-CA 121.08 -0.248 . . . . 0.0 111.457 179.651 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.81 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 1.3 m-85 -103.05 137.28 41.44 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.691 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.733 ' CG ' HG13 ' A' ' 101' ' ' VAL . 0.4 OUTLIER -105.1 140.84 37.67 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 121.958 0.885 . . . . 0.0 110.921 -177.597 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 1.097 HD21 HD13 ' A' ' 76' ' ' LEU . 11.3 mt -132.2 150.1 52.23 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.137 -0.938 . . . . 0.0 113.134 -178.027 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.453 ' O ' ' CB ' ' A' ' 98' ' ' SER . 0.0 OUTLIER -137.18 148.99 46.94 Favored 'General case' 0 C--O 1.219 -0.534 0 N-CA-C 107.67 -1.234 . . . . 0.0 107.67 177.551 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.621 ' O ' HG13 ' A' ' 93' ' ' VAL . 11.4 p -111.26 141.88 44.2 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 -178.384 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.621 HG13 ' O ' ' A' ' 92' ' ' SER . 15.9 m -163.36 -130.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 CA-C-N 113.848 -1.524 . . . . 0.0 108.283 178.617 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.536 ' O ' ' N ' ' A' ' 96' ' ' GLY . . . 32.94 35.87 0.03 OUTLIER Glycine 0 C--N 1.332 0.33 0 C-N-CA 121.321 -0.466 . . . . 0.0 113.662 178.691 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ASN . . . . . 0.418 ' N ' ' O ' ' A' ' 93' ' ' VAL . 8.4 t30 64.57 -70.13 0.08 Allowed 'General case' 0 N--CA 1.462 0.134 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 -178.297 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLY . . . . . 0.536 ' N ' ' O ' ' A' ' 94' ' ' GLY . . . -122.47 23.69 7.08 Favored Glycine 0 N--CA 1.445 -0.723 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 177.852 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.418 ' ND2' ' HA3' ' A' ' 94' ' ' GLY . 0.0 OUTLIER -119.92 166.64 13.05 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.555 0.216 . . . . 0.0 110.616 -179.708 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.532 ' O ' ' O ' ' A' ' 67' ' ' VAL . 0.2 OUTLIER -133.1 165.57 24.45 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.518 0.675 . . . . 0.0 111.122 -179.981 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -103.93 140.04 23.19 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 179.087 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 1.011 HD23 HG11 ' A' ' 63' ' ' VAL . 8.7 tp -104.29 106.37 16.84 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -178.2 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.733 HG13 ' CG ' ' A' ' 89' ' ' ASP . 0.5 OUTLIER -122.48 123.05 67.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 104.741 -2.318 . . . . 0.0 104.741 176.361 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.81 ' HB2' ' HA ' ' A' ' 88' ' ' TYR . 72.2 p -165.31 166.79 18.44 Favored 'General case' 0 C--N 1.312 -1.06 0 C-N-CA 116.876 -1.93 . . . . 0.0 116.161 -173.782 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.776 HD23 HD13 ' A' ' 60' ' ' LEU . 0.1 OUTLIER 161.5 -89.73 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 112.815 -1.993 . . . . 0.0 111.789 175.52 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.573 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 52.75 40.16 29.95 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 -179.729 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.573 ' CB ' ' O ' ' A' ' 104' ' ' ARG . 57.7 m 116.64 156.65 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.392 1.077 . . . . 0.0 108.298 -177.939 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.469 ' HB3' ' HG3' ' A' ' 53' ' ' LYS . 1.5 m-20 -104.92 102.55 12.07 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -178.27 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.802 ' NE2' ' HB1' ' A' ' 48' ' ' ALA . 2.6 tt0 -167.65 148.55 5.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.058 177.522 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.77 ' HE2' ' CZ ' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -143.72 159.22 42.88 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -179.98 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.729 HG22 ' CZ ' ' A' ' 39' ' ' PHE . 1.2 t -117.5 160.82 20.59 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.405 -1.27 . . . . 0.0 109.409 179.133 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.944 HD13 ' CB ' ' A' ' 20' ' ' SER . 1.0 OUTLIER -50.24 -55.92 13.29 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 120.732 0.301 . . . . 0.0 111.284 -179.502 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.894 ' O ' HG23 ' A' ' 115' ' ' VAL . 3.2 tp-100 -50.37 -65.36 0.57 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.243 -179.853 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.88 ' O ' HD22 ' A' ' 116' ' ' LEU . 11.5 m-20 -47.64 -55.46 9.33 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.88 0.371 . . . . 0.0 110.986 -179.58 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.53 ' HB1' ' CE1' ' A' ' 55' ' ' PHE . . . -42.39 -59.04 1.98 Allowed 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.104 179.805 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.675 ' HE2' ' HB ' ' A' ' 16' ' ' VAL . 0.0 OUTLIER -63.26 -34.62 78.07 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.084 179.894 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 1.082 HG22 ' CG ' ' A' ' 75' ' ' LYS . 93.3 t -52.48 -65.37 0.3 Allowed 'Isoleucine or valine' 0 C--O 1.248 1.009 0 CA-C-O 122.127 0.965 . . . . 0.0 111.342 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 1.0 ' HB3' HG21 ' A' ' 63' ' ' VAL . 0.0 OUTLIER -61.35 -42.94 99.51 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 114.485 -1.234 . . . . 0.0 110.237 -178.876 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.8 ' CD2' HD23 ' A' ' 8' ' ' LEU . 0.2 OUTLIER -68.09 -16.1 63.87 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.245 179.952 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.593 ' O ' ' HG2' ' A' ' 122' ' ' ARG . 2.7 tm-20 -72.15 -56.58 5.33 Favored 'General case' 0 N--CA 1.438 -1.06 0 N-CA-C 105.453 -2.055 . . . . 0.0 105.453 176.53 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.663 ' HB2' ' OD2' ' A' ' 72' ' ' ASP . . . -64.24 -33.98 77.05 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 114.166 -1.379 . . . . 0.0 110.866 177.725 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.966 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -64.16 -57.88 8.25 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.035 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.687 HD12 ' H ' ' A' ' 127' ' ' ALA . 0.1 OUTLIER -56.87 -45.81 82.24 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.997 -179.324 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.629 ' N ' ' HG ' ' A' ' 121' ' ' LEU . 0.0 OUTLIER -63.1 -65.7 0.65 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 119.549 -0.861 . . . . 0.0 111.97 -179.823 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -53.65 -29.79 40.08 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.177 -0.92 . . . . 0.0 113.041 -178.302 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 124' ' ' GLU . . . . . 0.41 ' CG ' ' O ' ' A' ' 120' ' ' ALA . 4.6 mm-40 -95.11 -66.24 0.93 Allowed 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -178.685 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.458 ' CB ' ' N ' ' A' ' 129' ' ' GLY . 0.1 OUTLIER -96.03 -65.49 0.97 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -178.529 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 126' ' ' GLY . . . . . 0.608 ' O ' ' HB3' ' A' ' 127' ' ' ALA . . . 98.57 74.39 1.15 Allowed Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 -178.34 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.687 ' H ' HD12 ' A' ' 121' ' ' LEU . . . 92.87 -27.83 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 123.04 0.536 . . . . 0.0 109.867 -178.008 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 128' ' ' ARG . . . . . 0.478 ' HB2' ' O ' ' A' ' 127' ' ' ALA . 0.0 OUTLIER 153.49 120.75 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.39 178.696 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 129' ' ' GLY . . . . . 0.458 ' N ' ' CB ' ' A' ' 125' ' ' SER . . . -145.03 -50.47 0.03 OUTLIER Glycine 0 C--N 1.319 -0.414 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.518 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 41.0 p . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.232 -0.889 . . . . 0.0 110.913 -179.996 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.083 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 22.5 p30 -140.42 153.92 46.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.754 0.311 . . . . 0.0 110.896 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.47 76.16 1.14 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.901 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 204' ' ' PTR . . . . . 0.426 ' HE1' ' HE3' ' A' ' 26' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -118.93 -43.83 2.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.703 179.861 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 206' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -104.06 119.2 55.05 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.616 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 207' ' ' PRO . . . . . 0.511 ' HA ' ' HB2' ' A' ' 30' ' ' ASN . 19.1 Cg_endo -59.02 -75.21 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.402 2.068 . . . . 0.0 112.761 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 208' ' ' PHE . . . . . 0.473 ' CZ ' ' HB3' ' A' ' 10' ' ' ARG . 1.4 p90 -140.72 -41.48 0.4 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.871 0.367 . . . . 0.0 111.016 -179.654 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 209' ' ' NH2 . . . . . 0.422 ' N ' ' CD1' ' B' ' 208' ' ' PHE . . . . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 116.482 -0.326 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.3 mmm . . . . . 0 N--CA 1.485 1.304 0 CA-C-O 120.646 0.26 . . . . 0.0 111.144 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.566 ' ND2' HD22 ' A' ' 8' ' ' LEU . 8.6 p-10 36.97 -147.71 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.68 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.789 HD21 ' CA ' ' A' ' 30' ' ' ASN . 0.6 OUTLIER -99.9 16.37 24.04 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.457 0.17 . . . . 0.0 111.428 -179.342 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.1 m 72.79 -166.6 0.12 Allowed 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -178.568 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.865 HD21 ' HB3' ' A' ' 62' ' ' HIS . 7.7 mt -95.51 -64.89 1.01 Allowed 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.234 0.54 . . . . 0.0 111.916 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.756 ' HA ' HD13 ' A' ' 121' ' ' LEU . 1.9 p -45.19 -47.07 12.51 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.297 -0.865 . . . . 0.0 112.367 -178.013 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ASP . . . . . 0.43 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 0.6 OUTLIER -73.4 -64.56 0.96 Allowed 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 120.857 0.361 . . . . 0.0 110.078 179.73 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.824 HD23 HD21 ' A' ' 117' ' ' LEU . 14.5 tp -41.39 -47.5 3.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.363 179.134 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.579 ' CG ' HD22 ' A' ' 121' ' ' LEU . 32.6 t-80 -64.97 -43.87 91.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.614 178.538 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.441 ' HB3' ' CZ ' ' B' ' 208' ' ' PHE . 3.4 mmt-85 -53.68 -54.08 42.98 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.995 -1.002 . . . . 0.0 111.586 -179.634 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.723 ' HG3' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -67.72 -51.27 51.28 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.518 -179.505 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.855 HG23 HD23 ' A' ' 110' ' ' LEU . 11.0 p -57.69 -44.36 85.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 CA-C-O 121.137 0.494 . . . . 0.0 110.644 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.791 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 95.0 p -62.84 -51.63 66.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.727 179.417 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.495 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 1.0 OUTLIER -66.64 -17.6 64.93 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.934 179.977 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.488 HD13 HG22 ' A' ' 31' ' ' VAL . 4.9 mt -79.6 -59.62 2.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.709 -179.552 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.499 ' HB ' ' NZ ' ' A' ' 114' ' ' LYS . 1.0 OUTLIER -71.42 -27.66 29.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 C-N-CA 120.904 -0.319 . . . . 0.0 110.92 -179.798 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.406 ' HB2' ' O ' ' A' ' 13' ' ' SER . 5.6 mm-40 -74.98 -13.97 60.57 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.804 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.495 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 10.5 pt20 -170.48 62.53 0.04 OUTLIER 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.78 0.324 . . . . 0.0 111.167 179.498 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 173.12 -60.11 0.01 OUTLIER 'General case' 0 C--O 1.232 0.16 0 CA-C-O 120.835 0.35 . . . . 0.0 111.37 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.716 ' OG ' ' HB2' ' A' ' 33' ' ' ALA . 15.0 m -85.2 -36.85 20.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.603 -179.237 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 55.95 71.83 0.67 Allowed Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.335 -179.594 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 53.77 97.05 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.967 0.413 . . . . 0.0 110.881 -179.751 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.689 ' O ' HG23 ' A' ' 109' ' ' THR . 0.2 OUTLIER -161.82 -161.25 0.76 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.021 -179.731 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.67 HG22 ' OE2' ' A' ' 52' ' ' GLU . 35.4 m -104.1 136.73 43.19 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.336 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.465 ' CA ' ' HG ' ' A' ' 110' ' ' LEU . . . -104.8 140.83 15.15 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.407 -0.901 . . . . 0.0 113.554 -178.706 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.971 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -104.95 133.65 49.38 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.194 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.641 HD22 HG12 ' A' ' 54' ' ' VAL . 1.2 tt -104.72 148.87 26.11 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.327 0.584 . . . . 0.0 111.927 -179.252 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.548 HH21 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER 169.01 58.37 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 114.993 -1.003 . . . . 0.0 108.969 -179.821 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.633 ' CA ' HD11 ' A' ' 3' ' ' LEU . . . 72.3 6.07 64.38 Favored Glycine 0 CA--C 1.52 0.358 0 N-CA-C 110.424 -1.071 . . . . 0.0 110.424 -177.173 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.789 ' CA ' HD21 ' A' ' 3' ' ' LEU . 0.2 OUTLIER -166.36 165.15 17.37 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 -179.74 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.723 HG12 ' HG3' ' A' ' 11' ' ' GLN . 0.8 OUTLIER -119.54 122.85 69.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.399 0.618 . . . . 0.0 111.234 179.021 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.971 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -111.91 166.04 11.56 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.313 179.528 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.719 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -103.73 142.68 33.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.318 0.58 . . . . 0.0 112.176 -178.843 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.472 HD22 ' HB ' ' A' ' 24' ' ' THR . 6.7 t30 -126.96 120.2 28.52 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.1 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.05 21.61 3.49 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.99 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -106.08 -23.98 12.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.192 -179.634 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 12.3 t -135.7 -176.54 4.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.095 0.474 . . . . 0.0 111.615 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.502 ' CB ' HE22 ' A' ' 40' ' ' GLN . 41.5 p -120.66 126.53 50.46 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.24 -179.796 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.714 ' O ' ' HB2' ' A' ' 42' ' ' LEU . 3.2 p90 -81.87 -43.28 18.41 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.132 -179.559 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.502 HE22 ' CB ' ' A' ' 38' ' ' THR . 0.0 OUTLIER 21.09 69.85 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.17 0.988 . . . . 0.0 113.164 -179.669 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.583 ' O ' ' HB2' ' A' ' 105' ' ' SER . . . 36.72 46.02 1.09 Allowed Glycine 0 C--O 1.226 -0.391 0 C-N-CA 120.907 -0.664 . . . . 0.0 112.313 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.72 ' HB3' ' OE1' ' A' ' 107' ' ' GLN . 1.3 tp -85.06 -156.93 0.27 Allowed 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.745 HG23 ' H ' ' A' ' 106' ' ' ASP . 0.2 OUTLIER -155.93 31.67 0.35 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.238 0.542 . . . . 0.0 111.197 179.81 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.904 HG23 ' O ' ' A' ' 48' ' ' ALA . 4.7 mp 54.23 5.17 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.656 179.296 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.431 ' H ' ' C ' ' A' ' 43' ' ' THR . . . -87.8 -22.85 24.28 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.931 0.396 . . . . 0.0 110.672 179.556 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -108.34 -28.06 9.62 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.0 179.846 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 160.12 73.3 0.02 OUTLIER Glycine 0 C--N 1.333 0.398 0 C-N-CA 120.295 -0.955 . . . . 0.0 113.512 179.732 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.904 ' O ' HG23 ' A' ' 44' ' ' ILE . . . -152.53 174.33 14.05 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.836 0.35 . . . . 0.0 111.245 179.136 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -105.52 147.45 28.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.611 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.723 ' O ' HG23 ' A' ' 54' ' ' VAL . 33.1 tt0 -50.34 -39.99 47.81 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.265 0.555 . . . . 0.0 110.861 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.593 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 2.8 p -48.32 -55.17 11.34 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.189 179.815 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.67 ' OE2' HG22 ' A' ' 24' ' ' THR . 3.1 mp0 -40.52 -62.46 0.77 Allowed 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 120.794 0.33 . . . . 0.0 111.04 179.725 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.66 ' HG2' ' N ' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -54.02 -40.11 66.75 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.713 179.513 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.723 HG23 ' O ' ' A' ' 50' ' ' GLU . 40.7 t -63.33 -43.37 98.57 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.197 0 CA-C-O 121.192 0.52 . . . . 0.0 110.017 179.76 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.722 ' O ' HG12 ' A' ' 59' ' ' VAL . 0.1 OUTLIER -63.82 -32.91 74.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.334 179.386 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.438 ' HB2' ' HB2' ' A' ' 108' ' ' MET . . . -68.56 -59.18 3.33 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.035 179.808 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -56.48 -37.46 70.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.813 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.412 HG21 HD22 ' A' ' 27' ' ' LEU . 7.5 p -64.71 -60.58 2.94 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.74 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.953 HG23 HD12 ' A' ' 117' ' ' LEU . 10.1 p -62.29 -45.01 99.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.78 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.796 HD13 HD23 ' A' ' 103' ' ' LEU . 6.3 tp -56.06 -39.23 71.75 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 120.972 0.415 . . . . 0.0 110.282 179.306 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 44.1 m -65.24 -59.08 4.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.131 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' HIS . . . . . 0.865 ' HB3' HD21 ' A' ' 5' ' ' LEU . 9.8 m170 -54.52 -42.81 71.27 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 121.186 0.517 . . . . 0.0 110.111 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 1.085 HG13 HG11 ' A' ' 66' ' ' VAL . 2.7 t -88.52 54.14 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.443 179.368 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.453 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . -84.16 36.94 0.59 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.292 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.859 ' O ' HG22 ' A' ' 99' ' ' VAL . 0.5 OUTLIER 156.8 -62.99 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 122.744 0.417 . . . . 0.0 110.825 -179.757 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 1.085 HG11 HG13 ' A' ' 63' ' ' VAL . 33.3 m 40.73 -147.91 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.983 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.527 ' O ' ' O ' ' A' ' 98' ' ' SER . 4.9 p -149.62 -25.88 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -179.393 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.624 HD12 ' O ' ' A' ' 98' ' ' SER . 0.6 OUTLIER 32.75 88.94 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.616 0.598 . . . . 0.0 112.616 178.933 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.644 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 0.9 OUTLIER -75.13 -169.77 1.01 Allowed 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.694 -0.403 . . . . 0.0 110.729 179.508 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -40.28 -41.32 1.31 Allowed 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.2 -0.454 . . . . 0.0 112.162 -179.284 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.405 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 0.8 OUTLIER -60.78 -65.11 0.74 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.086 -179.743 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.96 ' O ' HD22 ' A' ' 76' ' ' LEU . 55.0 m-20 -58.47 -44.8 89.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.249 -179.613 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.592 ' HA ' HD23 ' A' ' 76' ' ' LEU . 0.6 OUTLIER -48.93 -57.98 5.6 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.547 0.689 . . . . 0.0 109.659 178.83 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.67 -27.22 68.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.059 -0.973 . . . . 0.0 108.87 177.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 1.039 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -63.76 -46.57 84.71 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.935 -1.029 . . . . 0.0 109.227 178.436 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 1.059 HD13 HG11 ' A' ' 115' ' ' VAL . 1.4 mm? -61.06 -59.84 4.71 Favored 'General case' 0 C--N 1.343 0.284 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 178.078 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.638 ' O ' HG12 ' A' ' 81' ' ' VAL . 5.9 mt -55.19 -30.87 60.8 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.906 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -64.13 -51.99 61.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.303 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' SER . . . . . 0.46 ' CB ' ' HG2' ' A' ' 111' ' ' GLN . 0.3 OUTLIER -68.31 -26.43 65.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.257 179.851 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.632 HG22 ' HA ' ' A' ' 77' ' ' LEU . 0.6 OUTLIER -86.04 -30.34 22.73 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.734 0.302 . . . . 0.0 111.33 -179.519 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.638 HG12 ' O ' ' A' ' 77' ' ' LEU . 9.6 p -89.34 -20.05 7.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.529 -179.72 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 4.3 ptmt -45.24 -30.16 1.15 Allowed 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.837 0.351 . . . . 0.0 111.304 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -174.53 55.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.913 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 61.13 -168.7 0.17 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.697 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.9 HD13 ' N ' ' A' ' 86' ' ' ASN . 2.2 tm? 76.1 141.96 0.07 Allowed 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.197 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.9 ' N ' HD13 ' A' ' 85' ' ' LEU . 3.4 p30 -152.91 88.85 1.34 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.647 179.889 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ASN . . . . . 0.405 ' CB ' ' HA3' ' A' ' 41' ' ' GLY . 12.4 p-10 -93.11 -13.7 28.18 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.634 -179.638 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.588 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 0.1 OUTLIER -106.38 153.87 21.61 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.24 0.543 . . . . 0.0 111.118 -179.877 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.744 ' CG ' HG13 ' A' ' 101' ' ' VAL . 0.4 OUTLIER -120.12 150.06 41.22 Favored 'General case' 0 N--CA 1.435 -1.177 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -179.208 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.758 HD11 ' CB ' ' A' ' 76' ' ' LEU . 49.3 mt -142.21 161.64 37.49 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -177.547 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.4 133.65 40.78 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 114.334 -1.303 . . . . 0.0 107.9 177.716 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.873 ' O ' HG13 ' A' ' 93' ' ' VAL . 90.4 p -104.33 150.41 24.5 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -177.666 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.873 HG13 ' O ' ' A' ' 92' ' ' SER . 1.1 m -177.22 -120.03 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-N 113.596 -1.638 . . . . 0.0 108.355 179.529 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.412 ' C ' ' O ' ' A' ' 93' ' ' VAL . . . 28.47 39.4 0.01 OUTLIER Glycine 0 C--N 1.339 0.748 0 N-CA-C 114.928 0.731 . . . . 0.0 114.928 178.262 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ASN . . . . . 0.422 ' N ' ' O ' ' A' ' 93' ' ' VAL . 2.5 p-10 38.61 34.11 0.08 Allowed 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 117.528 0.664 . . . . 0.0 111.018 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 135.74 10.35 1.41 Allowed Glycine 0 N--CA 1.449 -0.494 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.973 -179.044 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.644 ' HA ' ' HA ' ' A' ' 69' ' ' THR . 0.2 OUTLIER -121.7 166.06 14.85 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 120.651 0.263 . . . . 0.0 110.469 179.99 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.624 ' O ' HD12 ' A' ' 68' ' ' LEU . 4.1 t -139.97 161.19 38.19 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.294 0.569 . . . . 0.0 110.635 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.859 HG22 ' O ' ' A' ' 65' ' ' ASN . 1.2 t -103.35 150.0 7.08 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.975 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 178.878 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.626 HD13 ' CD1' ' A' ' 116' ' ' LEU . 0.3 OUTLIER -103.68 114.13 28.16 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -178.105 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.744 HG13 ' CG ' ' A' ' 89' ' ' ASP . 1.3 p -126.06 103.8 12.12 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.11 0 N-CA-C 103.198 -2.89 . . . . 0.0 103.198 174.108 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.66 ' O ' HD23 ' A' ' 103' ' ' LEU . 8.2 p -143.82 165.24 28.23 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 113.879 1.066 . . . . 0.0 113.879 -174.016 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.947 HD13 ' O ' ' A' ' 105' ' ' SER . 0.1 OUTLIER 155.13 -88.13 0.0 OUTLIER 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 113.817 -1.538 . . . . 0.0 112.019 176.589 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.472 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 60.23 21.13 10.52 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 -178.54 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.947 ' O ' HD13 ' A' ' 103' ' ' LEU . 4.6 m 144.43 176.32 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 114.471 -1.24 . . . . 0.0 108.104 -179.082 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.745 ' H ' HG23 ' A' ' 43' ' ' THR . 0.3 OUTLIER -104.04 101.17 10.94 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.315 -0.554 . . . . 0.0 111.037 -179.483 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.72 ' OE1' ' HB3' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -168.51 151.35 5.32 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.429 178.665 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.446 ' HB3' ' HB3' ' A' ' 55' ' ' PHE . 0.9 OUTLIER -153.64 147.91 25.87 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.144 0.497 . . . . 0.0 111.613 178.369 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.689 HG23 ' O ' ' A' ' 23' ' ' CYS . 0.3 OUTLIER -115.28 160.94 19.16 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.229 -179.916 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.855 HD23 HG23 ' A' ' 12' ' ' VAL . 0.4 OUTLIER -48.91 -60.46 2.74 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.683 0.278 . . . . 0.0 110.444 179.818 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.882 ' O ' HG23 ' A' ' 115' ' ' VAL . 3.7 tp-100 -45.47 -65.18 0.57 Allowed 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.537 179.586 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.956 ' O ' HD22 ' A' ' 116' ' ' LEU . 29.6 m-20 -45.95 -53.13 10.48 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.113 0.482 . . . . 0.0 110.482 179.331 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.526 ' HB1' ' CE1' ' A' ' 55' ' ' PHE . . . -44.81 -63.16 0.97 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.202 179.732 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.791 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -64.41 -27.07 68.75 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.657 -179.756 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 1.059 HG11 HD13 ' A' ' 76' ' ' LEU . 92.6 t -58.72 -64.96 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.868 0 CA-C-O 122.148 0.975 . . . . 0.0 110.627 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.956 HD22 ' O ' ' A' ' 112' ' ' ASP . 0.1 OUTLIER -62.95 -40.08 96.57 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 114.512 -1.222 . . . . 0.0 110.04 -179.415 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.953 HD12 HG23 ' A' ' 59' ' ' VAL . 0.2 OUTLIER -67.78 -22.26 65.2 Favored 'General case' 0 CA--C 1.511 -0.536 0 O-C-N 123.235 0.335 . . . . 0.0 110.925 179.641 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.575 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 5.5 tp10 -69.03 -51.65 36.91 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 106.345 -1.724 . . . . 0.0 106.345 177.291 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.661 ' HB2' ' OD2' ' A' ' 72' ' ' ASP . . . -73.72 -19.15 60.89 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 114.464 -1.244 . . . . 0.0 110.877 177.858 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.915 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -77.59 -59.93 2.58 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.684 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.756 HD13 ' HA ' ' A' ' 6' ' ' SER . 0.1 OUTLIER -59.82 -30.14 68.72 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.739 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.575 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.9 OUTLIER -68.45 -54.82 14.52 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.33 -179.7 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.86 -30.07 26.74 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -177.142 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 124' ' ' GLU . . . . . 0.529 ' OE1' ' HB1' ' A' ' 120' ' ' ALA . 2.7 mt-10 -78.05 -66.57 0.83 Allowed 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.222 -0.591 . . . . 0.0 112.366 -178.35 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.462 ' CB ' ' HB2' ' A' ' 128' ' ' ARG . 0.3 OUTLIER -96.49 -44.66 7.08 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.094 0.474 . . . . 0.0 111.747 -179.086 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 94.13 76.04 1.31 Allowed Glycine 0 CA--C 1.5 -0.845 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.342 -178.747 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.497 ' HA ' HD12 ' A' ' 121' ' ' LEU . . . 48.42 28.87 1.81 Allowed 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -177.675 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 128' ' ' ARG . . . . . 0.462 ' HB2' ' CB ' ' A' ' 125' ' ' SER . 0.4 OUTLIER -101.65 -71.67 0.71 Allowed 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.026 -0.988 . . . . 0.0 112.013 -177.936 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 129' ' ' GLY . . . . . 0.482 ' CA ' ' HB3' ' A' ' 6' ' ' SER . . . 88.7 19.78 50.25 Favored Glycine 0 C--N 1.334 0.42 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.576 -179.541 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 45.5 m . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.884 -179.933 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.082 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 44.1 m-20 60.39 83.31 0.14 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.833 0.349 . . . . 0.0 110.86 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -137.08 174.84 10.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.926 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 204' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.1 -71.03 0.19 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.881 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 206' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -97.58 154.09 38.07 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.911 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_endo -55.61 -77.25 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.722 2.282 . . . . 0.0 112.423 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 208' ' ' PHE . . . . . 0.651 ' CD1' ' NE2' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -159.26 -17.07 0.06 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.769 0.318 . . . . 0.0 111.352 -179.987 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 209' ' ' NH2 . . . . . 0.454 ' N ' ' CD1' ' B' ' 208' ' ' PHE . . . . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.686 -0.234 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 mtm . . . . . 0 N--CA 1.487 1.385 0 CA-C-O 120.86 0.362 . . . . 0.0 111.169 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 12.8 p-10 -127.19 -154.04 0.61 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.716 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.79 HD21 ' HA ' ' A' ' 30' ' ' ASN . 5.5 mp -71.39 -79.69 0.07 Allowed 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.941 0.4 . . . . 0.0 110.8 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.49 ' O ' ' HB2' ' A' ' 8' ' ' LEU . 0.4 OUTLIER -165.54 -166.43 0.97 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.963 179.934 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.731 HD21 ' HB1' ' A' ' 120' ' ' ALA . 0.4 OUTLIER -95.68 -66.36 0.91 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 122.013 0.911 . . . . 0.0 111.6 -179.949 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p -63.97 -38.36 90.8 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.46 -1.246 . . . . 0.0 112.337 -178.16 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.97 -34.12 64.13 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.517 -0.473 . . . . 0.0 109.919 179.324 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.929 HD23 HD11 ' A' ' 117' ' ' LEU . 13.5 tp -66.98 -49.7 64.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.947 179.24 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.678 ' CG ' HD22 ' A' ' 121' ' ' LEU . 56.5 t-80 -61.09 -46.11 91.98 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.969 178.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.41 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 5.0 mtp180 -56.73 -42.36 79.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.857 179.367 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.793 ' HG3' HG22 ' A' ' 31' ' ' VAL . 5.4 tp-100 -67.13 -65.65 0.66 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.834 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.038 HG23 HD23 ' A' ' 110' ' ' LEU . 14.4 p -52.29 -46.93 46.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 121.071 0.462 . . . . 0.0 111.204 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.714 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 41.0 m -64.28 -37.88 89.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.802 -179.467 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.41 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 3.7 mmt180 -69.0 -30.7 69.15 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.513 -179.573 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.955 HD12 ' HA ' ' A' ' 12' ' ' VAL . 2.4 mt -72.67 -62.11 1.56 Allowed 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.671 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.782 ' CG2' ' HB3' ' A' ' 110' ' ' LEU . 56.3 t -57.7 -53.61 42.44 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.471 0 CA-C-O 121.217 0.532 . . . . 0.0 111.425 -179.489 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -62.55 -7.35 4.52 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.539 -178.658 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -150.12 37.15 0.69 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 120.953 -0.299 . . . . 0.0 111.699 179.266 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.491 ' N ' ' O ' ' A' ' 15' ' ' LEU . 1.4 mt-10 168.33 -66.79 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.903 ' CB ' HD13 ' A' ' 110' ' ' LEU . 0.8 OUTLIER -76.29 80.09 3.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.669 -177.669 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -66.64 73.5 0.16 Allowed Glycine 0 C--N 1.311 -0.843 0 CA-C-N 114.937 -1.029 . . . . 0.0 112.759 179.438 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.8 t70 75.94 22.09 1.49 Allowed 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 179.433 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.538 ' HB2' HD12 ' A' ' 110' ' ' LEU . 96.4 m -70.21 -165.79 0.11 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 179.329 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.552 ' HA ' ' HA ' ' A' ' 109' ' ' THR . 0.2 OUTLIER -104.39 163.42 12.45 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.818 0.342 . . . . 0.0 110.506 179.692 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -104.28 131.2 10.54 Favored Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.131 -1.033 . . . . 0.0 113.344 -179.229 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.784 ' HB3' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -104.42 110.75 23.13 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.927 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.0 tt -104.0 139.47 39.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.474 0.654 . . . . 0.0 112.231 -178.014 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 165.08 51.71 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.109 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.51 ' C ' HD11 ' A' ' 3' ' ' LEU . . . 94.02 -5.53 72.22 Favored Glycine 0 CA--C 1.519 0.287 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.402 -178.259 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.79 ' HA ' HD21 ' A' ' 3' ' ' LEU . 0.1 OUTLIER -165.55 151.98 9.86 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.818 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.793 HG22 ' HG3' ' A' ' 11' ' ' GLN . 1.5 m -104.81 123.91 59.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.469 179.19 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.784 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . . . -114.02 166.34 11.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.211 -178.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.834 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -103.29 105.97 16.38 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.22 0.533 . . . . 0.0 111.25 -179.628 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.448 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 0.8 OUTLIER -85.11 124.57 31.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.559 -179.884 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -125.08 28.19 6.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.923 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -110.39 -39.35 4.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.795 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.475 HG21 ' O ' ' A' ' 47' ' ' GLY . 0.8 OUTLIER -104.96 -53.46 2.66 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.115 -179.963 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.6 p 60.58 96.13 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.351 0.596 . . . . 0.0 109.627 -179.269 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.742 ' CG ' ' NE2' ' A' ' 107' ' ' GLN . 18.7 m-85 -133.13 -177.52 4.55 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 113.745 1.017 . . . . 0.0 113.745 -177.793 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.426 ' N ' ' CD ' ' A' ' 40' ' ' GLN . 0.0 OUTLIER -149.75 -56.31 0.18 Allowed 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 114.838 -1.074 . . . . 0.0 110.703 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.523 ' HA3' ' CB ' ' A' ' 87' ' ' ASN . . . -150.66 101.27 0.21 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.495 -0.86 . . . . 0.0 112.911 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.707 HD12 ' H ' ' A' ' 43' ' ' THR . 0.1 OUTLIER -156.74 172.84 17.9 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.787 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.707 ' H ' HD12 ' A' ' 42' ' ' LEU . 0.2 OUTLIER -108.67 40.9 1.69 Allowed 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -176.946 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.66 ' HA ' ' HB3' ' A' ' 48' ' ' ALA . 3.3 mt 55.1 0.89 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 179.299 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.47 ' H ' ' C ' ' A' ' 43' ' ' THR . . . -68.83 -35.92 77.56 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.204 0.526 . . . . 0.0 109.974 179.541 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.541 ' H ' HD11 ' A' ' 42' ' ' LEU . 6.6 t -74.96 -59.77 2.59 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.393 179.257 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLY . . . . . 0.475 ' O ' HG21 ' A' ' 37' ' ' THR . . . 173.5 31.75 0.03 OUTLIER Glycine 0 CA--C 1.52 0.36 0 C-N-CA 120.638 -0.792 . . . . 0.0 113.246 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.703 ' HB2' ' NE2' ' A' ' 107' ' ' GLN . . . -67.67 -167.42 0.07 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.268 0.556 . . . . 0.0 111.535 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 17.0 mmm180 -145.67 143.4 29.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.937 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.666 ' O ' HG23 ' A' ' 54' ' ' VAL . 4.6 mp0 -45.06 -31.49 1.37 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.884 0.373 . . . . 0.0 111.381 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.434 ' CB ' ' HG2' ' A' ' 26' ' ' LYS . 0.4 OUTLIER -60.49 -61.49 2.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.253 -179.936 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.419 ' HG2' ' CG2' ' A' ' 24' ' ' THR . 54.1 mt-10 -48.88 -65.35 0.58 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.122 0.487 . . . . 0.0 110.957 -179.894 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.627 ' HD2' HD11 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -45.01 -57.59 3.74 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.345 179.72 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.685 ' O ' HG23 ' A' ' 58' ' ' THR . 78.2 t -52.58 -35.25 20.45 Favored 'Isoleucine or valine' 0 C--O 1.232 0.133 0 CA-C-O 120.945 0.402 . . . . 0.0 110.534 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.586 ' HB3' ' HB3' ' A' ' 108' ' ' MET . 0.2 OUTLIER -65.35 -47.31 76.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.306 179.462 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.813 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -55.6 -49.2 73.43 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-O 120.982 0.42 . . . . 0.0 110.59 179.339 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -59.98 -45.57 92.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.816 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.685 HG23 ' O ' ' A' ' 54' ' ' VAL . 82.0 p -66.97 -52.83 37.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.804 -179.559 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.654 HG23 HD12 ' A' ' 117' ' ' LEU . 13.4 p -56.2 -46.49 81.29 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-O 120.828 0.347 . . . . 0.0 111.267 -179.189 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.463 ' N ' HG13 ' A' ' 59' ' ' VAL . 1.1 tp -67.62 -36.85 81.59 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.533 179.743 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 33.3 m -61.44 -65.23 0.72 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.123 -0.49 . . . . 0.0 112.036 -179.447 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' HIS . . . . . 0.856 ' NE2' HG23 ' A' ' 63' ' ' VAL . 9.7 p-80 -50.09 -44.99 52.2 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.019 0.438 . . . . 0.0 110.365 -179.726 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 1.009 HG21 ' HB3' ' A' ' 116' ' ' LEU . 16.8 t -63.79 -66.63 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.776 178.552 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.503 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 37.82 36.17 0.09 Allowed 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.541 178.751 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.549 ' H ' HG12 ' A' ' 63' ' ' VAL . 11.2 t-20 154.97 -80.44 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 122.479 0.311 . . . . 0.0 110.979 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.98 ' CG1' HG13 ' A' ' 63' ' ' VAL . 17.0 m 45.38 -154.41 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.546 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.845 HG13 ' O ' ' A' ' 67' ' ' VAL . 3.2 p -163.98 69.34 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.334 -0.084 0 CA-C-O 121.869 0.842 . . . . 0.0 111.4 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.842 HD23 ' HB3' ' A' ' 72' ' ' ASP . 1.0 OUTLIER -53.39 107.0 0.2 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.12 -0.945 . . . . 0.0 112.32 -179.904 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.732 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 74.1 p -71.14 -176.83 1.52 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 0.0 109.778 178.767 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.416 ' HA ' ' OG1' ' A' ' 73' ' ' THR . 0.0 OUTLIER -46.08 -34.59 4.26 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.159 0.504 . . . . 0.0 111.115 -179.786 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.406 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 0.8 OUTLIER -68.83 -65.05 0.75 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.793 179.987 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.842 ' HB3' HD23 ' A' ' 68' ' ' LEU . 43.9 m-20 -55.21 -29.45 57.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.971 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.439 ' CG2' ' HB3' ' A' ' 98' ' ' SER . 1.5 p -65.65 -60.95 2.38 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 178.443 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.73 -25.97 55.92 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 177.57 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 1.101 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.1 OUTLIER -57.71 -65.07 0.7 Allowed 'General case' 0 C--O 1.234 0.262 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.564 178.922 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.848 HD21 HD11 ' A' ' 116' ' ' LEU . 0.4 OUTLIER -59.01 -38.96 80.44 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 121.2 0.524 . . . . 0.0 109.87 179.085 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.522 ' O ' HG23 ' A' ' 81' ' ' VAL . 0.1 OUTLIER -52.25 -44.37 64.85 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.617 179.766 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.422 ' O ' ' HB2' ' A' ' 82' ' ' LYS . 33.9 mt-30 -72.31 -58.24 3.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.887 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' SER . . . . . 0.412 ' CB ' ' HG2' ' A' ' 111' ' ' GLN . 0.0 OUTLIER -56.53 -23.93 43.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.491 -179.822 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.644 HG23 ' OD1' ' A' ' 87' ' ' ASN . 51.1 m -95.12 -57.61 2.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.772 0.32 . . . . 0.0 111.63 -179.461 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.522 HG23 ' O ' ' A' ' 77' ' ' LEU . 48.9 t -64.51 -14.22 15.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.972 -179.379 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 78' ' ' GLN . 25.6 tttm -56.33 -40.47 74.48 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.617 0.246 . . . . 0.0 111.149 -179.877 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 68.2 t60 -80.32 -85.9 0.09 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.175 -179.684 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 44.5 t30 179.38 -73.69 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.813 0.339 . . . . 0.0 110.992 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.77 -171.33 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.067 -179.778 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -117.11 139.66 50.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.057 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ASN . . . . . 0.644 ' OD1' HG23 ' A' ' 80' ' ' THR . 11.5 p-10 -133.37 -47.71 0.83 Allowed 'General case' 0 C--O 1.244 0.772 0 CA-C-O 121.585 0.707 . . . . 0.0 110.496 179.866 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.69 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 3.1 m-85 -108.83 138.35 45.29 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.53 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.649 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.1 OUTLIER -104.64 150.49 24.65 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.444 -178.437 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.665 HD23 ' HA ' ' A' ' 100' ' ' LEU . 12.5 mt -138.53 144.65 40.03 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -178.013 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -132.88 114.53 14.17 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 178.178 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.512 ' HA ' ' CB ' ' A' ' 98' ' ' SER . 1.6 m -104.24 146.25 29.05 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 113.739 1.015 . . . . 0.0 113.739 -177.043 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.541 ' O ' ' O ' ' A' ' 94' ' ' GLY . 12.7 m -158.34 -130.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 CA-C-N 114.107 -1.406 . . . . 0.0 108.753 179.163 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.686 ' HA3' ' ND2' ' A' ' 97' ' ' ASN . . . 52.02 163.49 0.01 OUTLIER Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 119.957 -1.116 . . . . 0.0 112.587 178.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -54.07 -25.65 22.83 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 177.194 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -173.29 43.76 0.16 Allowed Glycine 0 N--CA 1.441 -1.024 0 CA-C-N 114.102 -1.408 . . . . 0.0 109.948 178.657 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.762 ' HB2' HG22 ' A' ' 67' ' ' VAL . 0.0 OUTLIER -133.61 166.21 23.11 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-O 121.281 0.563 . . . . 0.0 111.422 -179.129 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.52 ' O ' ' N ' ' A' ' 68' ' ' LEU . 39.9 t -146.28 165.12 30.19 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.472 -179.165 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.457 ' H ' ' HG ' ' A' ' 98' ' ' SER . 2.3 t -116.07 152.9 17.73 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.541 179.242 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.665 ' CB ' HD11 ' A' ' 68' ' ' LEU . 0.0 OUTLIER -104.69 126.39 51.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.7 0.762 . . . . 0.0 112.447 -179.586 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.649 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -130.71 110.67 18.9 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 N-CA-C 104.976 -2.231 . . . . 0.0 104.976 175.955 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.768 ' O ' ' HB2' ' A' ' 103' ' ' LEU . 17.8 p -153.14 165.33 35.97 Favored 'General case' 0 C--N 1.309 -1.169 0 C-N-CA 118.401 -1.32 . . . . 0.0 114.544 -174.603 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.768 ' HB2' ' O ' ' A' ' 102' ' ' SER . 0.8 OUTLIER 136.21 74.72 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 113.21 -1.814 . . . . 0.0 112.457 176.05 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.573 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -108.51 29.02 7.78 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 177.464 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.535 ' HB3' ' N ' ' A' ' 42' ' ' LEU . 2.8 m 153.35 163.49 0.01 OUTLIER 'General case' 0 C--O 1.231 0.117 0 CA-C-N 114.188 -1.369 . . . . 0.0 107.509 -178.489 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.457 ' O ' ' HG3' ' A' ' 107' ' ' GLN . 0.8 OUTLIER -104.79 100.98 10.61 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.977 -179.159 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.813 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 13.7 mt-30 -169.17 163.35 10.99 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.708 177.656 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.586 ' HB3' ' HB3' ' A' ' 55' ' ' PHE . 1.0 OUTLIER -165.93 135.23 3.25 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.293 0.568 . . . . 0.0 112.126 178.293 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.552 ' HA ' ' HA ' ' A' ' 24' ' ' THR . 0.4 OUTLIER -103.13 160.93 14.21 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.004 178.608 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 1.038 HD23 HG23 ' A' ' 12' ' ' VAL . 4.0 mt -45.77 -54.71 7.53 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -178.589 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.843 ' O ' HG23 ' A' ' 115' ' ' VAL . 3.1 tp-100 -48.31 -65.45 0.57 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.747 0.308 . . . . 0.0 111.04 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.502 ' O ' ' HB ' ' A' ' 115' ' ' VAL . 1.6 m-20 -47.2 -46.02 23.62 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.247 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.49 ' HB1' ' CE1' ' A' ' 55' ' ' PHE . . . -52.08 -60.54 3.08 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.648 179.897 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.842 ' NZ ' HG22 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -65.34 -22.53 66.83 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.993 179.745 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 1.101 HG22 ' CG ' ' A' ' 75' ' ' LYS . 53.0 t -61.51 -61.95 1.35 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.876 0 CA-C-O 121.894 0.854 . . . . 0.0 109.973 179.556 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 1.009 ' HB3' HG21 ' A' ' 63' ' ' VAL . 9.1 mp -61.83 -39.48 91.97 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.595 179.653 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.929 HD11 HD23 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -68.05 -23.17 64.93 Favored 'General case' 0 CA--C 1.507 -0.685 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.677 179.265 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.559 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 9.3 tp10 -66.62 -54.95 17.83 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 106.271 -1.751 . . . . 0.0 106.271 177.114 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.528 ' HB2' ' HA ' ' A' ' 68' ' ' LEU . . . -67.99 -20.13 64.99 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.497 177.226 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.915 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -77.04 -64.49 1.12 Allowed 'General case' 0 CA--C 1.509 -0.627 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.717 179.802 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.913 HD23 ' O ' ' A' ' 117' ' ' LEU . 0.2 OUTLIER -60.63 -21.76 63.06 Favored 'General case' 0 N--CA 1.444 -0.74 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.63 179.416 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.559 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 14.6 ttm-85 -73.9 -57.35 4.04 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.904 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.773 ' HB2' HG12 ' A' ' 67' ' ' VAL . 0.8 OUTLIER -94.37 -21.18 19.12 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -177.395 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -86.42 -66.58 0.89 Allowed 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -178.091 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -96.22 -60.35 1.64 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -178.665 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 126' ' ' GLY . . . . . 0.484 ' N ' ' O ' ' A' ' 121' ' ' LEU . . . 93.47 73.49 1.22 Allowed Glycine 0 CA--C 1.5 -0.869 0 N-CA-C 110.783 -0.927 . . . . 0.0 110.783 -178.19 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . 51.48 26.6 3.29 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 -177.198 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.87 -70.76 0.7 Allowed 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.55 -178.231 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 106.6 24.93 6.48 Favored Glycine 0 C--N 1.332 0.343 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.47 -179.687 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 16.8 t . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.887 179.981 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.088 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 202' ' ' ASP . . . . . 0.459 ' O ' ' HA3' ' A' ' 29' ' ' GLY . 0.3 OUTLIER 69.22 -79.32 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.732 0.301 . . . . 0.0 111.061 . . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 69.59 -65.87 0.29 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.835 0.35 . . . . 0.0 110.99 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 204' ' ' PTR . . . . . 0.406 ' N ' ' HD1' ' B' ' 204' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 42.53 -91.6 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.749 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 206' ' ' ASP . . . . . 0.409 ' CB ' ' HD2' ' B' ' 207' ' ' PRO . 0.9 OUTLIER -168.98 165.87 6.62 Favored Pre-proline 0 C--N 1.332 -0.165 0 CA-C-O 120.613 0.244 . . . . 0.0 110.808 -179.827 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 207' ' ' PRO . . . . . 0.433 ' O ' ' HB2' ' B' ' 208' ' ' PHE . 12.7 Cg_endo -56.18 139.38 85.67 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.545 2.164 . . . . 0.0 112.336 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 208' ' ' PHE . . . . . 0.6 ' CZ ' ' HA ' ' A' ' 11' ' ' GLN . 46.2 m-85 67.2 106.82 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.681 -179.753 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.37 0 CA-C-N 116.544 -0.298 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.993 0.425 . . . . 0.0 111.177 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.49 ' CB ' HG21 ' A' ' 58' ' ' THR . 3.7 p-10 -130.36 -157.66 0.84 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.712 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.781 HD11 ' C ' ' A' ' 29' ' ' GLY . 5.4 mp -84.95 -80.47 0.21 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.857 0.361 . . . . 0.0 111.054 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.431 ' O ' ' HB2' ' A' ' 8' ' ' LEU . 0.1 OUTLIER 171.3 154.33 0.07 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.884 -179.89 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.896 HD21 ' HB3' ' A' ' 62' ' ' HIS . 30.1 mt -49.17 -65.12 0.62 Allowed 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 121.205 0.526 . . . . 0.0 111.936 -179.392 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.2 t -42.4 -56.76 2.87 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.225 -0.898 . . . . 0.0 112.516 -178.31 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.86 -56.16 5.61 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.663 0.268 . . . . 0.0 111.055 -179.517 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.837 HD23 HD21 ' A' ' 117' ' ' LEU . 15.8 tp -45.52 -55.01 6.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.106 0.479 . . . . 0.0 110.218 179.317 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.631 ' CG ' HD22 ' A' ' 121' ' ' LEU . 51.5 t-80 -59.62 -47.76 84.33 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.532 178.564 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.48 ' HB3' ' CZ ' ' B' ' 208' ' ' PHE . 9.2 mmt-85 -49.99 -45.63 51.84 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.512 179.607 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.696 ' CG ' HG22 ' A' ' 31' ' ' VAL . 4.4 tp60 -64.68 -65.51 0.66 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.517 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.799 HG21 ' HB3' ' A' ' 113' ' ' ALA . 12.5 p -57.92 -48.17 84.62 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.768 -179.242 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.766 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 39.6 p -58.24 -53.55 57.03 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.098 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.455 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 8.9 ttm-85 -65.1 -23.81 67.25 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.831 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.446 ' CB ' HD11 ' A' ' 110' ' ' LEU . 7.5 mt -69.94 -61.73 1.66 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.806 0.336 . . . . 0.0 111.46 -179.727 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.734 HG23 HD12 ' A' ' 110' ' ' LEU . 1.2 t -71.41 -27.74 29.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.035 -179.609 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.413 ' CG ' ' O ' ' A' ' 13' ' ' SER . 9.5 mm-40 -72.57 -20.2 61.36 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.727 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.455 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 7.1 pt20 -162.42 57.43 0.23 Allowed 'General case' 0 CA--C 1.527 0.087 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.539 179.516 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 178.64 -60.71 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.159 0 N-CA-C 111.86 0.319 . . . . 0.0 111.86 179.614 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.482 ' OG ' ' HB2' ' A' ' 33' ' ' ALA . 70.2 m -85.89 -78.86 0.26 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.878 0.371 . . . . 0.0 111.514 -179.069 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.591 ' H ' ' HA ' ' A' ' 16' ' ' VAL . . . 123.3 -28.47 5.55 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 121.1 -0.571 . . . . 0.0 112.722 -179.752 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.491 ' HB3' ' O ' ' A' ' 21' ' ' GLY . 0.0 OUTLIER 167.43 6.08 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.801 0.301 . . . . 0.0 111.61 179.958 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.452 ' O ' ' O ' ' A' ' 22' ' ' ASP . 62.9 m -51.76 -164.75 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.083 0.468 . . . . 0.0 111.535 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.639 ' HA ' ' HA ' ' A' ' 109' ' ' THR . 12.5 m -103.61 155.53 18.48 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.673 ' HA2' HD23 ' A' ' 110' ' ' LEU . . . -106.02 129.05 9.6 Favored Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.249 -0.976 . . . . 0.0 113.878 -178.183 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.96 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -109.87 123.62 49.91 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.504 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.541 HD23 ' N ' ' A' ' 28' ' ' ARG . 9.9 tt -107.61 154.5 21.34 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.156 0.503 . . . . 0.0 111.739 -178.76 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.541 ' N ' HD23 ' A' ' 27' ' ' LEU . 2.7 mtt180 161.5 52.08 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.067 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.781 ' C ' HD11 ' A' ' 3' ' ' LEU . . . 96.32 -9.44 67.23 Favored Glycine 0 N--CA 1.452 -0.286 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -178.024 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.466 ' N ' HD11 ' A' ' 3' ' ' LEU . 0.1 OUTLIER -165.77 165.04 18.75 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 179.665 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.696 HG22 ' CG ' ' A' ' 11' ' ' GLN . 1.5 m -112.69 138.24 42.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 C-N-CA 120.359 -0.536 . . . . 0.0 110.979 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.96 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -130.42 165.85 21.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.544 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.482 ' HB2' ' OG ' ' A' ' 20' ' ' SER . . . -103.49 115.09 29.88 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.137 0.494 . . . . 0.0 111.574 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.55 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 0.8 OUTLIER -90.93 119.56 31.22 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.184 179.786 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.27 -22.42 10.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.019 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.682 ' CG ' HG23 ' A' ' 37' ' ' THR . 2.2 pt-20 -55.37 -48.52 74.16 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.854 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.682 HG23 ' CG ' ' A' ' 36' ' ' GLU . 8.9 p -103.33 -161.24 0.82 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.411 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 58.7 p -132.83 -35.99 1.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -179.467 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.78 ' CD1' HG23 ' A' ' 109' ' ' THR . 0.0 OUTLIER 74.25 172.82 0.28 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.828 0.347 . . . . 0.0 110.236 -179.356 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.726 ' HA ' HD11 ' A' ' 85' ' ' LEU . 0.2 OUTLIER 169.36 37.52 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.122 179.708 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.669 ' C ' ' HB2' ' A' ' 107' ' ' GLN . . . 82.66 -22.05 6.93 Favored Glycine 0 CA--C 1.519 0.313 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.15 -179.141 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.68 HD21 ' CB ' ' A' ' 46' ' ' SER . 12.6 tp -24.17 138.68 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.257 0.623 . . . . 0.0 112.186 179.195 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.509 HG22 ' O ' ' A' ' 43' ' ' THR . 12.8 m -91.58 26.56 2.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.795 -179.42 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.908 HD13 ' HB3' ' A' ' 48' ' ' ALA . 4.4 mm 71.69 3.18 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 179.537 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -74.05 -26.88 60.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.768 0.318 . . . . 0.0 111.113 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.68 ' CB ' HD21 ' A' ' 42' ' ' LEU . 0.5 OUTLIER -95.33 -40.52 9.49 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.074 -179.903 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.79 38.45 0.03 OUTLIER Glycine 0 CA--C 1.519 0.318 0 C-N-CA 120.394 -0.908 . . . . 0.0 113.353 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.908 ' HB3' HD13 ' A' ' 44' ' ' ILE . . . -81.98 159.19 23.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.936 0.368 . . . . 0.0 110.624 179.483 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.45 ' HB3' ' HG2' ' A' ' 52' ' ' GLU . 0.0 OUTLIER -80.2 130.61 35.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.695 179.902 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.715 ' O ' HG22 ' A' ' 54' ' ' VAL . 4.7 mp0 -52.76 -25.66 11.92 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.075 0.464 . . . . 0.0 110.868 179.834 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.568 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 92.8 p -69.55 -48.65 59.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.026 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.552 ' H ' ' HG2' ' A' ' 52' ' ' GLU . 0.0 OUTLIER -55.28 -56.99 13.69 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 179.15 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.684 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -52.06 -58.78 5.53 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.667 179.654 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.715 HG22 ' O ' ' A' ' 50' ' ' GLU . 16.0 m -52.73 -45.86 49.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 CA-C-O 121.17 0.509 . . . . 0.0 110.401 179.726 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.635 ' CZ ' ' HB1' ' A' ' 113' ' ' ALA . 0.9 OUTLIER -51.42 -46.86 63.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.363 179.237 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.735 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -59.05 -46.65 87.71 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.13 179.168 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -57.93 -40.58 80.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.417 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.49 HG21 ' CB ' ' A' ' 2' ' ' ASN . 89.2 m -68.4 -58.57 4.15 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.212 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 1.025 HG23 HD12 ' A' ' 117' ' ' LEU . 7.2 p -55.92 -42.45 71.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.021 -179.756 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.854 HD22 ' HG ' ' A' ' 103' ' ' LEU . 4.9 tp -64.41 -45.2 88.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.553 179.725 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 72.3 m -57.08 -61.2 2.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.872 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' HIS . . . . . 0.896 ' HB3' HD21 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -49.85 -40.03 40.96 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.009 0.433 . . . . 0.0 110.211 179.572 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.951 HG21 ' HB3' ' A' ' 116' ' ' LEU . 56.1 t -71.47 -80.39 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.648 178.742 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.419 ' O ' ' HB2' ' A' ' 65' ' ' ASN . . . 67.12 -6.11 0.62 Allowed 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 178.298 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.443 ' C ' HG22 ' A' ' 66' ' ' VAL . 2.6 t-20 175.35 -56.2 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 120.806 0.336 . . . . 0.0 110.172 -179.587 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.914 ' CG1' HG13 ' A' ' 63' ' ' VAL . 27.7 m 42.94 -157.68 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.326 178.99 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.828 HG22 ' HB3' ' A' ' 97' ' ' ASN . 0.5 OUTLIER -161.53 89.66 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 CA-C-O 122.088 0.947 . . . . 0.0 108.708 179.531 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.611 ' HB3' ' CB ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -89.99 112.64 24.12 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.812 -1.085 . . . . 0.0 113.007 -177.34 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.511 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 9.2 p -62.63 174.95 0.88 Allowed 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.34 -0.845 . . . . 0.0 109.389 178.248 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -43.8 -30.34 0.65 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.869 0.366 . . . . 0.0 111.445 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.415 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 0.2 OUTLIER -63.04 -65.31 0.71 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.138 -179.909 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.634 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 60.1 m-20 -62.25 -28.95 70.06 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.42 -179.644 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.564 HG22 ' N ' ' A' ' 74' ' ' ALA . 0.8 OUTLIER -61.34 -60.32 3.91 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 179.047 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.595 ' HB1' ' OE1' ' A' ' 78' ' ' GLN . . . -58.87 -28.16 65.87 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.487 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 1.055 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -56.08 -52.49 64.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.601 -1.181 . . . . 0.0 110.154 178.513 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 1.026 HD21 HD11 ' A' ' 116' ' ' LEU . 0.5 OUTLIER -67.01 -54.19 24.07 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.308 179.089 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.653 HD12 ' C ' ' A' ' 77' ' ' LEU . 0.4 OUTLIER -54.83 -24.76 24.47 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.4 -179.901 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.595 ' OE1' ' HB1' ' A' ' 74' ' ' ALA . 2.8 mt-30 -75.65 -63.66 1.25 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.399 179.096 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' SER . . . . . 0.449 ' CB ' ' HG2' ' A' ' 111' ' ' GLN . 0.0 OUTLIER -56.54 -23.09 37.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.498 179.985 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 2.0 m -95.1 -59.45 1.9 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -179.185 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.499 HG23 ' O ' ' A' ' 77' ' ' LEU . 10.3 t -71.44 -7.05 8.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -179.055 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.07 -75.66 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.839 0.352 . . . . 0.0 111.031 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 -103.94 45.93 0.94 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.861 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 57.7 101.03 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.681 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.769 HD23 ' N ' ' A' ' 86' ' ' ASN . 1.6 tt -147.18 151.29 36.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.953 0.406 . . . . 0.0 111.054 -179.872 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.769 ' N ' HD23 ' A' ' 85' ' ' LEU . 2.5 m-20 -146.92 66.69 1.16 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.326 179.762 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ASN . . . . . 0.441 ' HA ' ' HB2' ' A' ' 104' ' ' ARG . 8.5 t-20 -116.6 -33.83 4.74 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.907 -179.475 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.584 ' CE2' HD21 ' A' ' 116' ' ' LEU . 5.2 m-85 -107.37 140.56 40.1 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 120.62 -0.432 . . . . 0.0 111.438 -179.453 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.673 ' CG ' HG13 ' A' ' 101' ' ' VAL . 0.7 OUTLIER -108.92 145.36 35.53 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 -179.593 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.826 HD21 HD13 ' A' ' 76' ' ' LEU . 6.2 mt -132.67 148.39 52.35 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 -177.254 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.451 ' O ' ' O ' ' A' ' 99' ' ' VAL . 5.1 ttp180 -146.36 105.04 3.84 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 105.715 -1.957 . . . . 0.0 105.715 177.363 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.687 ' HB2' ' HB3' ' A' ' 98' ' ' SER . 0.1 OUTLIER -103.37 165.4 11.05 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 116.22 1.933 . . . . 0.0 116.22 -174.041 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.497 HG23 ' HA ' ' A' ' 98' ' ' SER . 0.2 OUTLIER -121.64 43.52 0.63 Allowed 'Isoleucine or valine' 0 C--O 1.242 0.705 0 CA-C-N 111.48 -2.6 . . . . 0.0 106.863 177.67 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -24.63 147.6 0.01 OUTLIER Glycine 0 N--CA 1.435 -1.431 0 CA-C-N 111.584 -2.553 . . . . 0.0 114.824 -177.101 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 74.94 30.99 0.89 Allowed 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 113.561 -1.319 . . . . 0.0 110.762 179.772 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 163.88 -38.85 0.32 Allowed Glycine 0 N--CA 1.444 -0.772 0 C-N-CA 120.117 -1.04 . . . . 0.0 113.604 179.735 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.828 ' HB3' HG22 ' A' ' 67' ' ' VAL . 0.0 OUTLIER -163.95 168.21 19.61 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 117.767 0.784 . . . . 0.0 111.877 -178.208 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.687 ' HB3' ' HB2' ' A' ' 92' ' ' SER . 3.7 m -153.96 141.33 19.66 Favored 'General case' 0 N--CA 1.436 -1.173 0 CA-C-N 114.987 -1.006 . . . . 0.0 109.633 178.772 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.451 ' O ' ' O ' ' A' ' 91' ' ' ARG . 76.4 t -104.99 123.04 58.84 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.143 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.499 -179.516 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.834 HD22 HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -102.91 133.33 48.18 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 122.094 0.949 . . . . 0.0 112.821 -178.028 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.673 HG13 ' CG ' ' A' ' 89' ' ' ASP . 0.2 OUTLIER -127.26 117.22 46.63 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 N-CA-C 104.943 -2.243 . . . . 0.0 104.943 176.829 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.774 ' O ' ' HB2' ' A' ' 103' ' ' LEU . 0.1 OUTLIER -146.36 165.15 30.19 Favored 'General case' 0 C--N 1.307 -1.267 0 C-N-CA 118.589 -1.244 . . . . 0.0 114.205 -174.91 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.854 ' HG ' HD22 ' A' ' 60' ' ' LEU . 0.6 OUTLIER 126.13 72.41 0.0 OUTLIER 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 112.816 -1.993 . . . . 0.0 112.759 176.11 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.441 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -89.3 -5.28 57.69 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.714 -1.13 . . . . 0.0 108.171 176.889 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' A' ' 41' ' ' GLY . 70.1 m -175.79 172.94 2.42 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 113.891 -1.504 . . . . 0.0 107.405 179.299 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.44 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.4 OUTLIER -104.77 102.4 11.97 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 119.581 -0.848 . . . . 0.0 112.326 -178.982 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.735 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 2.2 mt-30 -168.49 165.22 12.57 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.394 178.393 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.658 ' HB2' ' HB2' ' A' ' 56' ' ' ALA . 4.1 tpt -162.04 149.87 14.54 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 179.333 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.78 HG23 ' CD1' ' A' ' 39' ' ' PHE . 0.7 OUTLIER -116.88 165.21 13.58 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.98 178.732 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.734 HD12 HG23 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -51.73 -59.09 4.69 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 120.837 0.351 . . . . 0.0 110.323 179.513 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.938 ' O ' HG23 ' A' ' 115' ' ' VAL . 2.9 tp-100 -48.59 -65.54 0.55 Allowed 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.726 179.743 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.677 ' O ' HD22 ' A' ' 116' ' ' LEU . 4.0 t0 -41.95 -54.1 3.6 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-O 121.317 0.579 . . . . 0.0 111.212 179.697 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.799 ' HB3' HG21 ' A' ' 12' ' ' VAL . . . -47.98 -64.17 0.87 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.219 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.766 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -60.71 -25.31 66.33 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.956 -0.297 . . . . 0.0 111.253 -179.673 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 1.055 HG22 ' CG ' ' A' ' 75' ' ' LYS . 89.7 t -60.57 -65.49 0.47 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.819 0 CA-C-O 121.58 0.705 . . . . 0.0 110.996 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 1.026 HD11 HD21 ' A' ' 76' ' ' LEU . 0.1 OUTLIER -65.26 -37.41 87.13 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.368 -179.402 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 1.025 HD12 HG23 ' A' ' 59' ' ' VAL . 0.1 OUTLIER -67.59 -24.6 65.52 Favored 'General case' 0 CA--C 1.508 -0.669 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.397 179.422 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.488 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 1.1 tp10 -67.65 -50.38 58.21 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 177.097 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.541 ' CB ' HD23 ' A' ' 68' ' ' LEU . . . -69.62 -24.21 63.62 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.507 -1.224 . . . . 0.0 110.376 177.242 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.899 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -75.69 -65.34 0.91 Allowed 'General case' 0 CA--C 1.51 -0.588 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.711 -179.692 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.737 HD12 ' H ' ' A' ' 127' ' ' ALA . 0.1 OUTLIER -56.16 -31.72 63.63 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.115 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.488 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 2.3 ttt85 -66.95 -48.8 67.45 Favored 'General case' 0 CA--C 1.528 0.102 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.597 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.61 ' HG3' HG12 ' A' ' 67' ' ' VAL . 0.0 OUTLIER -89.24 -19.1 25.8 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -177.658 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 124' ' ' GLU . . . . . 0.43 ' HB2' ' CD1' ' A' ' 5' ' ' LEU . 3.5 mm-40 -95.35 -66.51 0.91 Allowed 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -178.541 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.418 ' HB2' ' N ' ' A' ' 129' ' ' GLY . 0.3 OUTLIER -96.23 -65.46 0.97 Allowed 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -178.501 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 126' ' ' GLY . . . . . 0.606 ' O ' ' HB3' ' A' ' 127' ' ' ALA . . . 97.96 70.32 0.99 Allowed Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 -178.133 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.737 ' H ' HD12 ' A' ' 121' ' ' LEU . . . 92.72 -27.47 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.134 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 -177.616 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 128' ' ' ARG . . . . . 0.488 ' HB2' ' O ' ' A' ' 127' ' ' ALA . 1.1 tmt_? 151.41 120.92 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.414 178.614 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 129' ' ' GLY . . . . . 0.418 ' N ' ' HB2' ' A' ' 125' ' ' SER . . . 163.59 48.18 0.02 OUTLIER Glycine 0 C--N 1.32 -0.354 0 CA-C-N 115.3 -0.864 . . . . 0.0 112.645 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.196 -0.907 . . . . 0.0 110.953 -179.964 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.131 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -128.11 147.7 50.55 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.769 0.318 . . . . 0.0 110.914 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -134.36 -174.95 3.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.737 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 204' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 1.3 t0 50.54 -170.02 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.535 179.648 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 206' ' ' ASP . . . . . 0.466 ' CB ' ' HD2' ' B' ' 207' ' ' PRO . 0.2 OUTLIER -80.05 168.81 23.16 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.825 -179.927 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 207' ' ' PRO . . . . . 0.678 ' HD3' HD23 ' A' ' 3' ' ' LEU . 4.7 Cg_endo -46.9 156.81 0.62 Allowed 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.884 2.389 . . . . 0.0 112.522 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 208' ' ' PHE . . . . . 0.48 ' CZ ' ' HB3' ' A' ' 10' ' ' ARG . 29.3 m-85 46.48 -92.88 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.359 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.705 -0.225 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.471 0 CA-C-O 120.783 0.325 . . . . 0.0 110.988 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.458 ' HB3' ' CG2' ' A' ' 58' ' ' THR . 6.6 p30 44.87 -162.86 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.714 179.697 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.926 HD11 HD13 ' A' ' 8' ' ' LEU . 0.2 OUTLIER -88.51 -95.69 0.1 Allowed 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.187 -179.846 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.513 ' O ' ' HB2' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -166.45 146.39 5.98 Favored 'General case' 0 CA--C 1.527 0.082 0 CA-C-O 120.608 0.242 . . . . 0.0 110.349 -179.893 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.728 HD21 ' HB3' ' A' ' 62' ' ' HIS . 19.5 mt -45.87 -65.06 0.6 Allowed 'General case' 0 CA--C 1.51 -0.57 0 CA-C-O 121.018 0.437 . . . . 0.0 111.913 -179.444 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -41.71 -62.05 0.97 Allowed 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.625 -178.327 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ASP . . . . . 0.405 ' OD2' HD12 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -59.79 -47.06 87.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.842 179.822 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.926 HD13 HD11 ' A' ' 3' ' ' LEU . 0.1 OUTLIER -54.81 -65.82 0.51 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.997 -179.642 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.53 ' CG ' ' CD2' ' A' ' 121' ' ' LEU . 40.5 t-80 -51.73 -34.3 38.46 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-O 121.61 0.719 . . . . 0.0 109.72 179.166 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.409 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -60.38 -61.38 2.64 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.665 -1.152 . . . . 0.0 110.523 179.919 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.641 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 7.1 pt20 -64.44 -53.22 51.83 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 120.774 -0.37 . . . . 0.0 111.743 -179.691 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.828 HG23 HD23 ' A' ' 110' ' ' LEU . 13.1 p -51.42 -48.45 34.27 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 121.078 0.466 . . . . 0.0 111.077 -179.67 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.642 ' HA ' ' NZ ' ' A' ' 114' ' ' LYS . 52.4 p -67.58 -31.41 71.44 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.417 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.409 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -72.71 -27.0 61.8 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -178.384 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.641 ' HG ' ' O ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -93.45 -37.99 11.66 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 119.308 -0.957 . . . . 0.0 110.579 179.565 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.886 HG13 ' O ' ' A' ' 20' ' ' SER . 59.5 t -68.67 -50.08 58.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 120.864 0.364 . . . . 0.0 111.239 179.688 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.401 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 2.6 mm100 -70.08 -5.66 28.38 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.392 -179.499 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.401 ' HG2' ' O ' ' A' ' 17' ' ' GLN . 9.0 mt-30 -145.14 32.22 1.11 Allowed 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 111.671 0.248 . . . . 0.0 111.671 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.449 ' N ' ' O ' ' A' ' 15' ' ' LEU . 0.4 OUTLIER 175.46 -71.95 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 179.847 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.952 ' CB ' HD13 ' A' ' 110' ' ' LEU . 0.7 OUTLIER -76.65 75.87 3.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.595 -178.629 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -62.83 74.72 0.03 OUTLIER Glycine 0 C--N 1.318 -0.445 0 CA-C-N 115.219 -0.9 . . . . 0.0 112.882 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.42 ' N ' ' O ' ' A' ' 20' ' ' SER . 16.3 t70 78.53 9.84 1.94 Allowed 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 179.226 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.464 ' O ' ' OG1' ' A' ' 109' ' ' THR . 0.9 OUTLIER -61.78 -167.49 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.191 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.132 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.502 ' CG2' ' HB3' ' A' ' 39' ' ' PHE . 94.6 m -103.56 142.34 34.45 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.629 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.614 ' CA ' ' HG ' ' A' ' 110' ' ' LEU . . . -104.76 149.45 16.89 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.049 -1.072 . . . . 0.0 114.157 -178.101 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.821 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -114.19 133.35 55.66 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 178.552 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.703 HD13 ' OG1' ' A' ' 58' ' ' THR . 7.8 tt -113.17 149.94 32.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.377 0.608 . . . . 0.0 111.966 -179.285 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 165.42 64.23 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.183 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.608 ' C ' HD22 ' A' ' 3' ' ' LEU . . . 78.25 -4.87 57.38 Favored Glycine 0 C--N 1.334 0.417 0 C-N-CA 120.681 -0.771 . . . . 0.0 111.214 -177.89 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.468 ' HA ' ' OE1' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -166.26 166.11 17.01 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 -179.772 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.609 ' CG1' ' HG3' ' A' ' 11' ' ' GLN . 13.5 p -105.71 144.76 14.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.223 0.535 . . . . 0.0 111.765 179.361 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.821 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -129.68 159.76 35.45 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.25 178.385 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.78 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -104.17 120.78 41.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.21 0.529 . . . . 0.0 111.832 -179.246 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.459 ' ND2' ' HB ' ' A' ' 24' ' ' THR . 5.0 t30 -104.41 110.11 22.24 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.133 179.528 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -110.82 -32.29 6.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.518 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -63.67 -49.13 74.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.736 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -95.46 171.85 8.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.613 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.4 p -141.15 110.3 6.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.062 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.75 ' CZ ' HG22 ' A' ' 109' ' ' THR . 0.0 OUTLIER -62.64 -175.85 0.1 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.374 179.829 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.507 ' HB3' ' O ' ' A' ' 39' ' ' PHE . 1.1 pm0 160.94 44.56 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.094 179.783 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.405 ' HA2' ' HB2' ' A' ' 107' ' ' GLN . . . 48.8 88.61 0.01 OUTLIER Glycine 0 CA--C 1.52 0.346 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.006 -178.929 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.459 ' HA ' HD13 ' A' ' 42' ' ' LEU . 0.0 OUTLIER -125.9 -155.12 0.66 Allowed 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 -179.948 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.83 8.46 3.54 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.77 HD13 ' HB3' ' A' ' 48' ' ' ALA . 3.6 mm 75.2 2.32 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 179.685 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -93.85 -24.28 17.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.814 0.34 . . . . 0.0 110.896 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.6 t -93.59 -66.64 0.91 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.003 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -163.13 32.76 0.29 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.556 -0.83 . . . . 0.0 112.904 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.77 ' HB3' HD13 ' A' ' 44' ' ' ILE . . . -99.54 165.7 11.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.647 0.26 . . . . 0.0 110.925 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -109.74 149.39 29.85 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.876 0.37 . . . . 0.0 111.188 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.653 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 1.0 OUTLIER -58.66 -26.83 64.19 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.849 179.719 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.513 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 20.6 p -70.34 -52.31 23.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.817 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.517 ' HB3' ' HG2' ' A' ' 107' ' ' GLN . 1.0 OUTLIER -53.03 -52.08 59.62 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.991 0.424 . . . . 0.0 110.535 179.434 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.653 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -57.9 -54.9 41.69 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.313 -179.967 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.626 HG22 ' O ' ' A' ' 50' ' ' GLU . 19.4 m -55.9 -46.56 80.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 CA-C-O 121.114 0.483 . . . . 0.0 110.165 179.6 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.828 ' O ' HG13 ' A' ' 59' ' ' VAL . 0.5 OUTLIER -50.78 -45.73 59.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.899 178.767 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.734 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -60.36 -41.98 94.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.407 179.143 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.8 mm-40 -66.42 -36.91 84.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.371 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.703 ' OG1' HD13 ' A' ' 27' ' ' LEU . 59.5 p -73.9 -50.72 18.88 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 121.091 0.472 . . . . 0.0 110.045 179.774 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.828 HG13 ' O ' ' A' ' 55' ' ' PHE . 5.1 m -61.49 -46.81 95.82 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.696 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.988 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.728 HD22 ' CD2' ' A' ' 103' ' ' LEU . 14.3 tp -66.38 -47.09 74.46 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.636 -0.256 . . . . 0.0 111.547 -179.858 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.5 m -61.06 -63.88 1.15 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.189 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' HIS . . . . . 0.728 ' HB3' HD21 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -47.39 -30.36 3.24 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 121.101 0.477 . . . . 0.0 110.607 -179.737 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 1.009 HG21 ' HB3' ' A' ' 116' ' ' LEU . 25.1 t -80.32 -69.75 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.753 179.034 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.47 ' O ' ' ND2' ' A' ' 65' ' ' ASN . . . 40.19 26.1 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 178.678 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.498 ' H ' HG12 ' A' ' 63' ' ' VAL . 0.9 OUTLIER 163.78 -74.38 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.775 0.321 . . . . 0.0 110.688 -179.764 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.916 ' CG1' HG13 ' A' ' 63' ' ' VAL . 25.0 m 44.02 -165.9 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.727 179.821 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.602 ' HB ' ' HB3' ' A' ' 97' ' ' ASN . 26.9 m -149.6 60.54 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.435 -1.206 0 CA-C-O 120.906 0.384 . . . . 0.0 111.511 -178.539 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.981 HD22 HD11 ' A' ' 76' ' ' LEU . 1.1 mp -49.21 101.4 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.619 -179.859 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 22.6 p -60.99 -166.78 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.838 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.92 -33.79 67.32 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.11 0.481 . . . . 0.0 110.862 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.443 ' O ' ' HE3' ' A' ' 75' ' ' LYS . 1.6 tm-20 -70.72 -65.45 0.73 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.205 -179.828 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.739 ' HB3' HD23 ' A' ' 68' ' ' LEU . 3.1 m-20 -51.03 -26.25 5.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.021 -179.655 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.446 ' CG2' ' OG ' ' A' ' 98' ' ' SER . 1.1 p -72.7 -54.62 8.49 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 177.868 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.561 ' HA ' HD21 ' A' ' 77' ' ' LEU . . . -54.45 -29.38 49.46 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 176.6 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 1.043 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -58.75 -60.8 3.26 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 113.742 -1.572 . . . . 0.0 110.489 178.289 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 1.099 HD13 HD23 ' A' ' 90' ' ' LEU . 1.0 OUTLIER -52.83 -56.91 12.3 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.139 0.495 . . . . 0.0 110.483 179.41 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.561 HD21 ' HA ' ' A' ' 74' ' ' ALA . 3.3 pp -59.67 -31.13 69.27 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.119 -179.481 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.557 ' HA ' HG12 ' A' ' 81' ' ' VAL . 20.0 mm-40 -70.59 -58.62 3.49 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.945 0.402 . . . . 0.0 110.351 179.321 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' SER . . . . . 0.415 ' CB ' ' HG2' ' A' ' 111' ' ' GLN . 1.2 t -50.46 -35.78 30.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.813 179.632 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.495 HG21 ' CE1' ' A' ' 88' ' ' TYR . 2.7 m -85.06 -59.28 2.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.986 -179.452 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.557 HG12 ' HA ' ' A' ' 78' ' ' GLN . 9.8 p -45.85 -30.92 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-O 120.68 0.276 . . . . 0.0 111.592 -179.371 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.46 -50.12 53.27 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.9 0.381 . . . . 0.0 110.849 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER 169.6 81.44 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.794 179.744 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -158.67 156.37 29.84 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.004 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -83.65 58.77 4.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.642 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.489 ' HA ' HG21 ' A' ' 80' ' ' THR . 2.9 m120 58.08 -92.31 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.645 -179.641 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ASN . . . . . 0.436 ' O ' ' HB2' ' A' ' 104' ' ' ARG . 0.1 OUTLIER 74.07 -47.42 0.64 Allowed 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 179.359 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.904 ' CE2' HD11 ' A' ' 90' ' ' LEU . 8.8 p90 -87.24 146.3 26.03 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-O 121.109 0.481 . . . . 0.0 111.702 -179.08 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.779 ' O ' ' O ' ' A' ' 101' ' ' VAL . 1.3 t0 -129.01 154.08 46.97 Favored 'General case' 0 N--CA 1.431 -1.404 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 178.62 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 1.099 HD23 HD13 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -157.9 147.79 20.17 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 114.668 1.358 . . . . 0.0 114.668 -178.578 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.564 ' HB3' ' HB ' ' A' ' 99' ' ' VAL . 0.0 OUTLIER -107.71 165.2 11.61 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 105.127 -2.175 . . . . 0.0 105.127 174.876 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.6 ' HA ' ' HA ' ' A' ' 98' ' ' SER . 75.6 p -139.42 165.18 27.9 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 116.065 1.876 . . . . 0.0 116.065 -177.689 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.594 ' C ' ' O ' ' A' ' 97' ' ' ASN . 0.2 OUTLIER -136.0 21.3 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 111.448 -2.614 . . . . 0.0 107.502 178.583 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.416 ' O ' ' N ' ' A' ' 97' ' ' ASN . . . 60.31 -162.6 18.66 Favored Glycine 0 N--CA 1.441 -0.97 0 CA-C-N 113.176 -1.829 . . . . 0.0 115.939 -178.922 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -43.32 -38.39 2.64 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 114.221 -0.989 . . . . 0.0 110.043 -179.045 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -62.3 -47.65 88.11 Favored Glycine 0 N--CA 1.435 -1.387 0 C-N-CA 120.01 -1.09 . . . . 0.0 110.492 178.422 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.602 ' HB3' ' HB ' ' A' ' 67' ' ' VAL . 0.3 OUTLIER -165.91 168.54 15.7 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-O 121.535 0.683 . . . . 0.0 111.885 179.558 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.6 ' HA ' ' HA ' ' A' ' 92' ' ' SER . 2.1 m -149.94 145.02 26.24 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 179.052 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.564 ' HB ' ' HB3' ' A' ' 91' ' ' ARG . 73.7 t -103.48 152.69 6.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 120.887 0.375 . . . . 0.0 111.669 -177.033 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 1.078 HD21 HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -108.95 130.47 55.45 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 114.916 1.45 . . . . 0.0 114.916 -177.211 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.779 ' O ' ' O ' ' A' ' 89' ' ' ASP . 2.1 p -143.95 103.02 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 N-CA-C 104.581 -2.377 . . . . 0.0 104.581 174.315 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.583 ' O ' HD23 ' A' ' 103' ' ' LEU . 0.1 OUTLIER -146.42 164.49 32.29 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 119.065 -1.054 . . . . 0.0 113.17 -174.843 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.815 HD13 ' O ' ' A' ' 105' ' ' SER . 0.1 OUTLIER 156.17 -90.96 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 113.505 -1.679 . . . . 0.0 111.372 176.722 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.436 ' HB2' ' O ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER 60.04 18.16 7.4 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 -179.407 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.815 ' O ' HD13 ' A' ' 103' ' ' LEU . 1.1 p 153.18 170.95 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -178.778 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.426 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.4 OUTLIER -110.73 100.02 8.85 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 119.25 -0.98 . . . . 0.0 111.452 179.264 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.734 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 6.1 mt-30 -169.19 164.96 11.1 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.742 -1.117 . . . . 0.0 109.174 177.685 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.566 ' HB2' ' HB2' ' A' ' 56' ' ' ALA . 2.3 tpt -160.76 145.49 14.13 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.121 0.486 . . . . 0.0 111.495 178.668 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.75 HG22 ' CZ ' ' A' ' 39' ' ' PHE . 0.6 OUTLIER -107.62 156.06 19.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.053 179.513 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.952 HD13 ' CB ' ' A' ' 20' ' ' SER . 0.6 OUTLIER -46.77 -53.48 11.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.746 0.308 . . . . 0.0 111.151 -179.51 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.925 ' O ' HG23 ' A' ' 115' ' ' VAL . 3.2 tp-100 -54.05 -61.95 1.97 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.212 179.324 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.504 ' HB2' HG23 ' A' ' 109' ' ' THR . 0.8 OUTLIER -46.54 -47.07 19.67 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.935 179.511 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.581 ' HB1' ' CZ ' ' A' ' 55' ' ' PHE . . . -53.01 -56.51 15.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.838 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.642 ' NZ ' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -66.11 -28.77 69.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.827 179.94 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 1.043 HG22 ' CG ' ' A' ' 75' ' ' LYS . 94.1 t -57.15 -65.27 0.42 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.729 0 CA-C-O 122.029 0.919 . . . . 0.0 110.588 179.235 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 1.009 ' HB3' HG21 ' A' ' 63' ' ' VAL . 9.5 mp -63.5 -40.63 97.58 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 114.437 -1.256 . . . . 0.0 111.003 -179.131 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.809 HD22 ' HB3' ' A' ' 8' ' ' LEU . 0.6 OUTLIER -73.62 -15.92 61.25 Favored 'General case' 0 CA--C 1.512 -0.507 0 C-N-CA 120.325 -0.55 . . . . 0.0 111.341 -179.809 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.488 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 20.5 tt0 -73.57 -47.84 37.48 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 105.928 -1.878 . . . . 0.0 105.928 176.143 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.431 ' CB ' ' HG ' ' A' ' 68' ' ' LEU . . . -71.77 -29.02 64.03 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 114.693 -1.139 . . . . 0.0 109.868 177.073 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.968 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -68.27 -64.82 0.79 Allowed 'General case' 0 CA--C 1.504 -0.808 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.612 179.614 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.777 HD12 ' HA2' ' A' ' 126' ' ' GLY . 0.2 OUTLIER -57.52 -39.27 76.17 Favored 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 119.987 -0.685 . . . . 0.0 109.24 179.509 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.57 ' N ' ' HG ' ' A' ' 121' ' ' LEU . 19.8 ttm-85 -54.73 -45.16 74.05 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.94 179.153 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -86.21 -31.63 21.62 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -178.806 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -95.75 -66.52 0.9 Allowed 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 -178.197 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.423 ' O ' ' HB2' ' A' ' 128' ' ' ARG . 47.8 t -95.59 -65.95 0.94 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 -177.595 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 126' ' ' GLY . . . . . 0.777 ' HA2' HD12 ' A' ' 121' ' ' LEU . . . 60.82 45.15 97.05 Favored Glycine 0 CA--C 1.493 -1.333 0 C-N-CA 120.192 -1.004 . . . . 0.0 110.764 -178.35 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . 47.95 24.7 0.64 Allowed 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 -176.824 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 128' ' ' ARG . . . . . 0.468 ' N ' ' C ' ' A' ' 126' ' ' GLY . 0.0 OUTLIER -117.54 -52.84 2.45 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 114.565 -1.198 . . . . 0.0 111.286 -178.088 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . -55.35 -35.93 61.93 Favored Glycine 0 C--N 1.336 0.538 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.77 -179.834 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 28.3 m . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.257 -0.878 . . . . 0.0 110.924 179.967 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.099 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -170.7 139.15 1.5 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.82 0.343 . . . . 0.0 110.899 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 203' ' ' GLU . . . . . 0.409 ' O ' ' C ' ' B' ' 204' ' ' PTR . 9.5 pt-20 -130.37 42.32 3.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.0 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 204' ' ' PTR . . . . . 0.458 ' CB ' ' HB3' ' A' ' 30' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -71.18 -14.57 62.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.69 -179.733 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 206' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -121.44 135.29 24.93 Favored Pre-proline 0 C--N 1.331 -0.196 0 CA-C-O 120.609 0.242 . . . . 0.0 111.314 -179.714 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -51.88 -74.39 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.864 2.376 . . . . 0.0 112.384 179.699 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 208' ' ' PHE . . . . . 0.424 ' CE2' ' HA ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -176.26 -172.68 0.5 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.983 -179.898 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.516 -0.311 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.719 0.295 . . . . 0.0 111.17 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -125.07 -150.41 0.45 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.831 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 1.041 HD11 HD12 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -106.85 -81.83 0.55 Allowed 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.108 -179.632 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.521 ' O ' ' HB2' ' A' ' 8' ' ' LEU . 34.9 t -178.23 -162.27 0.06 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.719 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.709 HD21 ' HB3' ' A' ' 62' ' ' HIS . 4.3 mt -95.38 -65.2 0.99 Allowed 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 121.24 0.543 . . . . 0.0 111.283 179.726 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.733 ' HB3' ' HA ' ' A' ' 128' ' ' ARG . 1.7 t -44.56 -39.32 4.83 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.636 -178.76 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.98 -62.8 1.58 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.266 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 1.069 HD11 HD11 ' A' ' 27' ' ' LEU . 2.7 tp -46.57 -41.69 14.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.357 0.598 . . . . 0.0 109.97 179.043 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.61 ' CG ' HD22 ' A' ' 121' ' ' LEU . 33.7 t-80 -69.34 -45.66 68.93 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.521 178.667 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.9 mtt-85 -54.87 -44.28 73.89 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.193 179.236 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.658 ' CB ' HG13 ' A' ' 31' ' ' VAL . 4.4 mp0 -64.63 -65.17 0.71 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.733 179.432 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 1.0 HG23 HD23 ' A' ' 110' ' ' LEU . 9.6 p -54.8 -47.81 74.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.082 -179.382 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.65 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 7.8 t -60.74 -50.22 74.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.404 -179.688 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 1.3 tpm_? -68.05 -22.47 64.94 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.374 -179.465 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.603 HD11 ' O ' ' A' ' 31' ' ' VAL . 12.4 mt -74.31 -60.14 2.41 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.402 -179.7 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.638 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 0.9 OUTLIER -70.81 -28.57 34.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.204 -179.384 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.442 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 5.7 mm-40 -85.46 -9.07 57.98 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.73 -0.388 . . . . 0.0 111.312 -179.681 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.442 ' HG2' ' O ' ' A' ' 17' ' ' GLN . 30.2 mt-30 -152.92 42.38 0.61 Allowed 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 179.759 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 177.56 -69.54 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 179.667 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.638 ' HB2' ' HA ' ' A' ' 16' ' ' VAL . 20.0 m -70.62 -81.5 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.973 -0.558 . . . . 0.0 112.126 -178.315 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.637 ' H ' ' HA ' ' A' ' 16' ' ' VAL . . . 120.42 -33.43 4.5 Favored Glycine 0 N--CA 1.45 -0.376 0 N-CA-C 111.549 -0.62 . . . . 0.0 111.549 -179.22 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 169.64 28.18 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 120.764 0.316 . . . . 0.0 110.98 179.692 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.432 ' HB2' ' HB3' ' A' ' 20' ' ' SER . 0.8 OUTLIER -80.74 -156.34 0.13 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.467 -179.903 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.665 HG21 ' CD2' ' A' ' 39' ' ' PHE . 0.1 OUTLIER -104.02 163.05 12.64 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.813 0.339 . . . . 0.0 110.589 -179.944 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLY . . . . . 0.428 ' HA3' ' CE2' ' A' ' 55' ' ' PHE . . . -110.71 150.72 17.72 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.541 -0.837 . . . . 0.0 113.647 -178.922 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.73 ' HB3' ' HB3' ' A' ' 32' ' ' ALA . 0.3 OUTLIER -114.33 104.44 12.07 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.229 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 1.069 HD11 HD11 ' A' ' 8' ' ' LEU . 0.5 OUTLIER -107.31 152.66 23.84 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -178.108 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.483 ' CB ' ' O ' ' A' ' 27' ' ' LEU . 5.7 ptp180 143.34 55.84 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 114.281 -1.327 . . . . 0.0 109.574 179.007 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.539 ' C ' HD22 ' A' ' 3' ' ' LEU . . . 105.83 -12.8 45.98 Favored Glycine 0 C--N 1.333 0.407 0 N-CA-C 111.388 -0.685 . . . . 0.0 111.388 -178.71 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.493 ' HB2' ' HA ' ' B' ' 207' ' ' PRO . 0.1 OUTLIER -166.38 165.23 17.28 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 179.849 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.677 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 1.4 m -121.8 117.29 51.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.244 0.545 . . . . 0.0 110.975 179.228 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.73 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . . . -107.99 166.27 10.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.874 -179.615 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.525 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -103.36 119.73 39.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.094 0.473 . . . . 0.0 111.316 -179.503 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.46 HD22 ' H ' ' A' ' 37' ' ' THR . 1.6 t-20 -98.56 122.09 41.32 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.931 -179.741 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.2 mtmm -118.68 -22.51 7.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.131 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -68.86 -16.21 63.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.486 -179.754 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.46 ' H ' HD22 ' A' ' 34' ' ' ASN . 0.1 OUTLIER -134.82 -175.14 3.8 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.985 0.421 . . . . 0.0 111.261 -179.786 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 72.3 p -147.86 106.84 3.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.872 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.737 ' O ' HG22 ' A' ' 109' ' ' THR . 21.8 m-85 -116.21 138.12 51.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.484 0.659 . . . . 0.0 112.57 -178.839 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -126.17 -45.99 1.67 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.065 179.419 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.469 ' HA2' ' HB2' ' A' ' 107' ' ' GLN . . . 177.04 76.43 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.278 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.112 179.231 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.608 ' H ' ' HB2' ' A' ' 107' ' ' GLN . 0.1 OUTLIER -113.2 -159.53 0.69 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 179.636 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.481 ' H ' HD12 ' A' ' 42' ' ' LEU . 0.2 OUTLIER -137.19 26.75 2.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.733 0.301 . . . . 0.0 111.793 179.963 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.831 ' HA ' ' HB3' ' A' ' 48' ' ' ALA . 1.1 mp 68.14 3.49 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 112.141 0.422 . . . . 0.0 112.141 179.536 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -93.89 -33.51 13.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.865 0.364 . . . . 0.0 110.874 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 3.2 t -98.83 -29.47 12.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.833 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 159.4 83.47 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.617 -0.801 . . . . 0.0 112.559 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.831 ' HB3' ' HA ' ' A' ' 44' ' ' ILE . . . -141.58 -177.48 5.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.044 0.45 . . . . 0.0 111.381 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.1 tpm_? -140.78 143.64 35.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.154 179.304 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.799 ' O ' HG23 ' A' ' 54' ' ' VAL . 2.5 mp0 -48.57 -35.16 12.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.216 0.532 . . . . 0.0 110.981 -179.846 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.461 ' CB ' ' HG2' ' A' ' 26' ' ' LYS . 0.7 OUTLIER -63.4 -60.61 3.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.374 -179.817 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.542 ' HG3' ' CD2' ' A' ' 39' ' ' PHE . 0.5 OUTLIER -44.41 -65.74 0.48 Allowed 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.149 0.5 . . . . 0.0 110.568 -179.752 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.518 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -47.16 -50.03 21.32 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.796 179.366 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.799 HG23 ' O ' ' A' ' 50' ' ' GLU . 57.0 t -56.53 -39.19 60.56 Favored 'Isoleucine or valine' 0 C--O 1.231 0.112 0 CA-C-O 121.013 0.435 . . . . 0.0 109.906 179.085 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.935 ' CD1' HD13 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -56.66 -51.05 70.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.01 179.23 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.632 ' HB2' ' HB2' ' A' ' 108' ' ' MET . . . -62.34 -32.79 73.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.509 179.187 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.2 tp-100 -71.26 -52.29 19.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.012 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.443 ' OG1' HD23 ' A' ' 27' ' ' LEU . 2.2 m -60.15 -48.22 82.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.076 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.663 ' CG2' HD12 ' A' ' 117' ' ' LEU . 9.7 p -66.36 -44.79 90.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 C-N-CA 120.585 -0.446 . . . . 0.0 111.314 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.49 HD13 HD23 ' A' ' 103' ' ' LEU . 0.6 OUTLIER -54.21 -44.98 72.09 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 121.028 0.442 . . . . 0.0 110.208 179.774 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 42.3 m -63.11 -59.17 5.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.179 179.781 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' HIS . . . . . 0.709 ' HB3' HD21 ' A' ' 5' ' ' LEU . 0.6 OUTLIER -50.89 -49.45 59.36 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-O 120.861 0.362 . . . . 0.0 110.564 -179.951 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.961 HG22 ' HB2' ' A' ' 120' ' ' ALA . 73.5 t -58.13 -66.51 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.86 178.82 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.493 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 36.78 32.21 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.859 178.682 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.554 ' O ' HG22 ' A' ' 66' ' ' VAL . 9.8 t-20 155.29 -79.47 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 122.466 0.307 . . . . 0.0 110.759 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.957 ' CG1' HG13 ' A' ' 63' ' ' VAL . 15.9 m 46.68 -155.9 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 116.121 -0.491 . . . . 0.0 112.001 179.683 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.759 HG13 ' O ' ' A' ' 67' ' ' VAL . 8.1 p -172.93 60.96 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.112 0 CA-C-O 121.643 0.735 . . . . 0.0 111.017 -179.506 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.997 HD11 ' HB2' ' A' ' 100' ' ' LEU . 0.5 OUTLIER -42.62 99.05 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.101 -0.954 . . . . 0.0 112.465 -179.551 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 75.1 p -60.25 178.06 0.22 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.751 178.872 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.23 -31.96 1.72 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.996 0.427 . . . . 0.0 110.955 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.81 -64.34 0.88 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.502 179.667 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.641 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 69.0 m-20 -60.55 -27.85 67.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.363 179.611 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 20.3 m -62.62 -61.34 2.49 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.51 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.0 -26.14 61.99 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 177.622 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 1.076 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.4 OUTLIER -57.24 -64.06 1.01 Allowed 'General case' 0 C--O 1.235 0.306 0 CA-C-N 114.777 -1.101 . . . . 0.0 110.134 178.783 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 1.019 HD13 HD21 ' A' ' 90' ' ' LEU . 0.4 OUTLIER -57.96 -39.22 77.58 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.806 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.55 ' O ' HG23 ' A' ' 81' ' ' VAL . 0.1 OUTLIER -52.63 -43.73 65.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.798 179.823 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.46 -50.54 30.66 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.595 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' SER . . . . . 0.452 ' HB3' ' CG ' ' A' ' 111' ' ' GLN . 35.6 p -62.24 -26.55 68.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.635 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.703 HG22 ' O ' ' A' ' 76' ' ' LEU . 13.1 t -95.25 -31.56 13.42 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -179.124 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.55 HG23 ' O ' ' A' ' 77' ' ' LEU . 80.1 t -91.53 -8.29 10.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 -179.568 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 8.9 pttt -55.49 -27.37 48.07 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.655 0.264 . . . . 0.0 111.172 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -161.19 94.22 0.99 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.826 0.346 . . . . 0.0 111.27 -179.901 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 48.94 -172.51 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.314 179.544 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 70.2 mt -64.34 105.34 0.9 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.488 179.679 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.408 ' HB2' ' HA ' ' A' ' 80' ' ' THR . 0.8 OUTLIER -66.31 -89.08 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.166 -179.576 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ASN . . . . . 0.488 ' HB2' ' O ' ' A' ' 103' ' ' LEU . 29.4 p-10 -179.82 7.96 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -179.481 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.506 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 3.3 m-85 -102.83 131.87 49.41 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 120.958 0.408 . . . . 0.0 111.208 -179.194 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.768 ' CG ' HG13 ' A' ' 101' ' ' VAL . 1.0 OUTLIER -109.22 144.28 37.54 Favored 'General case' 0 N--CA 1.435 -1.206 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 -179.445 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 1.019 HD21 HD13 ' A' ' 76' ' ' LEU . 39.7 mt -135.28 158.84 43.34 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -177.261 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.674 ' O ' ' CB ' ' A' ' 98' ' ' SER . 0.1 OUTLIER -134.16 161.32 35.22 Favored 'General case' 0 C--O 1.216 -0.659 0 CA-C-N 114.63 -1.168 . . . . 0.0 108.355 178.101 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.788 ' O ' HG13 ' A' ' 93' ' ' VAL . 17.9 p -103.96 157.93 16.76 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.82 0.819 . . . . 0.0 112.74 -178.832 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.788 HG13 ' O ' ' A' ' 92' ' ' SER . 0.0 OUTLIER 168.57 151.68 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.435 -1.197 0 CA-C-N 113.87 -1.514 . . . . 0.0 108.089 -179.171 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.419 ' HA3' ' ND2' ' A' ' 97' ' ' ASN . . . 88.74 21.39 43.47 Favored Glycine 0 C--N 1.289 -2.042 0 C-N-CA 119.931 -1.128 . . . . 0.0 112.873 -179.747 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 8.5 t30 72.62 -51.15 0.7 Allowed 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 -178.225 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -135.38 15.65 4.17 Favored Glycine 0 N--CA 1.441 -0.995 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.987 178.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.593 ' O ' ' O ' ' A' ' 93' ' ' VAL . 0.1 OUTLIER -106.88 166.76 10.36 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 117.304 0.552 . . . . 0.0 109.862 179.483 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.674 ' CB ' ' O ' ' A' ' 91' ' ' ARG . 0.1 OUTLIER -140.41 165.34 27.68 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.184 0.516 . . . . 0.0 110.908 179.847 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.499 HG12 ' HB2' ' A' ' 91' ' ' ARG . 0.5 OUTLIER -104.14 150.68 7.13 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 115.361 -0.836 . . . . 0.0 108.869 179.562 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.997 ' HB2' HD11 ' A' ' 68' ' ' LEU . 3.2 tp -103.79 106.31 16.78 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 113.423 0.897 . . . . 0.0 113.423 -178.476 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.768 HG13 ' CG ' ' A' ' 89' ' ' ASP . 1.4 p -121.85 104.19 14.56 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.978 0 N-CA-C 104.007 -2.59 . . . . 0.0 104.007 174.623 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.581 ' O ' HD23 ' A' ' 103' ' ' LEU . 0.2 OUTLIER -149.87 161.31 42.53 Favored 'General case' 0 C--N 1.309 -1.194 0 C-N-CA 118.829 -1.148 . . . . 0.0 114.036 -173.841 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.581 HD23 ' O ' ' A' ' 102' ' ' SER . 0.1 OUTLIER 166.14 -69.48 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 113.478 -1.692 . . . . 0.0 112.278 175.343 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.552 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 35.14 56.18 0.79 Allowed 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.055 0.455 . . . . 0.0 110.228 179.6 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.552 ' CB ' ' O ' ' A' ' 104' ' ' ARG . 11.4 m 105.27 167.98 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.545 -177.579 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.426 ' HB3' ' CB ' ' A' ' 53' ' ' LYS . 0.5 OUTLIER -104.74 102.33 11.91 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.092 -0.643 . . . . 0.0 112.665 -178.545 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.822 ' OE1' ' HB2' ' A' ' 48' ' ' ALA . 0.9 OUTLIER -168.72 165.1 12.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.841 177.989 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.686 ' HB3' ' HB3' ' A' ' 55' ' ' PHE . 18.6 ttm -165.59 143.4 5.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.346 0.593 . . . . 0.0 112.286 178.668 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.737 HG22 ' O ' ' A' ' 39' ' ' PHE . 0.1 OUTLIER -104.38 165.11 11.27 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.027 -0.988 . . . . 0.0 109.078 178.287 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 1.0 HD23 HG23 ' A' ' 12' ' ' VAL . 7.0 mt -56.03 -52.87 62.7 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.665 0.269 . . . . 0.0 111.395 -179.369 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.849 ' O ' HG23 ' A' ' 115' ' ' VAL . 3.4 tp-100 -50.45 -65.19 0.6 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.786 0.327 . . . . 0.0 110.642 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.893 ' O ' HD22 ' A' ' 116' ' ' LEU . 0.3 OUTLIER -47.71 -45.53 28.69 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.096 0.474 . . . . 0.0 110.895 179.898 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.845 ' HB1' ' CE1' ' A' ' 55' ' ' PHE . . . -49.42 -61.24 2.21 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.936 179.664 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.697 ' NZ ' HG22 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -66.36 -25.52 66.84 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.239 -179.982 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 1.076 HG22 ' CG ' ' A' ' 75' ' ' LYS . 76.6 t -58.36 -65.11 0.46 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.808 0 CA-C-O 121.991 0.9 . . . . 0.0 110.305 179.37 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.893 HD22 ' O ' ' A' ' 112' ' ' ASP . 0.0 OUTLIER -62.95 -40.98 99.3 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.645 -179.476 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.874 ' CD1' HD23 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -69.03 -22.41 64.05 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 120.792 0.33 . . . . 0.0 111.433 -179.763 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.594 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 30.8 tt0 -69.75 -49.51 52.4 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 106.008 -1.849 . . . . 0.0 106.008 177.324 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.657 ' O ' ' HB2' ' A' ' 123' ' ' GLN . . . -70.18 -28.27 65.18 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.081 177.384 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 0.961 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -72.05 -63.58 1.11 Allowed 'General case' 0 CA--C 1.511 -0.537 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.397 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.631 ' O ' ' N ' ' A' ' 126' ' ' GLY . 0.0 OUTLIER -55.99 -42.35 76.23 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.314 -179.746 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.594 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.4 OUTLIER -67.37 -39.14 85.65 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.904 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.657 ' HB2' ' O ' ' A' ' 119' ' ' ALA . 1.7 mp0 -77.15 -36.73 54.99 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -178.711 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -96.17 -69.74 0.74 Allowed 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 -177.464 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.506 ' OG ' ' N ' ' A' ' 129' ' ' GLY . 26.0 t -99.53 -66.84 0.88 Allowed 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -178.774 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 126' ' ' GLY . . . . . 0.631 ' N ' ' O ' ' A' ' 121' ' ' LEU . . . 69.14 50.24 35.1 Favored Glycine 0 N--CA 1.445 -0.716 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.779 -178.367 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -177.54 -54.2 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.96 -0.62 . . . . 0.0 109.615 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 128' ' ' ARG . . . . . 0.733 ' HA ' ' HB3' ' A' ' 6' ' ' SER . 0.0 OUTLIER 168.77 36.57 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.552 178.976 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 129' ' ' GLY . . . . . 0.506 ' N ' ' OG ' ' A' ' 125' ' ' SER . . . 93.05 -4.4 74.59 Favored Glycine 0 C--N 1.315 -0.596 0 CA-C-N 115.683 -0.69 . . . . 0.0 112.636 -179.765 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 29.0 t . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.273 -0.87 . . . . 0.0 110.957 -179.982 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.113 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 1.4 t70 60.89 95.28 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.815 0.341 . . . . 0.0 110.931 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -105.95 167.42 9.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.956 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 204' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 205' ' ' ASP . . . . . 0.412 ' O ' ' O ' ' B' ' 206' ' ' ASP . 0.7 OUTLIER -93.66 91.66 7.14 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.77 -179.25 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 206' ' ' ASP . . . . . 0.486 ' HB2' ' HD2' ' B' ' 207' ' ' PRO . 0.6 OUTLIER 54.34 159.46 0.06 OUTLIER Pre-proline 0 CA--C 1.533 0.295 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.85 179.116 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 207' ' ' PRO . . . . . 0.493 ' HA ' ' HB2' ' A' ' 30' ' ' ASN . 19.1 Cg_endo -60.26 -165.45 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.697 2.265 . . . . 0.0 112.289 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 208' ' ' PHE . . . . . 0.422 ' CD1' ' HG3' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -66.08 -168.06 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.952 -179.807 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.512 -0.313 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 32.0 mmt . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.79 0.329 . . . . 0.0 111.149 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -88.42 -164.35 1.11 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.815 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.898 HD11 ' HA ' ' A' ' 30' ' ' ASN . 1.2 mt -68.87 -81.56 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.062 0.458 . . . . 0.0 110.368 179.469 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.414 ' CB ' ' OD1' ' A' ' 7' ' ' ASP . 0.6 OUTLIER -170.12 -156.11 0.13 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.616 179.732 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 1.089 HD21 ' HB1' ' A' ' 120' ' ' ALA . 0.3 OUTLIER -95.71 -66.31 0.92 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.712 0.768 . . . . 0.0 112.429 -179.33 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.2 p -65.08 -41.14 95.31 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.549 -1.205 . . . . 0.0 112.87 -177.693 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ASP . . . . . 0.414 ' OD1' ' CB ' ' A' ' 4' ' ' SER . 0.1 OUTLIER -67.53 -48.21 67.67 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.23 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.887 HD23 HD21 ' A' ' 117' ' ' LEU . 18.2 tp -51.74 -46.58 64.09 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.927 178.738 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.571 ' CG ' ' CD2' ' A' ' 121' ' ' LEU . 46.1 t-80 -65.06 -39.92 93.98 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.538 178.697 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.407 ' HB2' ' O ' ' A' ' 7' ' ' ASP . 0.1 OUTLIER -52.06 -53.14 45.79 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.258 -179.691 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.979 ' HG3' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -69.64 -55.38 10.2 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 120.885 -0.326 . . . . 0.0 111.566 -179.706 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.687 HG23 HG21 ' A' ' 31' ' ' VAL . 2.4 p -55.82 -46.82 80.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 CA-C-O 120.973 0.416 . . . . 0.0 111.244 -179.814 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.805 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 56.0 p -60.96 -53.32 58.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.309 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.48 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 0.6 OUTLIER -60.73 -21.09 62.59 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.823 0.344 . . . . 0.0 110.445 -179.916 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.61 HD12 ' O ' ' A' ' 11' ' ' GLN . 4.8 mt -78.11 -65.54 0.96 Allowed 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 112.74 0.645 . . . . 0.0 112.74 -179.247 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.655 HG23 HD13 ' A' ' 110' ' ' LEU . 0.9 OUTLIER -72.49 -26.75 24.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.526 -0.47 . . . . 0.0 111.662 -178.863 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.457 ' HB2' ' O ' ' A' ' 13' ' ' SER . 3.5 mm100 -70.54 -21.86 62.67 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.461 -0.495 . . . . 0.0 110.326 179.639 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.48 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 2.1 pt20 -165.99 63.33 0.11 Allowed 'General case' 0 CA--C 1.528 0.113 0 CA-C-O 120.75 0.31 . . . . 0.0 111.318 179.376 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 175.53 -57.72 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.537 179.779 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.591 ' CB ' HD13 ' A' ' 110' ' ' LEU . 63.5 m -85.51 -39.63 17.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.647 -179.179 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 59.53 69.23 1.34 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.45 -0.881 . . . . 0.0 111.969 -179.447 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.42 ' N ' HG22 ' A' ' 16' ' ' VAL . 0.0 OUTLIER 58.77 88.7 0.06 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.977 0.418 . . . . 0.0 110.7 -179.635 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 23' ' ' CYS . . . . . 0.449 ' HB2' ' HB3' ' A' ' 20' ' ' SER . 97.1 m -149.79 -162.91 1.66 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.962 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.774 ' CG2' HG22 ' A' ' 109' ' ' THR . 0.0 OUTLIER -104.46 147.96 26.99 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.713 -179.923 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -104.99 140.6 15.07 Favored Glycine 0 N--CA 1.443 -0.834 0 C-N-CA 120.282 -0.961 . . . . 0.0 113.386 -178.76 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.963 ' HB3' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -104.45 121.77 44.13 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 178.967 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.772 HD22 HG12 ' A' ' 54' ' ' VAL . 8.7 tt -104.6 149.04 25.86 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.327 0.584 . . . . 0.0 112.243 -178.762 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 162.33 55.76 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.383 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.716 ' O ' HD21 ' A' ' 3' ' ' LEU . . . 90.61 -8.1 80.32 Favored Glycine 0 C--N 1.332 0.336 0 N-CA-C 111.355 -0.698 . . . . 0.0 111.355 -178.153 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.898 ' HA ' HD11 ' A' ' 3' ' ' LEU . 0.1 OUTLIER -165.92 162.97 18.54 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 179.815 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.979 HG12 ' HG3' ' A' ' 11' ' ' GLN . 7.4 p -104.7 133.58 48.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 121.482 0.658 . . . . 0.0 110.784 178.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.963 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . . . -113.22 166.38 11.51 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.657 -179.699 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.529 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -102.14 105.95 16.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.617 0.722 . . . . 0.0 110.573 -179.442 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -91.47 114.35 26.85 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.604 -1.18 . . . . 0.0 111.321 -179.015 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -131.08 40.22 3.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.558 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -110.93 -38.89 4.97 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.589 -179.383 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.809 ' O ' HG23 ' A' ' 38' ' ' THR . 89.5 m -122.51 -106.44 0.36 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.511 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.809 HG23 ' O ' ' A' ' 37' ' ' THR . 0.7 OUTLIER -174.44 -49.1 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 113.037 0.754 . . . . 0.0 113.037 179.933 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.639 ' O ' ' O ' ' A' ' 38' ' ' THR . 0.9 OUTLIER 45.1 122.38 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.879 0.847 . . . . 0.0 110.977 -177.72 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.519 ' NE2' ' O ' ' A' ' 85' ' ' LEU . 0.0 OUTLIER -128.61 40.38 3.66 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.0 -178.998 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.622 ' C ' ' HB2' ' A' ' 107' ' ' GLN . . . 90.24 8.53 66.37 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 115.396 -0.82 . . . . 0.0 113.112 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.784 ' HB3' ' NE2' ' A' ' 107' ' ' GLN . 0.3 OUTLIER -49.41 -166.58 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 117.04 0.42 . . . . 0.0 111.364 179.311 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.674 ' C ' HD12 ' A' ' 44' ' ' ILE . 1.5 m -132.58 24.17 4.38 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -179.748 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.809 ' HA ' ' HB3' ' A' ' 48' ' ' ALA . 1.3 mp 67.4 2.89 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 179.627 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.74 -32.51 60.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.847 0.356 . . . . 0.0 111.011 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.551 ' CB ' HD21 ' A' ' 42' ' ' LEU . 7.8 t -82.06 -62.64 1.57 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.095 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -175.07 32.54 0.09 OUTLIER Glycine 0 C--N 1.331 0.281 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.997 -179.891 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.809 ' HB3' ' HA ' ' A' ' 44' ' ' ILE . . . -83.7 -163.95 0.84 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.073 0.463 . . . . 0.0 111.64 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -130.79 -178.31 4.74 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.134 179.528 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.647 ' O ' HG23 ' A' ' 54' ' ' VAL . 2.4 mp0 -83.03 -27.88 30.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.91 0.386 . . . . 0.0 110.842 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.437 ' CB ' ' HG2' ' A' ' 26' ' ' LYS . 1.5 m -55.41 -65.14 0.64 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.743 -179.724 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.682 ' OE1' HG22 ' A' ' 24' ' ' THR . 31.2 mm-40 -49.39 -67.38 0.27 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.901 0.381 . . . . 0.0 111.641 -179.08 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.604 ' CB ' HD11 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -40.54 -54.38 2.52 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.917 179.147 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.772 HG12 HD22 ' A' ' 27' ' ' LEU . 77.3 t -58.09 -44.83 88.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.806 179.178 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.621 ' HA ' HD13 ' A' ' 27' ' ' LEU . 0.5 OUTLIER -55.31 -33.49 63.34 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.488 178.995 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.537 ' HB1' HD11 ' A' ' 60' ' ' LEU . . . -64.17 -65.2 0.71 Allowed 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 177.837 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLN . . . . . 0.437 ' HA ' HD12 ' A' ' 60' ' ' LEU . 3.7 mm-40 -37.46 -47.64 0.9 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.652 179.753 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.429 HG21 HD11 ' A' ' 27' ' ' LEU . 68.8 p -67.27 -46.56 73.29 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -179.208 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.996 HG23 HD12 ' A' ' 117' ' ' LEU . 11.9 p -72.23 -28.21 28.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -178.183 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 1.025 HD13 HD21 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -92.97 -21.38 19.81 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 120.201 -0.599 . . . . 0.0 110.525 179.486 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.407 ' CB ' ' O ' ' A' ' 57' ' ' GLN . 44.7 m -79.82 -42.9 23.42 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 178.259 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -61.96 -49.2 77.06 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.873 179.353 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 0.974 HG12 HG11 ' A' ' 66' ' ' VAL . 2.8 m -58.23 -60.64 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.035 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.599 ' H ' HG23 ' A' ' 63' ' ' VAL . . . 40.36 28.66 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.237 -0.438 . . . . 0.0 112.06 179.659 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.604 ' O ' HG22 ' A' ' 66' ' ' VAL . 0.9 OUTLIER 159.19 -80.26 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 120.724 0.297 . . . . 0.0 111.697 -179.679 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.974 HG11 HG12 ' A' ' 63' ' ' VAL . 23.0 m 49.98 -158.85 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.95 -179.142 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.923 HG22 ' HB3' ' A' ' 97' ' ' ASN . 4.5 p -163.92 87.28 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 121.597 0.713 . . . . 0.0 109.777 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.843 HD23 ' HB3' ' A' ' 72' ' ' ASP . 1.1 mp -80.87 112.73 18.52 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.66 -177.882 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.609 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 2.3 p -89.97 -177.18 5.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.52 179.033 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.449 ' HA ' ' OG1' ' A' ' 73' ' ' THR . 0.0 OUTLIER -34.67 -39.06 0.08 Allowed 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.018 -179.312 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -69.27 -65.35 0.72 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.406 -179.435 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.843 ' HB3' HD23 ' A' ' 68' ' ' LEU . 0.7 OUTLIER -60.57 -30.91 70.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.685 -179.902 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.547 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 1.5 p -61.86 -64.32 0.97 Allowed 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 178.247 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -53.23 -25.84 15.69 Favored 'General case' 0 N--CA 1.456 -0.163 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.422 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 1.077 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.1 OUTLIER -58.92 -56.33 23.66 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.187 178.765 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.871 HD13 HD11 ' A' ' 90' ' ' LEU . 1.3 mp -63.47 -47.91 79.85 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 178.921 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.676 ' O ' HG12 ' A' ' 81' ' ' VAL . 4.9 mt -58.61 -29.68 66.67 Favored 'General case' 0 N--CA 1.461 0.097 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.355 179.406 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.597 ' HA ' HG12 ' A' ' 81' ' ' VAL . 2.0 mt-30 -72.72 -47.66 45.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.533 179.888 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 22.0 p -59.06 -38.76 80.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.697 179.801 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.432 HG22 ' HA ' ' A' ' 77' ' ' LEU . 15.3 t -75.97 -45.17 36.21 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.281 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.676 HG12 ' O ' ' A' ' 77' ' ' LEU . 8.2 p -74.7 -12.43 15.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.645 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 9.4 mmmt -46.64 -64.09 0.85 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.78 0.324 . . . . 0.0 111.291 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -179.9 44.8 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.8 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -172.7 -177.2 1.64 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.987 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.519 ' O ' ' NE2' ' A' ' 40' ' ' GLN . 6.8 mp -111.03 116.23 30.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.709 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.409 ' HB2' ' CB ' ' A' ' 80' ' ' THR . 0.9 OUTLIER -88.26 157.33 18.8 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.969 0.414 . . . . 0.0 111.194 -179.672 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ASN . . . . . 0.541 ' OD1' ' HA3' ' A' ' 41' ' ' GLY . 0.4 OUTLIER -116.69 35.07 4.74 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-O 121.703 0.763 . . . . 0.0 110.387 179.861 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.579 ' HA ' ' HB3' ' A' ' 102' ' ' SER . 4.7 m-85 -101.96 152.23 21.19 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.457 -179.85 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.721 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.2 OUTLIER -124.34 143.93 50.3 Favored 'General case' 0 N--CA 1.443 -0.813 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 -179.353 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.871 HD11 HD13 ' A' ' 76' ' ' LEU . 11.8 mt -133.02 151.96 52.01 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -177.232 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.636 ' O ' ' CB ' ' A' ' 98' ' ' SER . 0.0 OUTLIER -134.19 159.43 40.94 Favored 'General case' 0 C--O 1.218 -0.575 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.048 178.291 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.788 ' O ' HG13 ' A' ' 93' ' ' VAL . 0.7 OUTLIER -103.98 160.95 14.39 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.738 0.78 . . . . 0.0 112.56 -178.882 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.788 HG13 ' O ' ' A' ' 92' ' ' SER . 0.0 OUTLIER 167.07 141.42 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.891 0 CA-C-N 113.992 -1.458 . . . . 0.0 108.5 -179.215 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.479 ' HA3' ' ND2' ' A' ' 97' ' ' ASN . . . 98.11 26.4 9.57 Favored Glycine 0 C--N 1.298 -1.576 0 C-N-CA 119.659 -1.258 . . . . 0.0 113.052 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 41.94 30.52 0.18 Allowed 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 121.443 0.64 . . . . 0.0 109.649 -178.662 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 157.18 -7.93 0.21 Allowed Glycine 0 N--CA 1.442 -0.924 0 CA-C-N 115.062 -0.972 . . . . 0.0 112.893 -179.064 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.923 ' HB3' HG22 ' A' ' 67' ' ' VAL . 0.0 OUTLIER -104.74 166.8 10.14 Favored 'General case' 0 C--N 1.346 0.428 0 CA-C-N 118.261 1.03 . . . . 0.0 109.823 179.389 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.636 ' CB ' ' O ' ' A' ' 91' ' ' ARG . 0.1 OUTLIER -141.85 163.95 31.52 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.278 0.561 . . . . 0.0 110.941 -179.811 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.57 HG12 ' HB2' ' A' ' 91' ' ' ARG . 0.4 OUTLIER -104.72 151.65 7.04 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.825 179.782 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.838 HD21 HD11 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -104.13 105.85 16.16 Favored 'General case' 0 CA--C 1.509 -0.602 0 CA-C-O 121.68 0.752 . . . . 0.0 112.439 -179.684 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.721 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 43.6 t -122.15 105.67 16.65 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.978 0 N-CA-C 105.348 -2.093 . . . . 0.0 105.348 175.761 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.745 ' O ' HD23 ' A' ' 103' ' ' LEU . 73.7 m -146.37 153.3 40.34 Favored 'General case' 0 C--N 1.309 -1.157 0 C-N-CA 119.256 -0.978 . . . . 0.0 113.051 -175.427 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 1.025 HD21 HD13 ' A' ' 60' ' ' LEU . 1.2 mm? 144.19 67.21 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 114.612 -1.176 . . . . 0.0 112.643 176.7 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.526 ' CB ' ' HB2' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -101.85 21.31 14.82 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 114.686 -1.143 . . . . 0.0 108.012 177.023 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.581 ' CB ' ' O ' ' A' ' 41' ' ' GLY . 4.3 m 159.02 160.32 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 -179.003 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.436 ' C ' ' O ' ' A' ' 42' ' ' LEU . 0.4 OUTLIER -104.79 102.85 12.39 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 -177.168 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.784 ' NE2' ' HB3' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -168.39 162.66 12.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.289 177.278 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.876 ' SD ' HG11 ' A' ' 59' ' ' VAL . 0.0 OUTLIER -165.38 126.06 1.9 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.27 0.557 . . . . 0.0 112.067 179.95 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.774 HG22 ' CG2' ' A' ' 24' ' ' THR . 4.7 p -103.0 162.73 12.69 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.558 -179.638 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.655 HD13 HG23 ' A' ' 16' ' ' VAL . 1.0 OUTLIER -39.34 -64.85 0.43 Allowed 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.293 -179.576 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.872 ' O ' HG23 ' A' ' 115' ' ' VAL . 3.6 tp-100 -43.69 -64.35 0.67 Allowed 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.278 179.653 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -44.19 -41.75 5.98 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 121.232 0.539 . . . . 0.0 110.597 179.569 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.802 ' HB2' ' HE1' ' A' ' 108' ' ' MET . . . -60.07 -65.09 0.74 Allowed 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.494 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.805 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.2 OUTLIER -55.88 -25.56 43.07 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.967 179.611 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 1.077 HG22 ' CG ' ' A' ' 75' ' ' LYS . 72.7 t -65.36 -64.62 0.68 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.739 0 CA-C-O 121.657 0.741 . . . . 0.0 110.728 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.838 HD11 HD21 ' A' ' 100' ' ' LEU . 9.8 mp -63.86 -30.74 71.8 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.448 -179.591 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.996 HD12 HG23 ' A' ' 59' ' ' VAL . 2.1 mp -79.07 -26.4 43.04 Favored 'General case' 0 CA--C 1.511 -0.535 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.256 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.554 ' HB2' ' O ' ' A' ' 114' ' ' LYS . 0.8 OUTLIER -66.38 -48.35 70.43 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 177.278 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.44 ' HB2' ' OD2' ' A' ' 72' ' ' ASP . . . -74.6 -25.35 59.19 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 114.992 -1.004 . . . . 0.0 109.695 177.1 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 1.089 ' HB1' HD21 ' A' ' 5' ' ' LEU . . . -68.73 -60.17 2.59 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.469 179.496 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.822 HD23 ' O ' ' A' ' 117' ' ' LEU . 1.0 OUTLIER -65.51 -33.77 76.71 Favored 'General case' 0 N--CA 1.444 -0.748 0 C-N-CA 120.202 -0.599 . . . . 0.0 109.695 179.638 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.549 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.1 OUTLIER -58.45 -46.47 86.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.828 179.494 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.619 ' HB2' HG12 ' A' ' 67' ' ' VAL . 2.4 tt0 -94.53 -29.82 14.71 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 113.769 1.025 . . . . 0.0 113.769 -177.769 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 124' ' ' GLU . . . . . 0.425 ' HB2' HD13 ' A' ' 5' ' ' LEU . 0.8 OUTLIER -96.42 -68.38 0.8 Allowed 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -177.399 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.47 ' OG ' ' N ' ' A' ' 126' ' ' GLY . 6.0 p -96.89 -66.0 0.93 Allowed 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 113.005 0.742 . . . . 0.0 113.005 -177.503 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 126' ' ' GLY . . . . . 0.608 ' O ' ' HB3' ' A' ' 127' ' ' ALA . . . 78.01 77.5 0.84 Allowed Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 111.104 -0.798 . . . . 0.0 111.104 -178.374 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.608 ' HB3' ' O ' ' A' ' 126' ' ' GLY . . . 86.55 -39.2 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 -178.274 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 128' ' ' ARG . . . . . 0.4 ' CB ' ' O ' ' A' ' 127' ' ' ALA . 4.0 mtp180 165.12 45.58 0.0 OUTLIER 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.356 0.598 . . . . 0.0 111.064 178.88 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 129' ' ' GLY . . . . . 0.407 ' HA3' ' HA ' ' A' ' 125' ' ' SER . . . -59.37 -25.89 61.05 Favored Glycine 0 C--N 1.315 -0.627 0 CA-C-N 115.511 -0.768 . . . . 0.0 112.538 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 2.6 p . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.896 179.927 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.146 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -72.76 128.99 37.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.821 0.343 . . . . 0.0 110.866 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -134.98 80.64 1.85 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.896 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 204' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.96 -65.65 0.65 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.15 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 206' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -107.48 157.09 36.58 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.269 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 207' ' ' PRO . . . . . 0.449 ' HA ' ' HB2' ' A' ' 30' ' ' ASN . 7.6 Cg_endo -48.83 179.04 0.01 OUTLIER 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 123.174 2.583 . . . . 0.0 112.691 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 208' ' ' PHE . . . . . 0.487 ' CE1' ' HA ' ' A' ' 11' ' ' GLN . 68.0 m-85 56.48 173.89 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.99 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 116.471 -0.332 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.777 0.323 . . . . 0.0 111.239 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ASN . . . . . 0.547 ' HB2' HD21 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -104.98 -162.98 0.92 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.899 -179.93 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.989 HD11 ' HB2' ' A' ' 8' ' ' LEU . 4.1 pp -68.89 -172.84 0.42 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.447 179.691 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' SER . . . . . 0.488 ' O ' HD12 ' A' ' 3' ' ' LEU . 0.1 OUTLIER -63.97 130.72 45.21 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.135 0.493 . . . . 0.0 112.03 -179.035 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 1.049 HD21 ' HB1' ' A' ' 120' ' ' ALA . 0.1 OUTLIER -51.08 -65.74 0.5 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.025 -179.939 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 6' ' ' SER . . . . . 0.426 ' OG ' ' N ' ' A' ' 128' ' ' ARG . 1.0 OUTLIER -48.96 -30.12 5.6 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.59 0.234 . . . . 0.0 111.418 -179.244 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ASP . . . . . 0.536 ' O ' ' HB3' ' A' ' 11' ' ' GLN . 0.9 OUTLIER -73.39 -44.83 57.66 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.046 0.45 . . . . 0.0 109.973 179.385 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.989 ' HB2' HD11 ' A' ' 3' ' ' LEU . 1.5 tp -73.8 -30.57 62.8 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.964 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' HIS . . . . . 0.771 ' CG ' HD22 ' A' ' 121' ' ' LEU . 4.4 t-80 -68.25 -54.3 18.59 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 121.677 0.751 . . . . 0.0 109.214 179.656 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.521 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 0.6 OUTLIER -63.57 -36.89 85.29 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 114.584 -1.189 . . . . 0.0 108.988 179.164 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.992 ' HG2' HG13 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -60.49 -65.47 0.68 Allowed 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.917 178.477 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 12' ' ' VAL . . . . . 0.978 HG12 ' O ' ' A' ' 8' ' ' LEU . 5.7 p -56.69 -51.99 59.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.809 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.515 ' O ' ' HB2' ' A' ' 17' ' ' GLN . 2.5 p -63.49 -27.3 69.18 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.224 -179.388 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.521 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -76.81 -41.03 45.94 Favored 'General case' 0 CA--C 1.514 -0.405 0 C-N-CA 120.281 -0.568 . . . . 0.0 111.344 -179.02 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.718 HD12 ' HA ' ' A' ' 12' ' ' VAL . 0.1 OUTLIER -68.67 -53.2 23.74 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 119.707 -0.797 . . . . 0.0 110.043 179.627 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 16' ' ' VAL . . . . . 0.725 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 10.4 p -65.47 -47.84 85.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.75 -178.483 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 0.522 ' N ' HG13 ' A' ' 16' ' ' VAL . 1.0 OUTLIER -61.76 -18.65 60.64 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.169 -0.612 . . . . 0.0 110.964 -179.783 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLN . . . . . 0.415 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 1.5 pt20 -158.84 61.65 0.42 Allowed 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 120.73 -0.388 . . . . 0.0 111.869 179.557 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.476 ' N ' ' O ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER 169.87 -44.59 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.331 179.339 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.773 ' CB ' HD13 ' A' ' 110' ' ' LEU . 14.7 m -105.69 -28.41 10.72 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.387 -179.39 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.405 ' O ' HG22 ' A' ' 16' ' ' VAL . . . 79.41 -59.7 4.35 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.245 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -173.55 21.77 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 120.617 0.246 . . . . 0.0 111.227 179.712 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -61.09 -156.81 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.736 -179.924 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.74 HG21 ' CD2' ' A' ' 39' ' ' PHE . 0.3 OUTLIER -103.56 149.78 24.56 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 179.854 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -105.0 128.54 9.48 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.448 -0.882 . . . . 0.0 113.224 -179.009 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.885 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -104.6 129.19 52.73 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 178.884 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.638 HD12 ' CD2' ' A' ' 55' ' ' PHE . 0.3 OUTLIER -104.14 165.63 10.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.545 -179.024 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.564 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER 144.97 50.16 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.488 1.115 . . . . 0.0 109.949 179.891 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.583 ' C ' HD23 ' A' ' 3' ' ' LEU . . . 93.7 -9.61 73.38 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 120.912 -0.661 . . . . 0.0 111.67 -179.1 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -165.58 156.17 13.44 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 179.713 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.992 HG13 ' HG2' ' A' ' 11' ' ' GLN . 0.6 OUTLIER -109.5 132.18 58.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 C-N-CA 119.785 -0.766 . . . . 0.0 111.237 179.727 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.885 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -117.41 166.96 11.71 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.869 -1.059 . . . . 0.0 110.859 -179.406 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.633 ' HB2' ' OG ' ' A' ' 20' ' ' SER . . . -103.28 119.49 38.97 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.16 0.505 . . . . 0.0 111.3 -179.393 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.636 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 8.3 t30 -100.0 137.02 39.03 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.73 -179.728 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.7 ttmp? -121.9 9.9 10.1 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.51 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.63 -61.02 2.58 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 120.963 0.411 . . . . 0.0 110.428 179.709 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.543 HG23 ' CE1' ' A' ' 39' ' ' PHE . 0.1 OUTLIER -137.04 -78.94 0.39 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.264 179.339 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.774 ' O ' HG22 ' A' ' 109' ' ' THR . 9.3 t 176.03 -41.95 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.059 0.457 . . . . 0.0 111.352 179.727 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.74 ' CD2' HG21 ' A' ' 24' ' ' THR . 9.0 m-85 59.52 135.68 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.798 0.809 . . . . 0.0 111.498 -178.966 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLN . . . . . 0.466 ' HG2' ' CB ' ' A' ' 84' ' ' ASN . 0.3 OUTLIER -169.41 76.61 0.1 Allowed 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.586 -1.188 . . . . 0.0 108.835 179.645 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.468 ' C ' ' HB2' ' A' ' 105' ' ' SER . . . 69.37 106.04 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.615 0 CA-C-N 115.353 -0.839 . . . . 0.0 112.696 -178.926 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.643 ' N ' ' HB3' ' A' ' 105' ' ' SER . 5.3 tp -159.01 -141.77 0.09 Allowed 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 178.798 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -162.72 25.62 0.1 Allowed 'General case' 0 C--N 1.33 -0.241 0 O-C-N 122.204 -0.31 . . . . 0.0 111.693 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.887 HG23 ' O ' ' A' ' 48' ' ' ALA . 29.4 mt 63.36 5.04 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 179.576 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -87.18 -55.55 3.76 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.801 0.334 . . . . 0.0 111.474 -179.441 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.74 -28.34 61.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.152 -179.627 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.14 80.19 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.196 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.887 ' O ' HG23 ' A' ' 44' ' ' ILE . . . -151.52 132.5 14.26 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.714 0.292 . . . . 0.0 111.21 -179.634 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.2 mtt-85 -68.14 -177.18 0.81 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.745 0.307 . . . . 0.0 110.398 179.232 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.886 ' O ' HG23 ' A' ' 54' ' ' VAL . 0.9 OUTLIER -87.8 -35.92 17.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.001 0.429 . . . . 0.0 110.766 179.821 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.607 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 18.2 p -56.05 -62.78 1.47 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.171 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.865 ' OE1' ' HB1' ' A' ' 48' ' ' ALA . 0.0 OUTLIER -34.72 -67.08 0.15 Allowed 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.882 -179.811 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.641 ' HD2' HD11 ' A' ' 44' ' ' ILE . 2.7 ptpt -56.87 -46.75 81.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.418 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.886 HG23 ' O ' ' A' ' 50' ' ' GLU . 97.8 t -54.7 -41.32 55.39 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-O 121.046 0.45 . . . . 0.0 110.038 179.439 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.851 ' CZ ' ' HB1' ' A' ' 113' ' ' ALA . 1.9 t80 -61.63 -49.75 75.34 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.872 178.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.525 ' HB2' ' HB2' ' A' ' 108' ' ' MET . . . -50.44 -48.06 56.49 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.108 179.805 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -62.25 -47.02 86.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.639 179.581 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' THR . . . . . 0.564 HG21 HD22 ' A' ' 27' ' ' LEU . 24.0 p -63.7 -49.5 72.87 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.378 -179.696 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' VAL . . . . . 0.96 ' O ' HG23 ' A' ' 63' ' ' VAL . 14.0 p -65.67 -48.89 80.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.786 179.76 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.684 HD22 ' HG ' ' A' ' 103' ' ' LEU . 13.1 tp -50.25 -49.9 51.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.725 0.298 . . . . 0.0 110.774 179.588 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.6 m -63.93 -41.81 97.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.736 179.624 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' HIS . . . . . 0.587 ' HB3' HD22 ' A' ' 5' ' ' LEU . 0.1 OUTLIER -68.21 -20.86 64.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.961 179.756 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 63' ' ' VAL . . . . . 1.041 HG13 HG11 ' A' ' 66' ' ' VAL . 4.6 t -105.01 37.81 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.061 0.458 . . . . 0.0 111.121 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.484 ' O ' ' HB2' ' A' ' 65' ' ' ASN . . . -65.64 91.23 0.13 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.677 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.769 ' O ' HG22 ' A' ' 99' ' ' VAL . 10.0 m120 93.28 -61.11 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.679 -0.691 . . . . 0.0 112.22 179.514 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 1.041 HG11 HG13 ' A' ' 63' ' ' VAL . 33.7 m 39.03 -140.08 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -179.387 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' VAL . . . . . 0.851 HG22 ' CB ' ' A' ' 97' ' ' ASN . 4.6 p -175.62 67.42 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 CA-C-O 121.71 0.767 . . . . 0.0 111.215 179.63 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.791 HD23 ' HB3' ' A' ' 72' ' ' ASP . 2.4 mp -62.66 103.69 0.45 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.86 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.872 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 0.6 OUTLIER -78.42 -177.88 5.48 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.642 179.278 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -37.34 -37.42 0.19 Allowed 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.3 -179.257 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.526 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 2.5 tt0 -66.12 -65.43 0.68 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.987 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.791 ' HB3' HD23 ' A' ' 68' ' ' LEU . 82.3 m-20 -60.3 -28.09 67.83 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.087 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 36.5 m -64.0 -64.06 0.99 Allowed 'General case' 0 C--O 1.239 0.516 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 178.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.499 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . . . -56.68 -25.11 53.13 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 108.787 -0.819 . . . . 0.0 108.787 177.407 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 1.083 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.3 OUTLIER -59.35 -54.63 44.55 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 114.733 -1.121 . . . . 0.0 110.224 178.743 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.934 HD21 HD11 ' A' ' 116' ' ' LEU . 1.9 mt -64.49 -48.04 76.71 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.838 0.352 . . . . 0.0 110.181 179.272 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.641 HD12 ' C ' ' A' ' 77' ' ' LEU . 0.4 OUTLIER -63.83 -23.62 67.43 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.034 -179.765 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -78.37 -47.83 16.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.833 0.349 . . . . 0.0 110.883 179.792 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -64.6 -33.75 76.65 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.184 179.692 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' THR . . . . . 0.54 HG21 ' ND2' ' A' ' 86' ' ' ASN . 11.4 p -78.09 -62.8 1.56 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.943 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 77' ' ' LEU . 67.9 t -57.0 -24.36 20.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.128 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -47.14 -39.63 13.98 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.794 0.33 . . . . 0.0 110.936 179.792 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 175.36 163.58 0.29 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.052 179.811 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.466 ' CB ' ' HG2' ' A' ' 40' ' ' GLN . 5.6 m120 61.99 -173.84 0.14 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.221 179.675 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.512 ' N ' HD22 ' A' ' 85' ' ' LEU . 2.4 mm? -77.78 -175.66 4.04 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.396 -179.64 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.54 ' ND2' HG21 ' A' ' 80' ' ' THR . 58.9 t-20 -132.47 135.4 46.01 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.72 -179.706 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ASN . . . . . 0.518 ' HA ' ' HB2' ' A' ' 104' ' ' ARG . 2.2 p-10 -123.01 5.53 9.3 Favored 'General case' 0 C--O 1.243 0.738 0 CA-C-O 120.871 0.367 . . . . 0.0 111.968 -179.86 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.533 ' HA ' ' CB ' ' A' ' 102' ' ' SER . 1.3 m-85 -99.79 135.62 40.94 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 120.435 -0.506 . . . . 0.0 110.447 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.763 ' CG ' HG13 ' A' ' 101' ' ' VAL . 0.7 OUTLIER -107.47 142.44 37.33 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 -179.93 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.592 HD21 HD13 ' A' ' 76' ' ' LEU . 11.1 mt -132.23 147.24 52.4 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 113.337 0.865 . . . . 0.0 113.337 -176.92 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.47 127.81 34.09 Favored 'General case' 0 C--O 1.224 -0.261 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 177.845 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' SER . . . . . 0.715 ' O ' HG13 ' A' ' 93' ' ' VAL . 0.7 OUTLIER -104.39 145.95 29.53 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 113.955 1.094 . . . . 0.0 113.955 -177.428 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.715 HG13 ' O ' ' A' ' 92' ' ' SER . 4.9 m -166.62 -124.68 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-N 113.691 -1.595 . . . . 0.0 108.558 179.09 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 36.85 34.33 0.1 OUTLIER Glycine 0 C--N 1.336 0.564 0 C-N-CA 121.143 -0.551 . . . . 0.0 114.202 178.423 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ASN . . . . . 0.407 ' O ' ' ND2' ' A' ' 95' ' ' ASN . 1.5 p-10 40.64 34.54 0.25 Allowed 'General case' 0 C--O 1.231 0.131 0 CA-C-O 121.325 0.583 . . . . 0.0 110.945 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 140.39 -3.82 2.46 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.58 -179.026 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.872 ' HA ' ' HA ' ' A' ' 69' ' ' THR . 0.1 OUTLIER -112.8 166.36 11.44 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.702 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 98' ' ' SER . . . . . 0.531 ' O ' ' N ' ' A' ' 68' ' ' LEU . 3.1 t -140.19 163.02 33.85 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.482 0.658 . . . . 0.0 111.32 -179.517 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 0.769 HG22 ' O ' ' A' ' 65' ' ' ASN . 1.2 t -107.45 146.23 13.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-N 115.04 -0.982 . . . . 0.0 108.74 178.912 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.567 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.1 OUTLIER -103.87 114.36 28.56 Favored 'General case' 0 CA--C 1.513 -0.454 0 C-N-CA 119.766 -0.774 . . . . 0.0 112.136 -179.662 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 101' ' ' VAL . . . . . 0.763 HG13 ' CG ' ' A' ' 89' ' ' ASP . 0.9 OUTLIER -120.36 104.19 15.1 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.015 0 N-CA-C 104.288 -2.486 . . . . 0.0 104.288 175.453 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 102' ' ' SER . . . . . 0.628 ' O ' HD23 ' A' ' 103' ' ' LEU . 0.9 OUTLIER -141.39 152.51 44.39 Favored 'General case' 0 C--N 1.307 -1.263 0 C-N-CA 119.807 -0.757 . . . . 0.0 112.713 -174.907 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.684 ' HG ' HD22 ' A' ' 60' ' ' LEU . 0.4 OUTLIER 147.7 59.66 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 114.506 -1.224 . . . . 0.0 112.441 176.529 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.518 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -83.86 -6.38 59.41 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.308 -0.86 . . . . 0.0 108.739 177.434 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.643 ' HB3' ' N ' ' A' ' 42' ' ' LEU . 58.7 m -177.92 171.92 1.72 Allowed 'General case' 0 C--O 1.232 0.147 0 CA-C-N 114.553 -1.203 . . . . 0.0 108.105 179.258 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ASP . . . . . 0.555 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -104.74 101.88 11.48 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 119.693 -0.803 . . . . 0.0 112.754 -178.492 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLN . . . . . 0.616 ' NE2' ' HB2' ' A' ' 48' ' ' ALA . 4.4 mt-30 -169.76 162.99 9.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.273 177.534 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 108' ' ' MET . . . . . 0.603 ' HE2' ' HB3' ' A' ' 112' ' ' ASP . 0.3 OUTLIER -165.77 144.15 5.94 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.426 -0.51 . . . . 0.0 112.142 179.005 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 109' ' ' THR . . . . . 0.774 HG22 ' O ' ' A' ' 38' ' ' THR . 30.2 p -110.11 165.29 11.86 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.719 179.362 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' LEU . . . . . 0.791 HD23 HG23 ' A' ' 12' ' ' VAL . 6.5 mt -52.46 -59.18 4.74 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.584 179.615 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' GLN . . . . . 0.835 ' O ' HG23 ' A' ' 115' ' ' VAL . 2.0 tp-100 -47.67 -65.48 0.56 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.817 0.342 . . . . 0.0 110.634 179.577 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 112' ' ' ASP . . . . . 0.92 ' O ' HD22 ' A' ' 116' ' ' LEU . 16.5 m-20 -46.63 -45.98 19.49 Favored 'General case' 0 C--O 1.236 0.395 0 CA-C-O 121.477 0.656 . . . . 0.0 110.429 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 113' ' ' ALA . . . . . 0.851 ' HB1' ' CZ ' ' A' ' 55' ' ' PHE . . . -51.65 -63.32 1.17 Allowed 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.35 179.256 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' LYS . . . . . 0.572 ' HE3' ' CG1' ' A' ' 16' ' ' VAL . 0.0 OUTLIER -62.04 -20.05 63.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.281 179.902 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 1.083 HG22 ' CG ' ' A' ' 75' ' ' LYS . 74.2 t -65.06 -65.11 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.886 0 CA-C-O 122.013 0.911 . . . . 0.0 109.967 179.399 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.955 ' HB3' HG21 ' A' ' 63' ' ' VAL . 0.1 OUTLIER -61.62 -35.58 78.29 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.399 179.693 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 117' ' ' LEU . . . . . 0.916 HD21 HD23 ' A' ' 8' ' ' LEU . 0.3 OUTLIER -70.51 -24.24 62.8 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.9 179.36 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 118' ' ' GLU . . . . . 0.539 ' HA ' ' CD2' ' A' ' 9' ' ' HIS . 1.7 tt0 -69.35 -46.85 66.02 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 106.741 -1.578 . . . . 0.0 106.741 177.954 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 119' ' ' ALA . . . . . 0.495 ' CB ' ' HG ' ' A' ' 68' ' ' LEU . . . -77.52 -22.18 51.57 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 114.695 -1.139 . . . . 0.0 110.236 177.651 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 120' ' ' ALA . . . . . 1.049 ' HB1' HD21 ' A' ' 5' ' ' LEU . . . -75.06 -56.71 4.46 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.78 179.471 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.771 HD22 ' CG ' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -60.8 -37.43 81.93 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 178.208 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 122' ' ' ARG . . . . . 0.5 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.5 OUTLIER -60.99 -46.37 91.04 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.356 179.97 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.615 ' CG ' HG12 ' A' ' 67' ' ' VAL . 8.4 mm-40 -95.29 -19.5 19.93 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -177.762 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 124' ' ' GLU . . . . . 0.445 ' CG ' ' O ' ' A' ' 120' ' ' ALA . 2.9 mm-40 -95.32 -66.62 0.9 Allowed 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.867 0.691 . . . . 0.0 112.867 -178.393 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 1.2 p -96.07 -65.32 0.98 Allowed 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -178.172 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' GLY . . . . . 0.528 ' N ' ' O ' ' A' ' 121' ' ' LEU . . . 83.81 73.42 1.25 Allowed Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 110.182 -1.167 . . . . 0.0 110.182 -177.941 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 127' ' ' ALA . . . . . 0.503 ' HB3' ' O ' ' A' ' 126' ' ' GLY . . . 74.55 32.44 0.91 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 -177.418 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 128' ' ' ARG . . . . . 0.426 ' N ' ' OG ' ' A' ' 6' ' ' SER . 0.0 OUTLIER 77.68 112.92 0.07 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 114.823 -1.08 . . . . 0.0 110.931 -179.598 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . -92.55 19.62 49.58 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.572 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.0 m . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.893 179.983 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.088 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -176.43 75.69 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.861 0.362 . . . . 0.0 110.889 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 58.85 -172.62 0.1 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.802 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 204' ' ' PTR . . . . . 0.411 ' O ' ' N ' ' B' ' 206' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -57.05 82.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.096 -0.502 . . . . 0.0 112.141 -178.833 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 206' ' ' ASP . . . . . 0.411 ' N ' ' O ' ' B' ' 204' ' ' PTR . 0.1 OUTLIER 49.87 175.63 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.814 179.104 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 207' ' ' PRO . . . . . 0.586 ' HB3' HD22 ' A' ' 3' ' ' LEU . 77.7 Cg_endo -88.76 108.04 0.48 Allowed 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 122.925 2.417 . . . . 0.0 112.467 -179.845 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 208' ' ' PHE . . . . . 0.554 ' HB3' ' NE2' ' A' ' 11' ' ' GLN . 0.7 OUTLIER 35.95 -162.0 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.038 -0.528 . . . . 0.0 112.358 179.58 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 209' ' ' NH2 . . . . . 0.527 ' N ' ' CG ' ' B' ' 208' ' ' PHE . . . . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.649 -0.251 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . 0.572 ' ND2' HD21 ' A' ' 8' ' ' LEU . 7.1 p-10 . . . . . 0 CA--C 1.528 0.133 0 CA-C-O 120.678 0.275 . . . . 0.0 110.918 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.798 HD11 ' N ' ' A' ' 30' ' ' ASN . 5.1 mp -73.1 172.89 10.21 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.909 0.385 . . . . 0.0 110.497 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.4 p -88.62 135.68 33.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.077 179.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.532 HD21 ' HB3' ' A' ' 62' ' ' HIS . 2.9 mt -37.4 -62.02 0.55 Allowed 'General case' 0 CA--C 1.504 -0.792 0 CA-C-O 121.434 0.635 . . . . 0.0 111.712 -179.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -40.44 -65.01 0.45 Allowed 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 114.553 -1.203 . . . . 0.0 111.378 -179.192 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . 0.543 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 0.7 OUTLIER -61.63 -44.57 96.74 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.982 0.42 . . . . 0.0 109.95 178.873 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.867 ' HB3' HD22 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -45.41 -65.0 0.6 Allowed 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.791 178.87 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.66 ' CB ' HD22 ' A' ' 121' ' ' LEU . 61.1 t60 -52.77 -39.87 62.64 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.603 178.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.543 ' HB2' ' O ' ' A' ' 7' ' ' ASP . 8.3 mmt180 -56.94 -62.48 1.71 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.846 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.757 ' HG3' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -64.75 -53.26 49.93 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 120.299 -0.561 . . . . 0.0 111.168 179.894 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.924 ' O ' HG23 ' A' ' 16' ' ' VAL . 8.1 p -53.96 -51.07 49.12 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 C-N-CA 120.63 -0.428 . . . . 0.0 111.343 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.584 ' HA ' ' CE ' ' A' ' 114' ' ' LYS . 21.6 t -63.68 -31.19 72.28 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -179.552 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 20.0 tpp180 -70.99 -35.3 72.05 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 120.236 -0.585 . . . . 0.0 110.966 -178.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.776 HD12 ' HA ' ' A' ' 12' ' ' VAL . 0.1 OUTLIER -75.35 -52.66 10.28 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 119.974 -0.691 . . . . 0.0 110.593 179.841 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.924 HG23 ' O ' ' A' ' 12' ' ' VAL . 1.8 t -60.81 -55.14 26.6 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.96 -179.367 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -61.02 -17.83 54.37 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -178.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 15.9 pt20 -170.39 71.44 0.06 Allowed 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.527 -0.469 . . . . 0.0 111.977 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.479 ' HB2' ' HA ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER 170.3 -38.18 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.117 179.382 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.414 ' N ' ' O ' ' A' ' 15' ' ' LEU . 70.1 m -115.33 -24.03 8.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.54 -179.362 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 56.66 55.34 30.45 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.457 -0.877 . . . . 0.0 111.945 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.417 ' HA ' ' CG1' ' A' ' 16' ' ' VAL . 0.3 OUTLIER 59.97 82.9 0.14 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.136 0.493 . . . . 0.0 110.768 -179.544 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.421 ' O ' ' HB ' ' A' ' 109' ' ' THR . 0.1 OUTLIER -133.97 -151.9 0.46 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.703 179.851 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.671 ' HB ' ' HB3' ' A' ' 34' ' ' ASN . 0.2 OUTLIER -103.9 134.37 47.31 Favored 'General case' 0 CA--C 1.52 -0.184 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.179 179.609 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.406 ' CA ' ' HG ' ' A' ' 110' ' ' LEU . . . -104.5 141.01 15.19 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.399 -0.905 . . . . 0.0 112.619 -179.11 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.852 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -104.5 130.27 52.44 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 179.877 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.565 HD13 ' CD1' ' A' ' 55' ' ' PHE . 0.7 OUTLIER -111.12 153.17 26.09 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.296 0.57 . . . . 0.0 112.293 -178.468 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.403 ' HD2' ' NZ ' ' A' ' 26' ' ' LYS . 2.7 mtm180 161.2 61.35 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.188 179.559 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.769 ' C ' HD11 ' A' ' 3' ' ' LEU . . . 79.74 -0.34 82.31 Favored Glycine 0 N--CA 1.45 -0.379 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 -177.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.798 ' N ' HD11 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -165.93 165.84 17.87 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 -179.682 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.757 HG12 ' HG3' ' A' ' 11' ' ' GLN . 9.1 p -111.9 137.91 42.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.24 0.543 . . . . 0.0 111.074 178.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.852 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -125.39 165.72 17.89 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.783 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -103.93 127.89 51.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.295 0.569 . . . . 0.0 111.717 -179.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.671 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 50.3 t30 -116.3 115.93 26.81 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.628 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.68 -28.6 3.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.279 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -48.6 -72.6 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.207 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.541 ' C ' HG22 ' A' ' 38' ' ' THR . 57.9 p -86.95 -103.43 0.07 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.423 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.585 ' O ' HG21 ' A' ' 24' ' ' THR . 0.2 OUTLIER 164.66 -111.69 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.626 ' HB3' HG21 ' A' ' 24' ' ' THR . 0.1 OUTLIER 172.54 -164.61 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 179.98 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.581 ' N ' ' CG ' ' A' ' 39' ' ' PHE . 0.2 OUTLIER 160.34 37.6 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.078 0.551 . . . . 0.0 110.494 179.501 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.556 ' C ' ' HB2' ' A' ' 107' ' ' GLN . . . 77.72 -26.24 2.03 Favored Glycine 0 CA--C 1.526 0.727 0 CA-C-N 115.755 -0.657 . . . . 0.0 113.091 -179.159 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.509 HD13 ' HG3' ' A' ' 40' ' ' GLN . 1.8 mp -32.62 135.03 0.09 Allowed 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.61 HG23 ' HB2' ' A' ' 106' ' ' ASP . 3.4 m -95.39 36.08 1.27 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.422 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.597 HG22 ' O ' ' A' ' 44' ' ' ILE . 5.1 mp 66.02 0.0 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.079 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -74.92 -25.56 59.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.927 0.394 . . . . 0.0 110.761 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.5 t -101.33 -66.01 0.94 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.144 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -170.59 52.25 0.19 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.602 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.525 ' HB1' ' OE1' ' A' ' 107' ' ' GLN . . . -113.34 -178.73 3.45 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.015 0.436 . . . . 0.0 111.11 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.72 126.28 51.97 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.786 179.268 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.809 ' O ' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -46.97 -28.36 1.6 Allowed 'General case' 0 C--O 1.233 0.206 0 CA-C-O 120.98 0.419 . . . . 0.0 110.468 179.848 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . 0.536 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 82.7 p -59.22 -62.49 1.84 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.935 179.502 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.51 ' CB ' ' HG2' ' A' ' 107' ' ' GLN . 0.4 OUTLIER -42.65 -57.6 2.65 Favored 'General case' 0 C--O 1.231 0.082 0 CA-C-O 121.188 0.518 . . . . 0.0 110.435 179.639 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.433 ' HB3' HD11 ' A' ' 44' ' ' ILE . 0.1 OUTLIER -46.85 -61.9 1.64 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.88 179.151 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.809 HG23 ' O ' ' A' ' 50' ' ' GLU . 30.9 t -50.07 -46.86 24.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.812 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.736 ' O ' HG13 ' A' ' 59' ' ' VAL . 0.4 OUTLIER -58.95 -33.42 70.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.329 179.263 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.497 ' HA ' HG22 ' A' ' 59' ' ' VAL . . . -67.76 -43.91 78.71 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.847 179.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.1 mm-40 -67.42 -33.87 76.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.057 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.423 ' CG2' ' HB3' ' A' ' 2' ' ' ASN . 11.8 p -77.46 -41.29 40.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.061 -179.507 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.894 ' O ' HG22 ' A' ' 63' ' ' VAL . 21.0 m -73.49 -31.28 32.42 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.844 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.538 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.659 HD13 ' O ' ' A' ' 102' ' ' SER . 10.1 tp -77.84 -37.89 47.42 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-O 120.906 0.384 . . . . 0.0 110.101 178.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 6.3 t -67.73 -53.06 30.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.793 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . 0.532 ' HB3' HD21 ' A' ' 5' ' ' LEU . 2.0 m-70 -47.82 -50.17 26.88 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 120.791 0.329 . . . . 0.0 110.199 179.471 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 1.036 HG12 HG11 ' A' ' 66' ' ' VAL . 0.9 OUTLIER -68.38 -74.48 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.35 179.48 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.712 ' H ' HG23 ' A' ' 63' ' ' VAL . . . 60.91 13.95 4.88 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.506 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.457 ' CB ' ' O ' ' A' ' 64' ' ' ALA . 0.3 OUTLIER 159.72 -66.47 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 120.849 0.357 . . . . 0.0 111.644 -179.663 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 1.036 HG11 HG12 ' A' ' 63' ' ' VAL . 14.8 m 48.11 -127.66 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 115.79 -0.641 . . . . 0.0 112.248 -179.199 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.522 ' O ' ' O ' ' A' ' 98' ' ' SER . 5.9 p -174.54 -18.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 N-CA-C 113.107 0.781 . . . . 0.0 113.107 -179.303 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.822 HD23 ' HB3' ' A' ' 72' ' ' ASP . 3.5 mp 32.81 105.05 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 178.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 18.9 p -66.12 -153.42 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 177.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -68.64 -34.54 75.9 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.122 0.487 . . . . 0.0 110.114 179.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.44 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 0.8 OUTLIER -64.04 -65.77 0.63 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.362 -179.631 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.822 ' HB3' HD23 ' A' ' 68' ' ' LEU . 1.0 OUTLIER -50.92 -32.26 20.14 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.755 0.312 . . . . 0.0 110.936 -179.929 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 85.1 m -62.61 -63.51 1.2 Allowed 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.4 -24.43 59.99 Favored 'General case' 0 C--N 1.333 -0.116 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 177.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 1.087 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.2 OUTLIER -57.13 -65.42 0.62 Allowed 'General case' 0 C--O 1.236 0.36 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.514 179.074 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.845 HD21 HD11 ' A' ' 116' ' ' LEU . 0.5 OUTLIER -60.48 -42.22 95.82 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 178.913 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -54.15 -36.45 63.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.801 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -75.66 -60.45 2.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.321 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.58 -32.05 70.02 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.206 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 54.5 m . . . . . 0 C--N 1.328 -0.326 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.346 -179.644 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . 0.405 ' HA ' ' HB2' ' A' ' 104' ' ' ARG . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.181 0 CA-C-O 120.446 0.165 . . . . 0.0 110.774 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.522 ' CZ ' ' CG ' ' A' ' 112' ' ' ASP . 2.5 m-85 -96.59 141.8 29.42 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 121.038 0.447 . . . . 0.0 110.757 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.732 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.5 OUTLIER -117.06 140.29 49.67 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 179.732 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.841 HD23 ' HA ' ' A' ' 100' ' ' LEU . 34.0 mt -143.31 154.55 43.89 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -177.018 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.421 ' CG ' HG12 ' A' ' 99' ' ' VAL . 0.0 OUTLIER -143.77 131.9 21.82 Favored 'General case' 0 C--O 1.223 -0.334 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 177.176 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.665 ' O ' HG13 ' A' ' 93' ' ' VAL . 54.2 p -103.96 146.01 29.31 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 -176.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.665 HG13 ' O ' ' A' ' 92' ' ' SER . 10.4 m . . . . . 0 CA--C 1.541 0.614 0 CA-C-N 113.616 -1.629 . . . . 0.0 108.683 179.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.448 ' CB ' HG22 ' A' ' 67' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.225 -0.197 0 CA-C-O 120.697 0.284 . . . . 0.0 110.385 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.522 ' O ' ' O ' ' A' ' 67' ' ' VAL . 4.1 t -140.49 162.88 34.3 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.371 0.605 . . . . 0.0 110.834 -179.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.421 HG12 ' CG ' ' A' ' 91' ' ' ARG . 1.2 t -103.18 136.8 34.13 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.957 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 178.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.841 ' HA ' HD23 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -104.3 110.37 22.58 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-O 121.911 0.863 . . . . 0.0 113.032 -177.695 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.732 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -118.69 103.61 14.81 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.997 0 N-CA-C 103.878 -2.638 . . . . 0.0 103.878 175.023 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 0.659 ' O ' HD13 ' A' ' 60' ' ' LEU . 0.3 OUTLIER -139.75 154.59 47.46 Favored 'General case' 0 C--N 1.309 -1.192 0 C-N-CA 119.015 -1.074 . . . . 0.0 113.732 -174.756 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.548 HD23 ' O ' ' A' ' 102' ' ' SER . 0.0 OUTLIER 166.81 -91.38 0.0 OUTLIER 'General case' 0 N--CA 1.438 -1.063 0 CA-C-N 113.662 -1.608 . . . . 0.0 111.515 176.796 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.574 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 48.6 59.18 4.53 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 -179.532 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.574 ' CB ' ' O ' ' A' ' 104' ' ' ARG . 4.9 t 102.53 157.82 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 -176.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.61 ' HB2' HG23 ' A' ' 43' ' ' THR . 0.6 OUTLIER -104.95 100.87 10.47 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 119.211 -0.996 . . . . 0.0 112.799 -178.685 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.556 ' HB2' ' C ' ' A' ' 41' ' ' GLY . 1.5 tt0 -168.03 122.92 0.97 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.838 -1.074 . . . . 0.0 109.874 177.325 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.491 ' HG2' HG21 ' A' ' 59' ' ' VAL . 0.0 OUTLIER -122.8 164.46 18.33 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.172 0.51 . . . . 0.0 111.531 179.967 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . 0.524 HG22 HG23 ' A' ' 24' ' ' THR . 1.5 p -121.79 165.4 15.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.771 -179.63 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.815 ' HB3' HG22 ' A' ' 16' ' ' VAL . 5.5 mt -51.86 -49.87 62.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.778 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . 0.902 ' O ' HG23 ' A' ' 115' ' ' VAL . 1.5 tp60 -59.82 -64.05 1.09 Allowed 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.119 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 0.722 ' O ' HD22 ' A' ' 116' ' ' LEU . 24.8 m-20 -48.02 -44.87 31.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.901 179.434 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 0.548 ' HB1' ' CZ ' ' A' ' 55' ' ' PHE . . . -56.4 -54.2 48.42 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.08 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.584 ' CE ' ' HA ' ' A' ' 13' ' ' SER . 0.3 OUTLIER -62.5 -34.68 77.34 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.505 179.413 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 1.087 HG22 ' CG ' ' A' ' 75' ' ' LYS . 84.4 t -55.84 -65.48 0.37 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.827 0 CA-C-O 121.931 0.872 . . . . 0.0 111.299 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.845 HD11 HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -59.93 -37.75 80.4 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.311 -179.106 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.867 HD22 ' HB3' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -73.66 -21.36 60.3 Favored 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 120.505 -0.478 . . . . 0.0 111.621 -179.994 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.486 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 0.1 OUTLIER -69.17 -47.4 65.04 Favored 'General case' 0 CA--C 1.503 -0.83 0 N-CA-C 106.442 -1.688 . . . . 0.0 106.442 177.479 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.436 ' CB ' ' HG ' ' A' ' 68' ' ' LEU . . . -76.12 -25.31 55.26 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 114.747 -1.115 . . . . 0.0 109.909 177.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.827 ' HB3' ' HA ' ' A' ' 117' ' ' LEU . . . -69.8 -60.64 2.18 Favored 'General case' 0 CA--C 1.508 -0.666 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.979 179.395 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.66 HD22 ' CB ' ' A' ' 9' ' ' HIS . 0.2 OUTLIER -62.4 -39.39 93.09 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.193 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.58 ' N ' ' HG ' ' A' ' 121' ' ' LEU . 0.1 OUTLIER -52.37 -58.18 7.49 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.186 179.481 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 92.3 mm-40 -81.74 -26.37 34.59 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 -178.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . 0.42 ' CG ' ' O ' ' A' ' 120' ' ' ALA . 3.6 mm-40 -96.06 -66.65 0.89 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.847 1.054 . . . . 0.0 113.847 -178.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.33 -0.268 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -177.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . 0.518 ' C ' HD12 ' A' ' 3' ' ' LEU . 2.5 p30 . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.915 0.388 . . . . 0.0 111.078 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.714 ' HB2' HD13 ' A' ' 8' ' ' LEU . 2.6 mp -164.05 -75.23 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.278 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.411 ' O ' ' CB ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER 171.07 -170.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.726 -179.842 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.725 HD21 ' HB3' ' A' ' 62' ' ' HIS . 6.5 mt -95.52 -63.26 1.18 Allowed 'General case' 0 CA--C 1.505 -0.765 0 CA-C-O 121.293 0.568 . . . . 0.0 111.558 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.41 ' O ' ' HG3' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -59.54 -47.19 86.48 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 115.195 -0.911 . . . . 0.0 112.075 -178.162 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -65.59 -55.1 19.49 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.33 0.586 . . . . 0.0 110.021 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.744 HD23 ' CD2' ' A' ' 117' ' ' LEU . 8.6 tp -55.2 -45.7 75.86 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.102 179.019 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.448 ' HA ' HG12 ' A' ' 12' ' ' VAL . 76.4 t60 -54.4 -45.66 72.96 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.227 179.154 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.41 ' HG3' ' O ' ' A' ' 6' ' ' SER . 36.9 mtt180 -59.31 -52.88 63.74 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.594 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.522 ' HG3' HG13 ' A' ' 31' ' ' VAL . 3.3 tp-100 -57.31 -57.41 12.74 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 121.149 0.5 . . . . 0.0 110.706 179.461 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.967 HG23 HD13 ' A' ' 110' ' ' LEU . 7.4 p -58.83 -46.11 91.16 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.717 -179.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.76 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 35.9 t -55.34 -64.07 0.96 Allowed 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.954 -0.566 . . . . 0.0 112.002 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.464 ' O ' ' CG ' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -60.16 -32.78 71.37 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.056 -179.115 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.522 HD11 ' O ' ' A' ' 31' ' ' VAL . 9.7 mt -59.57 -65.37 0.68 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.925 -179.373 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.797 HG22 ' H ' ' A' ' 22' ' ' ASP . 0.5 OUTLIER -65.53 -24.99 35.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.144 -179.523 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.38 -4.88 47.65 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -178.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.464 ' CG ' ' O ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -140.38 23.9 2.31 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 120.392 -0.523 . . . . 0.0 112.382 179.558 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -177.69 -69.85 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.619 ' OG ' ' HB1' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -46.51 -53.06 12.02 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.703 -178.787 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 80.93 37.57 18.66 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.558 -0.83 . . . . 0.0 112.031 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.797 ' H ' HG22 ' A' ' 16' ' ' VAL . 7.7 t70 78.13 21.87 0.84 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.823 0.344 . . . . 0.0 110.715 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.28 -151.97 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.708 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.635 HG23 ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -103.51 165.35 11.09 Favored 'General case' 0 CA--C 1.519 -0.243 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 -179.987 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.641 ' HA3' HD22 ' A' ' 110' ' ' LEU . . . -127.58 156.18 20.4 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.041 -1.076 . . . . 0.0 113.909 -178.721 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.988 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -125.75 123.88 39.8 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.998 -0.601 . . . . 0.0 109.96 179.488 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.839 HD13 HG21 ' A' ' 58' ' ' THR . 2.6 tt -113.15 144.34 42.82 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.419 0.628 . . . . 0.0 111.922 -179.376 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.409 ' HD3' ' HD3' ' A' ' 26' ' ' LYS . 0.0 OUTLIER 169.77 54.23 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.729 179.672 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.612 ' O ' HD21 ' A' ' 3' ' ' LEU . . . 109.17 -19.31 29.88 Favored Glycine 0 N--CA 1.45 -0.433 0 N-CA-C 110.468 -1.053 . . . . 0.0 110.468 -177.673 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.481 ' N ' HD11 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -166.14 165.45 17.67 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 179.481 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.555 HG23 ' CE2' ' A' ' 55' ' ' PHE . 2.1 p -106.74 133.38 51.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 121.348 0.594 . . . . 0.0 110.836 178.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.988 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -123.52 166.27 15.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.404 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.619 ' HB1' ' OG ' ' A' ' 20' ' ' SER . . . -102.61 138.42 39.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.543 0.687 . . . . 0.0 112.381 -178.216 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.536 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 31.4 t30 -114.94 123.5 49.28 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 114.698 -1.137 . . . . 0.0 110.531 -179.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.1 mtmp? -135.86 21.96 3.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.068 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -119.02 -24.59 6.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.338 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 4.9 p -118.09 177.55 4.75 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.988 0.423 . . . . 0.0 111.105 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.409 ' O ' ' NE2' ' A' ' 40' ' ' GLN . 12.3 p -128.63 115.04 17.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.312 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.635 ' CD1' HG23 ' A' ' 24' ' ' THR . 4.2 p90 -68.45 -84.87 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.591 -179.138 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.553 ' N ' ' CG ' ' A' ' 39' ' ' PHE . 0.0 OUTLIER 63.96 54.45 1.72 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.382 0.673 . . . . 0.0 112.711 179.924 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.575 ' N ' HE21 ' A' ' 107' ' ' GLN . . . 69.2 -50.55 0.56 Allowed Glycine 0 CA--C 1.526 0.72 0 CA-C-N 116.088 -0.505 . . . . 0.0 113.095 179.618 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.821 HD11 ' CB ' ' A' ' 46' ' ' SER . 0.8 OUTLIER 3.94 125.75 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.454 1.101 . . . . 0.0 113.92 179.102 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.679 HG22 ' CG ' ' A' ' 106' ' ' ASP . 0.8 OUTLIER -91.2 56.98 3.28 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.976 -179.617 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.595 HG22 ' O ' ' A' ' 44' ' ' ILE . 1.8 mp 49.55 9.26 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 179.052 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -100.75 -56.78 2.25 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -178.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.821 ' CB ' HD11 ' A' ' 42' ' ' LEU . 0.3 OUTLIER -54.5 -26.79 33.65 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.741 -178.883 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 140.51 38.99 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.378 -0.915 . . . . 0.0 112.929 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.592 ' HB2' HD23 ' A' ' 42' ' ' LEU . . . -93.96 -167.04 1.61 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.799 0.333 . . . . 0.0 110.447 179.504 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.467 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 0.7 OUTLIER -128.94 146.86 50.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.574 179.664 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.814 ' O ' HG22 ' A' ' 54' ' ' VAL . 8.5 tt0 -53.14 -24.05 9.62 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.099 0.476 . . . . 0.0 110.706 179.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . 0.585 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -61.7 -65.25 0.72 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.454 -179.441 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.556 ' HB2' ' HG2' ' A' ' 107' ' ' GLN . 0.6 OUTLIER -53.23 -50.52 64.58 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.713 0.292 . . . . 0.0 111.783 -179.221 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.82 ' HD2' HG13 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -55.22 -57.13 13.03 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 111.716 0.265 . . . . 0.0 111.716 -179.35 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.82 HG13 ' HD2' ' A' ' 53' ' ' LYS . 15.7 m -54.36 -47.55 69.42 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 120.662 -0.415 . . . . 0.0 110.383 179.503 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.597 ' O ' HG23 ' A' ' 58' ' ' THR . 0.6 OUTLIER -48.37 -42.72 32.51 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.812 178.785 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.778 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -64.24 -44.95 90.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.316 178.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 50.6 mm-40 -56.73 -47.46 79.96 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.13 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.839 HG21 HD13 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -64.02 -64.08 0.98 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.309 -179.702 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.914 HG23 HD12 ' A' ' 117' ' ' LEU . 12.0 p -46.28 -51.73 3.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.971 -179.6 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.507 ' N ' HG13 ' A' ' 59' ' ' VAL . 0.4 OUTLIER -55.6 -49.17 73.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.815 0.341 . . . . 0.0 110.835 179.235 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.8 m -55.57 -60.6 3.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.239 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . 0.725 ' HB3' HD21 ' A' ' 5' ' ' LEU . 1.7 m170 -49.51 -37.36 26.31 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 121.094 0.473 . . . . 0.0 110.123 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.892 HG23 ' O ' ' A' ' 59' ' ' VAL . 40.8 t -75.64 -82.19 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.247 179.194 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.493 ' HB3' ' O ' ' A' ' 63' ' ' VAL . . . 72.62 -6.72 1.56 Allowed 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 178.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.538 ' OD1' HG13 ' A' ' 99' ' ' VAL . 6.5 m-20 153.46 -61.52 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.394 0.677 . . . . 0.0 109.365 -179.378 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.867 HG12 ' HB3' ' A' ' 123' ' ' GLN . 0.1 OUTLIER 44.23 -100.96 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 CA-C-N 115.243 -0.89 . . . . 0.0 112.842 178.903 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.743 HG22 ' HB3' ' A' ' 97' ' ' ASN . 0.3 OUTLIER 167.38 107.87 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.343 0.289 0 CA-C-O 121.594 0.711 . . . . 0.0 109.833 -179.519 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.842 HD11 ' HB2' ' A' ' 100' ' ' LEU . 0.1 OUTLIER -110.29 112.63 24.71 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.752 -178.071 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.563 HG22 HD22 ' A' ' 97' ' ' ASN . 11.0 p -83.37 178.7 7.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.608 -0.723 . . . . 0.0 110.788 179.291 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -41.0 -31.14 0.16 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.558 -179.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -68.97 -57.8 4.98 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.943 0.401 . . . . 0.0 110.396 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.655 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 65.4 m-20 -69.3 -39.87 78.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.722 179.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 62.1 m -61.3 -41.23 96.63 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-O 121.296 0.569 . . . . 0.0 109.622 178.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.501 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . . . -71.24 -30.74 66.69 Favored 'General case' 0 CA--C 1.512 -0.506 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 177.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 1.074 ' CG ' HG12 ' A' ' 115' ' ' VAL . 0.3 OUTLIER -55.01 -50.36 69.22 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 114.322 -1.308 . . . . 0.0 109.426 177.92 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 1.087 HD13 HD11 ' A' ' 90' ' ' LEU . 1.4 mt -67.29 -56.75 8.49 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.466 179.205 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.608 HD12 ' C ' ' A' ' 77' ' ' LEU . 0.6 OUTLIER -54.57 -26.85 34.85 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.476 179.808 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -72.53 -54.81 8.18 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.232 179.213 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . 0.411 ' OG ' ' HG3' ' A' ' 111' ' ' GLN . 0.0 OUTLIER -52.65 -36.19 56.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.676 179.551 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 86.0 m . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.788 -179.549 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . 0.61 ' HA ' ' HB2' ' A' ' 104' ' ' ARG . 9.7 t-20 . . . . . 0 C--O 1.238 0.47 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.758 ' CD2' HD22 ' A' ' 76' ' ' LEU . 6.9 p90 -96.73 160.57 14.3 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 121.232 0.539 . . . . 0.0 112.397 -178.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.697 ' HB3' ' O ' ' A' ' 101' ' ' VAL . 0.8 OUTLIER -131.9 140.7 49.14 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 178.593 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 1.087 HD11 HD13 ' A' ' 76' ' ' LEU . 8.0 mt -133.94 155.27 50.23 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 -176.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.67 ' O ' ' HB3' ' A' ' 98' ' ' SER . 0.0 OUTLIER -139.96 150.25 44.27 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.293 178.439 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.79 ' O ' HG13 ' A' ' 93' ' ' VAL . 33.7 p -104.47 159.33 15.82 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 121.77 0.795 . . . . 0.0 112.648 -179.02 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.79 HG13 ' O ' ' A' ' 92' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.436 -1.146 0 CA-C-N 113.853 -1.521 . . . . 0.0 108.199 -179.389 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.743 ' HB3' HG22 ' A' ' 67' ' ' VAL . 0.5 OUTLIER . . . . . 0 N--CA 1.438 -1.049 0 N-CA-C 106.86 -1.533 . . . . 0.0 106.86 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.717 ' O ' HD12 ' A' ' 68' ' ' LEU . 3.5 m -147.48 159.85 43.26 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 119.343 -0.943 . . . . 0.0 111.39 -178.274 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.538 HG13 ' OD1' ' A' ' 65' ' ' ASN . 1.2 t -103.56 140.42 21.78 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 179.56 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.924 HD22 HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -103.57 111.07 23.37 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-O 121.764 0.792 . . . . 0.0 112.899 -178.197 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.697 ' O ' ' HB3' ' A' ' 89' ' ' ASP . 0.1 OUTLIER -123.88 103.52 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.194 0 N-CA-C 104.202 -2.518 . . . . 0.0 104.202 175.003 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 0.607 ' O ' ' HB2' ' A' ' 103' ' ' LEU . 12.2 p -140.37 142.24 35.54 Favored 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 119.669 -0.813 . . . . 0.0 112.068 -175.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.814 HD13 ' O ' ' A' ' 105' ' ' SER . 0.2 OUTLIER 147.74 79.29 0.0 OUTLIER 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.784 177.531 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.61 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -98.31 28.43 4.1 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 177.487 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.814 ' O ' HD13 ' A' ' 103' ' ' LEU . 6.9 m 148.83 179.21 0.0 OUTLIER 'General case' 0 C--N 1.343 0.293 0 CA-C-N 113.749 -1.569 . . . . 0.0 107.047 -178.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.679 ' CG ' HG22 ' A' ' 43' ' ' THR . 0.0 OUTLIER -104.14 101.34 11.09 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 119.1 0.864 . . . . 0.0 111.908 -178.973 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.778 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 0.6 OUTLIER -169.46 165.05 10.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.308 178.434 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.549 ' HB2' ' HB2' ' A' ' 56' ' ' ALA . 1.8 tpt -165.21 142.46 5.88 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.3 0.572 . . . . 0.0 112.008 178.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . 0.551 HG22 ' CE2' ' A' ' 39' ' ' PHE . 0.5 OUTLIER -104.83 159.55 15.7 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.709 179.112 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.967 HD13 HG23 ' A' ' 12' ' ' VAL . 0.9 OUTLIER -46.44 -55.75 6.96 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.357 0.599 . . . . 0.0 109.977 179.411 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . 0.879 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 2.2 tp-100 -53.05 -66.7 0.34 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.791 -179.214 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 0.84 ' O ' HG22 ' A' ' 115' ' ' VAL . 7.5 m-20 -44.61 -37.57 3.7 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.525 0.679 . . . . 0.0 110.746 -179.699 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 0.554 ' HB3' HG21 ' A' ' 12' ' ' VAL . . . -62.63 -44.24 96.79 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.384 179.205 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.879 ' HD2' ' HA ' ' A' ' 111' ' ' GLN . 0.0 OUTLIER -79.28 -21.9 45.41 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.77 -179.578 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 1.074 HG12 ' CG ' ' A' ' 75' ' ' LYS . 13.2 m -69.55 -48.87 63.64 Favored 'Isoleucine or valine' 0 C--O 1.242 0.688 0 CA-C-O 122.165 0.984 . . . . 0.0 109.209 179.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.856 ' HB3' HG21 ' A' ' 63' ' ' VAL . 1.2 mp -71.5 -36.82 71.24 Favored 'General case' 0 N--CA 1.433 -1.3 0 CA-C-N 114.148 -1.387 . . . . 0.0 110.068 179.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.914 HD12 HG23 ' A' ' 59' ' ' VAL . 0.2 OUTLIER -75.83 -20.12 58.39 Favored 'General case' 0 CA--C 1.51 -0.578 0 C-N-CA 120.421 -0.512 . . . . 0.0 110.767 178.935 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.45 ' HA ' HD23 ' A' ' 121' ' ' LEU . 28.6 tp10 -71.66 -50.23 32.42 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 177.531 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.526 ' HA ' ' HB3' ' A' ' 122' ' ' ARG . . . -72.28 -33.27 67.31 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.863 177.287 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.813 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -60.82 -64.82 0.82 Allowed 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.824 179.367 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.49 HD23 ' O ' ' A' ' 117' ' ' LEU . 0.0 OUTLIER -58.42 -31.5 67.78 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.716 179.077 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.526 ' HB3' ' HA ' ' A' ' 119' ' ' ALA . 0.0 OUTLIER -59.5 -65.15 0.72 Allowed 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.958 -179.798 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.867 ' HB3' HG12 ' A' ' 66' ' ' VAL . 1.4 tm0? -86.71 -4.7 59.21 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 113.376 0.88 . . . . 0.0 113.376 -177.486 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . 0.573 ' HG2' HG13 ' A' ' 66' ' ' VAL . 5.0 mm-40 -93.83 -67.34 0.86 Allowed 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 119.895 -0.722 . . . . 0.0 111.614 -179.675 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 9.8 p . . . . . 0 C--N 1.323 -0.558 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.492 -179.832 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.6 p30 . . . . . 0 CA--C 1.531 0.217 0 CA-C-O 120.81 0.338 . . . . 0.0 111.373 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.755 HD11 ' C ' ' A' ' 29' ' ' GLY . 5.7 mp -73.23 -72.5 0.25 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.341 0.591 . . . . 0.0 110.455 179.374 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 167.73 -159.21 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.109 -0.951 . . . . 0.0 109.087 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.78 HD21 ' HB1' ' A' ' 120' ' ' ALA . 0.0 OUTLIER -95.25 -60.98 1.55 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.887 0.375 . . . . 0.0 111.413 179.567 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 27.8 p -53.74 -45.05 70.41 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.888 -0.597 . . . . 0.0 112.242 -179.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . 0.432 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -73.18 -62.47 1.46 Allowed 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 120.901 0.381 . . . . 0.0 110.192 -179.679 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 1.055 HD23 HD21 ' A' ' 117' ' ' LEU . 6.5 tp -45.05 -45.74 11.04 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.313 179.203 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.765 ' CG ' HD22 ' A' ' 121' ' ' LEU . 63.4 t60 -62.16 -48.78 78.58 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.581 178.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.441 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 4.1 mmt180 -48.92 -54.92 13.46 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.755 -179.416 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.615 ' OE1' HD22 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -67.5 -54.89 16.24 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -179.353 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.783 HG23 HD23 ' A' ' 110' ' ' LEU . 8.6 p -55.98 -46.87 80.68 Favored 'Isoleucine or valine' 0 C--O 1.242 0.698 0 CA-C-O 121.292 0.568 . . . . 0.0 111.18 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.549 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 9.2 t -58.99 -57.97 10.74 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.965 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -58.13 -25.73 61.77 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.697 -179.863 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.567 HD22 ' HB2' ' A' ' 33' ' ' ALA . 12.9 mt -67.97 -65.37 0.7 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.687 -179.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.599 HG23 HD13 ' A' ' 110' ' ' LEU . 1.4 t -73.43 -25.0 20.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 120.148 -0.621 . . . . 0.0 110.977 -179.538 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.426 ' CG ' ' O ' ' A' ' 13' ' ' SER . 7.2 mm-40 -75.96 -23.42 55.37 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.253 179.384 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -154.3 57.87 0.71 Allowed 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 120.73 0.3 . . . . 0.0 111.274 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 175.89 -61.8 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.771 ' OG ' ' HB1' ' A' ' 33' ' ' ALA . 20.4 m -85.44 -77.85 0.28 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.894 0.378 . . . . 0.0 111.97 -178.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . 0.565 ' H ' ' HA ' ' A' ' 16' ' ' VAL . . . 118.57 -36.64 3.52 Favored Glycine 0 N--CA 1.449 -0.473 0 N-CA-C 111.553 -0.619 . . . . 0.0 111.553 -179.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.405 ' O ' ' O ' ' A' ' 23' ' ' CYS . 0.2 OUTLIER -177.08 5.24 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.719 0.295 . . . . 0.0 111.636 179.895 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.633 ' HB2' HD12 ' A' ' 110' ' ' LEU . 88.5 m -52.65 -165.96 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.495 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.617 ' CB ' ' HB3' ' A' ' 34' ' ' ASN . 0.2 OUTLIER -103.77 164.47 11.66 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.142 179.758 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -109.21 136.26 13.44 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.301 -0.952 . . . . 0.0 113.716 -178.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.918 ' HB3' ' HB3' ' A' ' 32' ' ' ALA . 2.1 tmmm? -105.68 116.65 32.31 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 178.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.795 HD22 HG12 ' A' ' 54' ' ' VAL . 8.6 tt -104.11 146.77 28.26 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.033 0.444 . . . . 0.0 111.849 -179.05 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.512 ' NH2' HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER 153.81 64.59 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.271 -179.863 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.755 ' C ' HD11 ' A' ' 3' ' ' LEU . . . 89.94 -12.43 67.55 Favored Glycine 0 CA--C 1.519 0.289 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.764 -178.56 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.685 ' N ' HD11 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -165.9 165.16 18.39 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.66 HG21 ' HB ' ' A' ' 12' ' ' VAL . 0.1 OUTLIER -110.37 121.35 63.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 C-N-CA 120.439 -0.504 . . . . 0.0 109.939 177.781 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.918 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . . . -104.07 166.5 10.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.771 -179.217 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.778 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -103.15 104.76 14.94 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.26 0.553 . . . . 0.0 111.72 -178.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.617 ' HB3' ' CB ' ' A' ' 24' ' ' THR . 49.5 t30 -76.25 86.75 3.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.998 179.303 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.91 74.49 2.64 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.836 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 179.62 -36.66 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.46 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.68 ' O ' HG23 ' A' ' 38' ' ' THR . 0.2 OUTLIER -100.72 -166.62 1.33 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.794 179.862 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.68 HG23 ' O ' ' A' ' 37' ' ' THR . 0.9 OUTLIER -168.83 102.22 0.39 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.682 179.882 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.66 ' CZ ' ' HA ' ' A' ' 48' ' ' ALA . 20.6 m-30 -114.92 145.03 42.65 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -178.209 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.477 ' O ' ' HG2' ' A' ' 40' ' ' GLN . 2.1 pm0 -153.75 65.23 0.73 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.229 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.468 ' H ' ' HB3' ' A' ' 107' ' ' GLN . . . 78.31 106.39 0.19 Allowed Glycine 0 CA--C 1.519 0.332 0 CA-C-N 115.352 -0.84 . . . . 0.0 113.084 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.68 ' N ' ' HB3' ' A' ' 105' ' ' SER . 0.0 OUTLIER -154.81 -135.23 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 178.86 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.503 ' H ' HD12 ' A' ' 42' ' ' LEU . 0.1 OUTLIER -170.52 35.28 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 O-C-N 121.859 -0.525 . . . . 0.0 111.493 -179.656 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.743 ' HA ' ' HB3' ' A' ' 48' ' ' ALA . 4.9 mt 63.29 3.49 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -88.63 -56.39 3.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.916 0.389 . . . . 0.0 110.752 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.447 ' HB2' HD11 ' A' ' 42' ' ' LEU . 1.4 t -60.39 -22.59 63.51 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.727 179.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 135.5 46.6 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.295 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.872 ' HB2' ' OE1' ' A' ' 107' ' ' GLN . . . -102.68 -169.02 1.6 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.087 0.47 . . . . 0.0 111.457 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.8 142.08 28.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.977 179.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.607 ' O ' HG23 ' A' ' 54' ' ' VAL . 10.1 tt0 -44.52 -29.27 0.69 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.818 0.342 . . . . 0.0 111.654 -179.324 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . 0.416 ' CB ' ' HG2' ' A' ' 26' ' ' LYS . 5.2 m -56.54 -65.18 0.65 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.742 -179.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.437 ' HG3' ' O ' ' A' ' 108' ' ' MET . 0.7 OUTLIER -53.77 -63.77 1.04 Allowed 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 111.911 0.338 . . . . 0.0 111.911 -179.164 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.649 ' CE ' HD11 ' A' ' 44' ' ' ILE . 0.7 OUTLIER -44.78 -51.89 8.98 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 120.686 0.279 . . . . 0.0 111.426 -179.802 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.795 HG12 HD22 ' A' ' 27' ' ' LEU . 74.9 t -58.81 -34.32 51.87 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 CA-C-O 121.055 0.455 . . . . 0.0 109.788 179.188 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.699 ' HA ' HD13 ' A' ' 27' ' ' LEU . 0.3 OUTLIER -63.67 -46.37 85.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.737 178.883 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.782 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -57.51 -46.61 83.58 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.455 179.195 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.436 ' OE1' HD11 ' A' ' 103' ' ' LEU . 13.8 mm-40 -62.91 -45.32 93.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.451 179.554 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.461 HG21 HD11 ' A' ' 27' ' ' LEU . 59.5 m -59.86 -57.76 11.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.917 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.96 HG23 HD12 ' A' ' 117' ' ' LEU . 7.7 p -59.04 -48.7 85.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.811 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.81 HD22 ' CD2' ' A' ' 103' ' ' LEU . 12.9 tp -54.83 -34.28 62.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.906 0.384 . . . . 0.0 110.615 179.516 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 49.2 m -72.27 -50.8 24.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.156 -179.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . 0.605 ' ND1' HD23 ' A' ' 5' ' ' LEU . 0.4 OUTLIER -66.63 -25.09 66.42 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 120.928 0.394 . . . . 0.0 110.733 -179.54 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 1.089 HG13 HG11 ' A' ' 66' ' ' VAL . 7.0 t -98.66 31.2 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.489 179.188 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.57 ' O ' ' HB2' ' A' ' 65' ' ' ASN . . . -68.85 61.73 0.1 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.288 -179.299 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.685 ' O ' HG22 ' A' ' 99' ' ' VAL . 0.7 OUTLIER 142.19 -73.13 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.095 0.558 . . . . 0.0 111.407 179.722 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 1.089 HG11 HG13 ' A' ' 63' ' ' VAL . 29.2 m 39.55 -146.15 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.912 -179.092 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.484 ' O ' ' O ' ' A' ' 98' ' ' SER . 4.1 p -158.51 -24.02 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 N-CA-C 112.284 0.476 . . . . 0.0 112.284 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.737 HD12 ' O ' ' A' ' 98' ' ' SER . 0.7 OUTLIER 36.89 92.6 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 179.093 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 15.7 p -64.34 177.02 0.92 Allowed 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 178.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -42.21 -33.2 0.57 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.807 0.337 . . . . 0.0 111.329 -179.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -65.27 -63.81 1.01 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.468 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.675 ' HB3' HD23 ' A' ' 68' ' ' LEU . 48.5 m-20 -59.85 -33.51 71.89 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.859 0.362 . . . . 0.0 110.472 179.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.582 HG23 ' HB3' ' A' ' 98' ' ' SER . 2.1 m -56.48 -62.81 1.47 Allowed 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 178.596 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -57.78 -27.48 63.11 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.449 0.642 . . . . 0.0 109.28 177.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 1.085 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.1 OUTLIER -56.99 -65.15 0.67 Allowed 'General case' 0 C--O 1.238 0.469 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.302 178.956 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 1.043 HD21 HD11 ' A' ' 116' ' ' LEU . 0.5 OUTLIER -56.21 -39.06 71.87 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.434 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.96 -49.18 74.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.398 179.522 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -60.69 -58.1 9.89 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.423 -179.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.65 -61.6 1.99 Allowed 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.566 -179.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.533 HG22 ' O ' ' A' ' 76' ' ' LEU . 0.7 OUTLIER . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.772 -179.265 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . 0.467 ' HA ' ' HB2' ' A' ' 104' ' ' ARG . 25.8 t30 . . . . . 0 C--O 1.241 0.645 0 CA-C-O 121.311 0.577 . . . . 0.0 110.632 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.548 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 4.1 m-85 -106.94 142.26 36.85 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.914 -179.01 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.666 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.2 OUTLIER -110.4 150.76 28.35 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 115.299 -0.864 . . . . 0.0 108.982 -179.4 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.925 HD21 HD13 ' A' ' 76' ' ' LEU . 2.0 mt -138.74 156.17 47.61 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -177.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.602 ' O ' ' CB ' ' A' ' 98' ' ' SER . 56.2 mmm-85 -128.19 149.8 50.29 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 114.695 -1.138 . . . . 0.0 108.536 177.866 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.79 ' O ' HG13 ' A' ' 93' ' ' VAL . 53.4 p -103.76 154.29 19.73 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.985 0.898 . . . . 0.0 113.065 -178.302 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.79 HG13 ' O ' ' A' ' 92' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.433 -1.316 0 CA-C-N 113.594 -1.639 . . . . 0.0 107.531 -179.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.558 ' O ' ' O ' ' A' ' 93' ' ' VAL . 0.2 OUTLIER . . . . . 0 N--CA 1.454 -0.24 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.737 ' O ' HD12 ' A' ' 68' ' ' LEU . 0.6 OUTLIER -146.78 161.86 39.76 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.528 0.68 . . . . 0.0 111.451 179.942 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.685 HG22 ' O ' ' A' ' 65' ' ' ASN . 0.5 OUTLIER -103.87 155.04 5.76 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.176 179.604 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.708 HD22 ' HG ' ' A' ' 116' ' ' LEU . 1.4 tp -103.05 108.89 20.24 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-O 121.937 0.875 . . . . 0.0 112.389 -179.319 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.666 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -122.12 105.19 15.89 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.027 0 N-CA-C 104.073 -2.566 . . . . 0.0 104.073 175.49 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 0.742 ' O ' ' HB2' ' A' ' 103' ' ' LEU . 0.1 OUTLIER -144.34 165.15 28.72 Favored 'General case' 0 C--N 1.307 -1.265 0 C-N-CA 119.01 -1.076 . . . . 0.0 113.734 -173.917 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.81 ' CD2' HD22 ' A' ' 60' ' ' LEU . 0.5 OUTLIER 132.57 70.85 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 113.469 -1.696 . . . . 0.0 112.533 176.465 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.467 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -98.32 13.21 32.25 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.757 -1.11 . . . . 0.0 108.132 177.001 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.68 ' HB3' ' N ' ' A' ' 42' ' ' LEU . 5.0 m 160.15 172.07 0.01 OUTLIER 'General case' 0 C--O 1.231 0.099 0 CA-C-N 114.108 -1.406 . . . . 0.0 107.335 -179.151 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.505 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.4 OUTLIER -104.75 101.7 11.3 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 119.61 -0.836 . . . . 0.0 112.194 -178.965 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.872 ' OE1' ' HB2' ' A' ' 48' ' ' ALA . 1.6 mt-30 -169.6 165.23 10.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.776 178.024 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.476 ' HB3' ' HB3' ' A' ' 55' ' ' PHE . 0.0 OUTLIER -165.56 138.14 4.24 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.12 0.486 . . . . 0.0 111.799 178.48 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . 0.549 ' CG2' HG23 ' A' ' 24' ' ' THR . 0.1 OUTLIER -103.91 159.58 15.53 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.38 178.759 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.783 HD23 HG23 ' A' ' 12' ' ' VAL . 6.8 mt -46.92 -55.55 7.87 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 121.174 -0.211 . . . . 0.0 110.908 -179.481 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . 0.894 ' O ' HG23 ' A' ' 115' ' ' VAL . 2.1 tp60 -46.87 -65.52 0.55 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.691 0.281 . . . . 0.0 110.826 179.708 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 0.907 ' O ' HD22 ' A' ' 116' ' ' LEU . 58.9 m-20 -45.52 -54.14 7.94 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 121.158 0.504 . . . . 0.0 110.867 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 0.479 ' HB3' HG21 ' A' ' 12' ' ' VAL . . . -44.31 -64.94 0.58 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.944 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.583 ' NZ ' ' HB ' ' A' ' 16' ' ' VAL . 0.0 OUTLIER -64.97 -22.08 66.94 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.473 -179.847 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 1.085 HG22 ' CG ' ' A' ' 75' ' ' LYS . 53.1 t -60.06 -64.94 0.51 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.815 0 CA-C-O 121.995 0.902 . . . . 0.0 109.786 179.535 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 1.043 HD11 HD21 ' A' ' 76' ' ' LEU . 0.2 OUTLIER -64.05 -35.83 82.02 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.85 179.67 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 1.055 HD21 HD23 ' A' ' 8' ' ' LEU . 0.4 OUTLIER -70.86 -19.14 62.66 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-O 121.044 0.449 . . . . 0.0 110.812 179.437 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.578 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 6.9 tp10 -75.34 -47.5 27.43 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 106.598 -1.63 . . . . 0.0 106.598 177.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.552 ' HB1' ' H ' ' A' ' 68' ' ' LEU . . . -77.93 -18.19 56.37 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 114.606 -1.179 . . . . 0.0 111.08 178.303 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.891 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -82.44 -52.17 7.14 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.186 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.765 HD22 ' CG ' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -63.85 -30.06 71.19 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 178.148 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.578 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 4.3 ttm-85 -71.91 -55.98 6.53 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.422 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -92.7 -29.87 15.84 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 -177.024 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . 0.406 ' CB ' ' O ' ' A' ' 120' ' ' ALA . 4.4 mm-40 -75.73 -65.99 0.84 Allowed 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.514 -0.474 . . . . 0.0 112.038 -178.382 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.325 -0.482 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.97 -178.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.1 p30 . . . . . 0 C--O 1.232 0.157 0 CA-C-O 120.929 0.395 . . . . 0.0 111.278 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.858 HD11 ' HB2' ' A' ' 7' ' ' ASP . 0.0 OUTLIER -91.38 -66.64 0.91 Allowed 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.405 -179.668 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.682 ' N ' HD13 ' A' ' 3' ' ' LEU . 39.9 t 172.81 -169.18 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 179.391 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 1.004 HD21 ' CB ' ' A' ' 120' ' ' ALA . 0.0 OUTLIER -96.7 -65.42 0.97 Allowed 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.661 -0.416 . . . . 0.0 111.406 179.049 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.4 p -51.18 -49.01 61.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.695 -179.078 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . 0.858 ' HB2' HD11 ' A' ' 3' ' ' LEU . 2.9 m-20 -67.9 -44.59 76.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.904 0.383 . . . . 0.0 110.19 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 1.101 HD23 HD21 ' A' ' 117' ' ' LEU . 18.6 tp -61.53 -64.75 0.84 Allowed 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.279 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.916 ' CD2' HD22 ' A' ' 121' ' ' LEU . 71.7 t60 -45.19 -50.53 11.43 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.392 0.615 . . . . 0.0 109.865 178.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.452 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 17.3 mmt85 -56.39 -51.43 68.37 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.298 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 1.139 ' HG3' HG12 ' A' ' 31' ' ' VAL . 4.6 pt20 -71.05 -53.31 15.14 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.728 -179.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.883 ' CA ' HG11 ' A' ' 31' ' ' VAL . 10.0 p -55.58 -50.04 69.5 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-O 120.705 0.288 . . . . 0.0 111.455 179.331 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.47 ' N ' HG13 ' A' ' 12' ' ' VAL . 4.6 t -64.51 -43.66 93.35 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.354 179.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.452 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -53.79 -43.92 69.69 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -179.441 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.634 HD21 HG13 ' A' ' 31' ' ' VAL . 0.1 OUTLIER -75.36 -51.13 13.88 Favored 'General case' 0 CA--C 1.517 -0.29 0 C-N-CA 119.879 -0.728 . . . . 0.0 111.102 -179.692 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.819 HG13 ' NZ ' ' A' ' 114' ' ' LYS . 8.8 p -73.92 -4.83 5.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 113.569 0.951 . . . . 0.0 113.569 -178.293 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.433 ' HG2' ' CE ' ' A' ' 114' ' ' LYS . 5.9 mm-40 -93.38 -4.71 50.98 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.221 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -153.34 -40.53 0.1 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.694 0.283 . . . . 0.0 111.278 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -89.45 -66.7 0.9 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.751 0.31 . . . . 0.0 111.268 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.767 ' CB ' HD13 ' A' ' 110' ' ' LEU . 0.7 OUTLIER -69.77 -32.74 71.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.853 -179.827 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 76.22 -56.23 3.21 Favored Glycine 0 CA--C 1.52 0.368 0 C-N-CA 120.954 -0.641 . . . . 0.0 113.67 179.118 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.471 ' HA ' ' CG2' ' A' ' 16' ' ' VAL . 0.1 OUTLIER -176.92 8.31 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.701 0.25 . . . . 0.0 111.635 -179.158 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.418 ' O ' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -56.49 -152.88 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.048 -179.599 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.676 HG21 ' HB2' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -103.62 153.16 20.92 Favored 'General case' 0 CA--C 1.52 -0.187 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.34 -179.871 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.455 ' CA ' ' HG ' ' A' ' 110' ' ' LEU . . . -113.17 124.95 6.79 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.337 -0.935 . . . . 0.0 113.459 -178.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.698 ' HG3' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -109.01 127.78 54.38 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 178.483 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 1.02 ' HB3' ' HA ' ' A' ' 31' ' ' VAL . 0.4 OUTLIER -164.02 165.91 22.01 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 114.864 1.431 . . . . 0.0 114.864 -178.08 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.0 mpt_? -142.65 -48.03 0.33 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 113.226 -1.806 . . . . 0.0 108.526 177.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.415 ' O ' ' HB2' ' A' ' 3' ' ' LEU . . . -130.74 4.53 5.78 Favored Glycine 0 CA--C 1.524 0.621 0 CA-C-N 115.054 -0.976 . . . . 0.0 110.752 177.468 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.799 ' O ' ' CB ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -166.36 157.41 12.94 Favored 'General case' 0 C--O 1.222 -0.372 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 -179.992 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 1.139 HG12 ' HG3' ' A' ' 11' ' ' GLN . 8.8 p -102.36 131.65 50.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 122.179 0.99 . . . . 0.0 113.22 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.698 ' HB3' ' HG3' ' A' ' 26' ' ' LYS . . . -113.38 166.0 11.91 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 113.407 -1.724 . . . . 0.0 109.411 178.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.578 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -103.3 135.5 44.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.306 0.574 . . . . 0.0 111.785 -178.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.486 ' ND2' ' CE2' ' A' ' 39' ' ' PHE . 28.9 t30 -116.02 117.82 31.19 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.679 -179.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -123.05 -31.26 3.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.743 179.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -61.01 -54.45 44.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.523 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.419 ' HB ' ' CE1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -83.65 -166.13 1.31 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.355 179.596 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 35.8 p -154.54 101.05 2.31 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.887 0.375 . . . . 0.0 111.441 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.772 ' O ' HG22 ' A' ' 109' ' ' THR . 1.6 m-85 -113.98 127.96 56.18 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.833 179.191 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -118.04 -35.01 3.97 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.265 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.58 ' HA3' ' HB3' ' A' ' 87' ' ' ASN . . . 171.54 -14.89 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.891 -0.671 . . . . 0.0 113.412 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.724 HD21 ' HB2' ' A' ' 48' ' ' ALA . 0.1 OUTLIER -44.75 174.0 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 117.332 0.566 . . . . 0.0 111.834 -179.799 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.521 HG22 ' O ' ' A' ' 43' ' ' THR . 20.8 m -109.72 46.61 1.0 Allowed 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -178.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.833 HD11 ' HE3' ' A' ' 53' ' ' LYS . 0.7 OUTLIER 59.94 -5.33 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 179.244 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.443 ' H ' ' C ' ' A' ' 43' ' ' THR . . . -63.76 -64.09 0.99 Allowed 'General case' 0 CA--C 1.522 -0.13 0 CA-C-O 120.969 0.414 . . . . 0.0 110.621 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.5 t -46.44 -41.64 14.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.962 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 151.55 37.16 0.03 OUTLIER Glycine 0 CA--C 1.519 0.314 0 C-N-CA 120.46 -0.876 . . . . 0.0 113.432 179.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.931 ' HB1' ' OE1' ' A' ' 52' ' ' GLU . . . -90.82 -171.27 2.97 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 117.151 0.476 . . . . 0.0 111.281 179.75 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.42 ' HG3' ' CZ ' ' A' ' 39' ' ' PHE . 12.4 mtp85 -115.94 -165.97 1.09 Allowed 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.523 -179.545 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.859 ' O ' HG22 ' A' ' 54' ' ' VAL . 0.6 OUTLIER -95.27 -52.45 4.17 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.311 -0.404 . . . . 0.0 112.012 -179.259 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . 0.545 ' O ' HG23 ' A' ' 54' ' ' VAL . 1.4 p -39.96 -40.33 1.0 Allowed 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.098 0.475 . . . . 0.0 111.312 -179.592 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.931 ' OE1' ' HB1' ' A' ' 48' ' ' ALA . 0.0 OUTLIER -63.02 -66.21 0.57 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.491 179.66 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.833 ' HE3' HD11 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -46.33 -55.62 7.03 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.881 179.936 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.859 HG22 ' O ' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -54.07 -39.83 43.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.184 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.928 ' CE1' HD21 ' A' ' 27' ' ' LEU . 1.3 t80 -52.78 -49.03 66.38 Favored 'General case' 0 C--O 1.231 0.132 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.735 178.42 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.743 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -58.99 -42.81 90.93 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.305 179.119 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -58.69 -43.09 89.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.807 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.598 HG23 ' O ' ' A' ' 54' ' ' VAL . 27.2 p -64.54 -60.36 3.23 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.162 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.947 HG23 HD12 ' A' ' 117' ' ' LEU . 8.9 p -60.72 -47.53 92.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.532 -179.523 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 1.04 HD13 HD23 ' A' ' 103' ' ' LEU . 6.0 tp -58.45 -43.0 88.66 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.67 0.271 . . . . 0.0 111.409 -179.569 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 9.9 t -75.3 -34.61 61.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.289 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . 0.614 ' HB3' HD22 ' A' ' 5' ' ' LEU . 0.1 OUTLIER -70.01 -25.22 63.48 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 120.727 0.298 . . . . 0.0 110.323 179.521 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 1.077 HG12 ' HB2' ' A' ' 120' ' ' ALA . 28.0 m -91.93 -55.55 6.06 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.233 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.179 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.551 ' N ' HG23 ' A' ' 63' ' ' VAL . . . 29.88 36.66 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 O-C-N 123.38 0.425 . . . . 0.0 112.009 179.78 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.62 ' O ' HG22 ' A' ' 66' ' ' VAL . 4.5 m-20 160.25 -84.45 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.262 0.468 . . . . 0.0 112.262 -179.031 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.62 HG22 ' O ' ' A' ' 65' ' ' ASN . 22.9 m 50.97 -160.56 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.59 -178.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.492 ' O ' ' O ' ' A' ' 98' ' ' SER . 7.3 p -147.34 -15.48 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 -178.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.899 HD22 HD11 ' A' ' 76' ' ' LEU . 0.4 OUTLIER 29.58 95.06 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.426 0.899 . . . . 0.0 113.426 178.81 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.408 HG21 ' CZ ' ' A' ' 122' ' ' ARG . 79.4 p -62.53 -161.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 178.619 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.08 -36.52 77.56 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.03 0.443 . . . . 0.0 110.393 179.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.474 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 13.7 tt0 -62.72 -65.34 0.7 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.242 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.686 ' O ' HD12 ' A' ' 76' ' ' LEU . 1.3 m-20 -53.26 -36.89 61.62 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.969 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.502 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 85.4 m -57.29 -65.25 0.66 Allowed 'General case' 0 C--O 1.238 0.455 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.644 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.86 -25.97 57.67 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 177.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 1.069 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -59.06 -51.43 70.1 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.723 178.715 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.899 HD11 HD22 ' A' ' 68' ' ' LEU . 1.2 mp -64.44 -49.68 70.5 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 178.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.529 HD23 ' N ' ' A' ' 77' ' ' LEU . 2.8 mt -57.08 -32.92 66.75 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.426 179.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.16 -49.21 58.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.686 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . 0.411 ' HB3' ' HG2' ' A' ' 111' ' ' GLN . 0.0 OUTLIER -61.17 -30.94 70.71 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.466 179.706 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.534 HG23 ' CZ ' ' A' ' 88' ' ' TYR . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.207 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . 0.58 ' HB3' ' HA3' ' A' ' 41' ' ' GLY . 9.4 p-10 . . . . . 0 C--O 1.238 0.469 0 CA-C-O 120.811 0.339 . . . . 0.0 111.428 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.661 ' CD1' HD23 ' A' ' 76' ' ' LEU . 4.4 p90 -104.52 145.99 29.51 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 119.981 -0.687 . . . . 0.0 110.817 179.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.718 ' HB3' ' O ' ' A' ' 101' ' ' VAL . 0.5 OUTLIER -109.45 141.56 41.69 Favored 'General case' 0 N--CA 1.436 -1.145 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.184 -179.056 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.821 HD11 ' CB ' ' A' ' 76' ' ' LEU . 66.4 mt -126.36 165.07 19.7 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.916 0.865 . . . . 0.0 113.289 -177.438 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -153.53 130.15 10.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 113.997 -1.456 . . . . 0.0 107.223 178.447 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.704 ' O ' HG13 ' A' ' 93' ' ' VAL . 60.4 p -103.68 145.83 29.48 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 -176.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.704 HG13 ' O ' ' A' ' 92' ' ' SER . 3.7 m . . . . . 0 CA--C 1.541 0.599 0 CA-C-N 113.553 -1.658 . . . . 0.0 108.621 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.425 ' HB2' HG22 ' A' ' 67' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.518 -0.267 0 CA-C-O 120.892 0.377 . . . . 0.0 110.551 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.505 ' O ' HD12 ' A' ' 68' ' ' LEU . 11.2 t -142.23 154.18 44.57 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.209 0.528 . . . . 0.0 111.138 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.416 HG13 ' N ' ' A' ' 100' ' ' LEU . 1.0 OUTLIER -103.74 159.91 4.79 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 178.772 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.796 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 0.1 OUTLIER -126.47 113.74 17.23 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -179.152 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.718 ' O ' ' HB3' ' A' ' 89' ' ' ASP . 0.2 OUTLIER -105.08 108.97 26.2 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 N-CA-C 103.213 -2.884 . . . . 0.0 103.213 174.481 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 0.781 ' O ' ' HB2' ' A' ' 103' ' ' LEU . 13.8 p -138.54 165.11 27.7 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -173.243 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 1.04 HD23 HD13 ' A' ' 60' ' ' LEU . 0.9 OUTLIER 126.74 82.55 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 112.508 -2.133 . . . . 0.0 112.658 176.61 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.447 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -104.65 19.14 20.94 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.619 -1.173 . . . . 0.0 108.284 177.441 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.691 ' O ' HD13 ' A' ' 103' ' ' LEU . 3.5 m 157.97 175.25 0.01 OUTLIER 'General case' 0 C--O 1.231 0.116 0 N-CA-C 107.14 -1.43 . . . . 0.0 107.14 -179.046 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.421 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.6 OUTLIER -106.69 101.95 11.36 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 119.596 -0.842 . . . . 0.0 112.097 -178.988 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.743 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 1.1 mt-30 -169.04 163.47 11.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.612 178.147 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.597 ' HB2' ' HB2' ' A' ' 56' ' ' ALA . 1.0 OUTLIER -165.71 133.71 3.01 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.395 0.617 . . . . 0.0 112.347 178.76 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . 0.772 HG22 ' O ' ' A' ' 39' ' ' PHE . 0.8 OUTLIER -103.24 159.8 15.23 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.983 -1.008 . . . . 0.0 109.316 178.823 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.767 HD13 ' CB ' ' A' ' 20' ' ' SER . 17.1 mt -46.91 -62.88 1.2 Allowed 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 121.222 -0.191 . . . . 0.0 110.92 -179.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . 0.979 ' O ' HG23 ' A' ' 115' ' ' VAL . 6.5 tp60 -44.38 -62.07 1.3 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.76 0.314 . . . . 0.0 110.499 179.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 0.452 ' O ' ' HB ' ' A' ' 115' ' ' VAL . 0.8 OUTLIER -45.42 -47.76 13.67 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 121.373 0.606 . . . . 0.0 110.436 179.529 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 0.591 ' CB ' ' CZ ' ' A' ' 55' ' ' PHE . . . -58.83 -65.74 0.61 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.923 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.819 ' NZ ' HG13 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -52.21 -25.72 9.88 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 121.06 -0.256 . . . . 0.0 110.898 179.825 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 1.069 HG22 ' CG ' ' A' ' 75' ' ' LYS . 88.2 t -64.39 -65.03 0.58 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.767 0 CA-C-O 122.082 0.944 . . . . 0.0 109.636 178.616 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.878 ' HB3' HG11 ' A' ' 63' ' ' VAL . 1.7 mp -63.59 -34.06 76.98 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 114.572 -1.194 . . . . 0.0 109.678 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 1.101 HD21 HD23 ' A' ' 8' ' ' LEU . 0.2 OUTLIER -72.67 -23.08 60.84 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.97 179.691 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.48 ' HA ' ' CE1' ' A' ' 9' ' ' HIS . 5.7 tt0 -71.84 -44.17 64.29 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 106.521 -1.659 . . . . 0.0 106.521 177.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.546 ' HB1' ' H ' ' A' ' 68' ' ' LEU . . . -77.9 -19.11 55.32 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 114.151 -1.386 . . . . 0.0 110.11 177.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 1.077 ' HB2' HG12 ' A' ' 63' ' ' VAL . . . -81.19 -48.07 12.59 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.928 179.557 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.916 HD22 ' CD2' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -68.8 -30.52 69.11 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.697 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.451 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 1.0 OUTLIER -74.08 -50.4 19.78 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.615 -0.72 . . . . 0.0 112.29 -179.404 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.08 -31.98 13.32 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -177.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -92.1 -65.61 0.99 Allowed 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -178.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . 0.46 ' CB ' ' HA ' ' A' ' 121' ' ' LEU . 3.9 t . . . . . 0 C--N 1.326 -0.413 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.614 -178.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.528 0.117 0 CA-C-O 120.835 0.35 . . . . 0.0 110.846 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.708 ' HB2' HD13 ' A' ' 8' ' ' LEU . 10.5 mp -90.01 164.88 14.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.679 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 51.4 p -60.95 -162.77 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.271 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 1.017 HD21 ' HB1' ' A' ' 120' ' ' ALA . 0.0 OUTLIER -93.5 -61.25 1.59 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.619 0.247 . . . . 0.0 111.391 179.811 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.9 p -47.33 -51.06 20.49 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -179.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.99 -55.72 15.31 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 121.164 0.507 . . . . 0.0 110.274 -179.346 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 1.06 HD23 HD21 ' A' ' 117' ' ' LEU . 11.6 tp -52.65 -60.06 3.71 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.425 179.309 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.762 ' ND1' HD13 ' A' ' 121' ' ' LEU . 1.7 t-80 -45.63 -56.43 5.2 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.111 178.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.5 -43.42 71.78 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.172 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.461 ' HG2' HG12 ' A' ' 31' ' ' VAL . 19.9 tp60 -58.86 -65.35 0.68 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.668 179.361 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.643 HG23 HD23 ' A' ' 110' ' ' LEU . 9.2 p -56.56 -45.8 82.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.965 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.707 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 8.8 t -60.49 -55.09 37.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.454 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.3 ttp180 -63.99 -22.73 67.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.091 -179.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.484 ' CD1' HG13 ' A' ' 31' ' ' VAL . 7.6 mt -73.16 -63.01 1.27 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.72 -179.535 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.706 HG23 ' HB2' ' A' ' 20' ' ' SER . 0.8 OUTLIER -70.3 -27.0 30.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.3 -179.538 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.403 ' HB2' ' O ' ' A' ' 13' ' ' SER . 8.1 mm-40 -78.14 -16.6 57.79 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.167 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -144.78 42.25 1.33 Allowed 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.84 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 173.56 -69.01 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 179.561 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.721 ' CB ' HD13 ' A' ' 110' ' ' LEU . 14.9 m -70.8 -31.75 68.6 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -178.088 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . 0.458 ' C ' HG22 ' A' ' 16' ' ' VAL . . . 78.04 -57.8 3.96 Favored Glycine 0 CA--C 1.521 0.462 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.933 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.638 ' N ' HG22 ' A' ' 16' ' ' VAL . 0.4 OUTLIER -177.3 30.42 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 120.831 0.348 . . . . 0.0 111.05 -179.879 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -74.81 -157.96 0.07 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.938 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.548 ' HB ' ' HB3' ' A' ' 34' ' ' ASN . 4.2 m -103.53 145.17 30.43 Favored 'General case' 0 C--O 1.231 0.108 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.432 ' HA2' ' O ' ' A' ' 32' ' ' ALA . . . -104.62 134.01 11.8 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.332 -0.937 . . . . 0.0 113.706 -178.46 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 1.0 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -104.96 128.87 53.42 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.932 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.875 HD22 HG21 ' A' ' 58' ' ' THR . 0.9 OUTLIER -104.82 146.55 28.83 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.378 0.608 . . . . 0.0 112.139 -178.863 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.496 HH21 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER 169.22 55.47 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 114.924 -1.035 . . . . 0.0 108.965 179.839 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.509 ' O ' HD11 ' A' ' 3' ' ' LEU . . . 87.52 -5.48 84.95 Favored Glycine 0 CA--C 1.52 0.348 0 N-CA-C 111.231 -0.747 . . . . 0.0 111.231 -177.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.4 ' ND2' ' C ' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -165.46 165.07 19.42 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 179.838 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.484 HG13 ' CD1' ' A' ' 15' ' ' LEU . 0.7 OUTLIER -112.76 120.96 64.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 121.432 0.634 . . . . 0.0 111.213 179.411 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 1.0 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -110.51 166.34 11.07 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.273 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.671 ' HB2' ' OG ' ' A' ' 20' ' ' SER . . . -103.58 137.43 41.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.221 0.534 . . . . 0.0 111.952 -178.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.58 HD21 HG23 ' A' ' 37' ' ' THR . 5.8 t30 -119.04 121.33 39.61 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.302 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 14.3 ttpp -121.78 -28.72 4.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.146 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -51.17 -77.19 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.961 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.58 HG23 HD21 ' A' ' 34' ' ' ASN . 7.9 t -77.45 -176.51 4.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.465 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 78.2 p -136.42 107.69 6.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.85 0.357 . . . . 0.0 111.235 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.635 ' CD1' HG23 ' A' ' 109' ' ' THR . 0.0 OUTLIER -61.18 -178.77 0.12 Allowed 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.19 179.62 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.472 ' N ' ' CG ' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -171.64 22.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.772 0.32 . . . . 0.0 111.568 179.6 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.52 ' O ' ' CB ' ' A' ' 105' ' ' SER . . . 79.16 -17.0 8.03 Favored Glycine 0 C--O 1.228 -0.255 0 CA-C-O 119.754 -0.47 . . . . 0.0 113.176 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.642 HD12 ' H ' ' A' ' 43' ' ' THR . 0.1 OUTLIER -48.08 178.15 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 117.235 0.517 . . . . 0.0 111.361 -179.935 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.678 ' C ' HD12 ' A' ' 44' ' ' ILE . 29.3 m -118.21 57.49 0.84 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.753 0.311 . . . . 0.0 111.67 -179.043 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.678 HD12 ' C ' ' A' ' 43' ' ' THR . 3.3 mp 69.93 -58.76 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.714 179.592 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.489 ' C ' ' O ' ' A' ' 44' ' ' ILE . . . -18.54 -77.27 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.61 ' HB2' HD13 ' A' ' 42' ' ' LEU . 58.8 m -43.86 -59.36 2.29 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.429 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 168.8 51.6 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.427 -0.892 . . . . 0.0 113.061 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.531 ' HB2' ' CD2' ' A' ' 42' ' ' LEU . . . -110.99 172.7 6.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.893 0.377 . . . . 0.0 111.053 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.476 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 2.2 tpm_? -91.49 158.5 16.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.713 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.707 ' O ' HG23 ' A' ' 54' ' ' VAL . 0.8 OUTLIER -71.92 -22.96 61.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.046 0.451 . . . . 0.0 110.494 179.507 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . 0.536 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 59.9 p -63.3 -62.81 1.44 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.256 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.585 ' HB2' ' HG2' ' A' ' 107' ' ' GLN . 1.5 pm0 -44.86 -60.69 1.92 Allowed 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.592 0.234 . . . . 0.0 111.414 -179.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.579 ' HG2' HD11 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -52.35 -50.71 61.79 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.702 -0.226 . . . . 0.0 110.997 179.931 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.941 ' O ' HG23 ' A' ' 58' ' ' THR . 73.5 t -57.55 -39.43 69.32 Favored 'Isoleucine or valine' 0 C--O 1.231 0.105 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.518 ' O ' HG12 ' A' ' 59' ' ' VAL . 0.3 OUTLIER -61.48 -45.15 95.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.581 178.756 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.641 ' HB2' ' C ' ' A' ' 107' ' ' GLN . . . -55.11 -45.82 75.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.577 179.337 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -64.3 -41.96 96.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.045 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.941 HG23 ' O ' ' A' ' 54' ' ' VAL . 9.9 p -61.56 -57.78 10.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.882 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 1.044 HG23 HD12 ' A' ' 117' ' ' LEU . 8.7 p -65.24 -49.72 77.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.08 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.819 HD13 HD23 ' A' ' 103' ' ' LEU . 6.2 tp -50.79 -40.2 54.63 Favored 'General case' 0 C--O 1.231 0.125 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.394 179.497 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 70.2 m -67.83 -53.49 26.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.331 179.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . 0.482 ' HB3' ' CD2' ' A' ' 5' ' ' LEU . 0.3 OUTLIER -60.83 -20.63 62.04 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 121.079 0.466 . . . . 0.0 110.299 179.598 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 1.086 HG13 HG11 ' A' ' 66' ' ' VAL . 3.4 t -109.61 55.07 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.491 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.493 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . -81.04 39.6 0.51 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.44 -179.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.621 ' HA ' HG13 ' A' ' 99' ' ' VAL . 3.9 m-20 153.63 -65.38 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 122.652 0.381 . . . . 0.0 111.123 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 1.086 HG11 HG13 ' A' ' 63' ' ' VAL . 35.5 m 42.36 -171.09 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -179.699 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.748 HG13 ' HG3' ' A' ' 123' ' ' GLN . 16.8 m -145.2 67.64 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 CA-C-O 121.133 0.492 . . . . 0.0 110.877 -178.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.713 ' N ' ' O ' ' A' ' 98' ' ' SER . 0.7 OUTLIER -60.24 107.73 0.69 Allowed 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.995 -179.391 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.651 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 7.2 p -80.17 177.62 8.82 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.244 179.197 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -35.42 -37.05 0.08 Allowed 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.952 0.406 . . . . 0.0 111.401 -179.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.467 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 4.8 tp10 -68.38 -65.11 0.74 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.023 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.699 ' HB3' HD23 ' A' ' 68' ' ' LEU . 65.0 m-20 -58.75 -32.26 69.1 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.414 -179.622 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -64.46 -57.82 8.17 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.626 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.528 ' HA ' ' CG ' ' A' ' 77' ' ' LEU . . . -56.24 -27.88 56.54 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 177.019 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 1.073 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.4 OUTLIER -61.78 -49.08 77.81 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 114.334 -1.303 . . . . 0.0 110.976 179.184 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.765 HD13 HD23 ' A' ' 90' ' ' LEU . 0.3 OUTLIER -68.27 -52.63 31.63 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.775 0.322 . . . . 0.0 110.729 179.572 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.528 ' CG ' ' HA ' ' A' ' 74' ' ' ALA . 3.8 pp -60.61 -26.86 67.31 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.095 -179.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.461 ' HB2' ' O ' ' A' ' 74' ' ' ALA . 34.0 tt0 -75.87 -47.96 23.33 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.16 0.505 . . . . 0.0 110.4 179.311 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 3.1 t -61.1 -33.24 73.04 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.94 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.5 HG22 ' HA ' ' A' ' 77' ' ' LEU . 14.2 t . . . . . 0 C--N 1.331 -0.205 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.614 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . 0.403 ' ND2' ' HA3' ' A' ' 41' ' ' GLY . 2.3 p-10 . . . . . 0 C--O 1.234 0.289 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.642 ' CE1' ' HE3' ' A' ' 108' ' ' MET . 25.8 m-85 -100.64 139.94 35.61 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 120.399 -0.52 . . . . 0.0 110.924 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.761 ' CG ' HG13 ' A' ' 101' ' ' VAL . 1.0 OUTLIER -117.3 149.77 39.9 Favored 'General case' 0 N--CA 1.428 -1.529 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 -179.267 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.767 HD12 ' N ' ' A' ' 90' ' ' LEU . 0.0 OUTLIER -149.36 161.72 41.5 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 121.693 0.758 . . . . 0.0 112.696 -178.883 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.42 ' O ' ' HB3' ' A' ' 98' ' ' SER . 2.6 ptm180 -140.95 135.29 31.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.501 -1.227 . . . . 0.0 108.062 178.301 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.561 ' O ' HG13 ' A' ' 93' ' ' VAL . 26.4 p -104.9 146.49 28.94 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.85 1.055 . . . . 0.0 113.85 -177.604 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.561 HG13 ' O ' ' A' ' 92' ' ' SER . 6.7 m . . . . . 0 N--CA 1.446 -0.643 0 CA-C-N 113.889 -1.505 . . . . 0.0 108.536 178.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.651 ' HA ' ' HA ' ' A' ' 69' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.434 -1.226 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.713 ' O ' ' N ' ' A' ' 68' ' ' LEU . 3.0 m -148.42 157.16 43.3 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.914 -178.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.621 HG13 ' HA ' ' A' ' 65' ' ' ASN . 2.5 t -104.08 150.17 7.41 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.043 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.714 HD13 ' CG ' ' A' ' 116' ' ' LEU . 0.1 OUTLIER -103.91 127.77 51.43 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 122.059 0.933 . . . . 0.0 113.198 -178.505 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.761 HG13 ' CG ' ' A' ' 89' ' ' ASP . 1.5 p -131.7 104.12 8.04 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 N-CA-C 104.295 -2.483 . . . . 0.0 104.295 174.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 0.688 ' O ' HD23 ' A' ' 103' ' ' LEU . 32.8 p -148.22 165.28 31.42 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 118.785 -1.166 . . . . 0.0 113.653 -174.621 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.872 HD13 ' O ' ' A' ' 105' ' ' SER . 0.2 OUTLIER 157.2 -83.34 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 113.661 -1.609 . . . . 0.0 111.73 176.509 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.501 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 52.4 28.12 5.53 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -179.162 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.872 ' O ' HD13 ' A' ' 103' ' ' LEU . 13.3 m 140.04 165.96 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 -178.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.421 ' HB3' ' HB2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -104.85 101.92 11.49 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 119.677 -0.809 . . . . 0.0 112.853 -178.093 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.641 ' C ' ' HB2' ' A' ' 56' ' ' ALA . 0.2 OUTLIER -168.61 164.73 12.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.41 177.694 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.642 ' HE3' ' CE1' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -165.58 141.91 5.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.118 0.485 . . . . 0.0 111.885 179.293 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . 0.635 HG23 ' CD1' ' A' ' 39' ' ' PHE . 0.8 OUTLIER -104.32 165.22 11.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.258 179.47 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.721 HD13 ' CB ' ' A' ' 20' ' ' SER . 3.4 mt -49.19 -58.04 5.69 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.692 0.282 . . . . 0.0 110.502 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . 0.953 ' O ' HG23 ' A' ' 115' ' ' VAL . 2.6 tp60 -50.42 -64.77 0.71 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.849 0.357 . . . . 0.0 110.839 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 0.475 ' O ' ' HB ' ' A' ' 115' ' ' VAL . 0.8 OUTLIER -44.34 -46.67 9.41 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.17 0.51 . . . . 0.0 110.95 179.847 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 0.603 ' HB3' HG21 ' A' ' 12' ' ' VAL . . . -55.6 -62.45 1.68 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.424 179.416 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.707 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 3.8 ptpp? -57.83 -27.01 62.8 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.037 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 1.073 HG22 ' CG ' ' A' ' 75' ' ' LYS . 99.4 t -61.05 -62.66 1.01 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.728 0 CA-C-O 122.149 0.976 . . . . 0.0 110.25 179.569 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.936 ' HB3' HG21 ' A' ' 63' ' ' VAL . 0.1 OUTLIER -68.64 -32.7 72.75 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.156 -179.199 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 1.06 HD21 HD23 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -73.37 -22.9 60.17 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 120.901 0.382 . . . . 0.0 110.49 179.359 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.565 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 2.2 tp10 -72.49 -43.44 63.66 Favored 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 106.243 -1.762 . . . . 0.0 106.243 177.09 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.467 ' HB1' ' HB ' ' A' ' 66' ' ' VAL . . . -75.46 -22.55 57.19 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 114.309 -1.314 . . . . 0.0 109.881 177.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 1.017 ' HB1' HD21 ' A' ' 5' ' ' LEU . . . -79.45 -49.93 11.57 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.503 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.762 HD13 ' ND1' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -63.91 -38.32 90.64 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.86 179.806 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.565 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -79.72 -33.93 40.47 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -179.285 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.748 ' HG3' HG13 ' A' ' 67' ' ' VAL . 12.1 tm0? -95.12 -19.43 20.12 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -177.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -93.6 -68.76 0.78 Allowed 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 119.743 -0.783 . . . . 0.0 111.976 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 2.0 t . . . . . 0 C--N 1.326 -0.445 0 CA-C-O 121.649 0.737 . . . . 0.0 111.31 179.271 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . 0.421 ' ND2' HG23 ' A' ' 58' ' ' THR . 6.0 p-10 . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.775 0.322 . . . . 0.0 110.868 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.833 ' HB2' HD13 ' A' ' 8' ' ' LEU . 4.7 mp -78.18 -175.29 4.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.623 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -103.04 153.13 20.57 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.01 179.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.756 ' HA ' HD23 ' A' ' 117' ' ' LEU . 75.4 mt -47.02 -61.83 1.69 Allowed 'General case' 0 CA--C 1.509 -0.607 0 CA-C-O 121.499 0.666 . . . . 0.0 110.993 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.546 ' HA ' HD13 ' A' ' 121' ' ' LEU . 5.2 t -42.77 -61.6 1.22 Allowed 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.278 -179.282 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -69.57 -56.74 6.48 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.971 0.415 . . . . 0.0 110.867 -179.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 1.056 HD23 HD21 ' A' ' 117' ' ' LEU . 23.5 tp -45.54 -45.84 13.66 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.751 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.748 ' CG ' HD22 ' A' ' 121' ' ' LEU . 56.4 t-80 -66.06 -40.27 90.77 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.424 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.4 -53.74 41.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.776 -1.102 . . . . 0.0 111.198 179.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.98 ' HG3' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -69.16 -55.39 10.79 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 120.791 0.329 . . . . 0.0 111.235 -179.795 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.875 HG22 HD13 ' A' ' 110' ' ' LEU . 3.8 p -51.9 -49.63 36.59 Favored 'Isoleucine or valine' 0 C--O 1.242 0.694 0 CA-C-O 121.22 0.533 . . . . 0.0 110.659 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.785 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 52.9 m -62.73 -41.89 99.4 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.557 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.475 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -67.25 -17.7 64.91 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.385 179.629 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.841 HD12 ' HA ' ' A' ' 12' ' ' VAL . 6.1 mt -83.14 -61.43 1.86 Allowed 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -179.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.566 ' CG2' ' HB3' ' A' ' 110' ' ' LEU . 0.9 OUTLIER -69.38 -34.27 61.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 C-N-CA 120.015 -0.674 . . . . 0.0 111.34 -179.068 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.45 ' HB2' ' O ' ' A' ' 13' ' ' SER . 3.5 mm-40 -69.62 -16.16 63.33 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.176 -179.507 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.475 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 2.8 pt20 -163.57 56.86 0.17 Allowed 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 120.854 -0.338 . . . . 0.0 111.44 179.301 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 176.52 -63.1 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.454 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.609 ' OG ' ' HB1' ' A' ' 33' ' ' ALA . 0.5 OUTLIER -79.08 -80.47 0.12 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.374 -179.324 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . 0.556 ' H ' HG22 ' A' ' 16' ' ' VAL . . . 113.28 -18.7 20.69 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.481 -179.599 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.63 ' O ' ' O ' ' A' ' 23' ' ' CYS . 21.9 p-10 166.46 -14.98 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.355 0.262 . . . . 0.0 111.388 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.63 ' O ' ' O ' ' A' ' 22' ' ' ASP . 58.0 m -42.13 -164.75 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.368 0.667 . . . . 0.0 112.718 -179.386 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.562 ' HA ' ' HA ' ' A' ' 109' ' ' THR . 20.4 m -103.75 162.15 13.33 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.781 -179.387 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.678 ' HA2' HD23 ' A' ' 110' ' ' LEU . . . -105.12 135.7 12.71 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.495 -0.86 . . . . 0.0 113.912 -178.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.945 ' HB3' ' HB3' ' A' ' 32' ' ' ALA . 1.3 tmmm? -104.92 119.52 39.21 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 178.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.65 HD23 ' N ' ' A' ' 28' ' ' ARG . 1.6 tt -104.63 165.25 11.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.665 -178.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.65 ' N ' HD23 ' A' ' 27' ' ' LEU . 0.0 OUTLIER 140.1 56.2 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.618 1.167 . . . . 0.0 109.492 -179.862 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.729 ' C ' HD11 ' A' ' 3' ' ' LEU . . . 88.53 -4.94 85.15 Favored Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.877 -0.678 . . . . 0.0 111.764 -178.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.538 ' N ' HD11 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -165.7 165.46 18.6 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 -179.95 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.98 HG12 ' HG3' ' A' ' 11' ' ' GLN . 3.7 p -112.58 136.65 48.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.251 0.548 . . . . 0.0 110.911 178.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.945 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . . . -129.3 167.43 17.72 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.629 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.609 ' HB1' ' OG ' ' A' ' 20' ' ' SER . . . -102.77 121.3 42.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.235 0.541 . . . . 0.0 111.588 -178.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.526 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 2.4 t30 -105.05 115.7 30.72 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.542 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.02 -25.78 15.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.391 -179.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.54 ' O ' ' HB ' ' A' ' 37' ' ' THR . 14.0 mm-40 -42.93 -82.21 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.717 -179.314 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.865 HG23 HG23 ' A' ' 38' ' ' THR . 7.5 t 172.0 -168.79 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.879 0.371 . . . . 0.0 110.945 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.865 HG23 HG23 ' A' ' 37' ' ' THR . 2.8 p 62.77 121.04 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.96 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.713 ' O ' ' HB3' ' A' ' 107' ' ' GLN . 11.3 p90 169.15 -31.67 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.688 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.472 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -54.78 67.99 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.602 -0.727 . . . . 0.0 112.478 -178.704 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.605 ' N ' ' O ' ' A' ' 39' ' ' PHE . . . 36.01 87.15 0.01 OUTLIER Glycine 0 C--N 1.332 0.31 0 CA-C-N 116.018 -0.537 . . . . 0.0 113.621 179.032 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.627 HD23 ' HB2' ' A' ' 48' ' ' ALA . 0.1 OUTLIER -141.8 169.99 16.55 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 179.168 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.596 ' C ' HD12 ' A' ' 44' ' ' ILE . 0.7 OUTLIER -103.28 41.31 1.28 Allowed 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 -177.698 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.921 HG23 ' O ' ' A' ' 48' ' ' ALA . 3.4 mp 53.54 5.14 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 179.012 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.433 ' H ' ' C ' ' A' ' 43' ' ' THR . . . -74.41 -41.29 61.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.928 0.394 . . . . 0.0 110.846 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.583 ' H ' HD11 ' A' ' 42' ' ' LEU . 0.5 OUTLIER -72.31 -32.18 66.34 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.477 179.664 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.447 ' O ' HG21 ' A' ' 38' ' ' THR . . . 142.62 34.33 0.1 OUTLIER Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.618 -0.801 . . . . 0.0 113.381 179.57 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.921 ' O ' HG23 ' A' ' 44' ' ' ILE . . . -85.89 149.78 24.98 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 117.118 0.459 . . . . 0.0 111.049 179.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 7.4 mtm180 -81.45 159.89 24.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.738 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.609 ' O ' HG23 ' A' ' 54' ' ' VAL . 0.2 OUTLIER -67.32 -21.38 65.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.952 179.873 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . 0.469 ' HB2' ' HA ' ' A' ' 26' ' ' LYS . 1.0 OUTLIER -61.0 -65.1 0.75 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.379 -179.585 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.462 ' N ' ' OG ' ' A' ' 51' ' ' SER . 0.0 OUTLIER -49.08 -65.84 0.5 Allowed 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.977 0.417 . . . . 0.0 110.809 -179.824 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.643 ' HA ' ' HA ' ' A' ' 107' ' ' GLN . 0.0 OUTLIER -43.82 -51.25 7.51 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.094 179.872 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.609 HG23 ' O ' ' A' ' 50' ' ' GLU . 53.4 t -61.13 -31.14 49.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.083 0.468 . . . . 0.0 110.244 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.734 ' HB3' ' HB3' ' A' ' 108' ' ' MET . 0.3 OUTLIER -66.61 -48.0 70.9 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.615 179.649 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.798 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -60.45 -45.87 92.11 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.966 0.412 . . . . 0.0 110.201 179.33 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 21.1 mm-40 -55.26 -55.55 30.09 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.604 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.421 HG23 ' ND2' ' A' ' 2' ' ' ASN . 0.7 OUTLIER -67.38 -30.54 70.35 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.005 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.768 HG11 HD23 ' A' ' 116' ' ' LEU . 0.9 OUTLIER -60.56 -57.09 13.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.258 -179.556 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 1.009 HD21 ' CE2' ' A' ' 88' ' ' TYR . 42.3 mt -75.49 -34.71 60.89 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 121.339 0.59 . . . . 0.0 111.335 -179.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 45.5 m -57.83 -42.12 83.71 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.18 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . 0.486 ' HB3' HD21 ' A' ' 5' ' ' LEU . 0.2 OUTLIER -75.62 -50.27 16.02 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-O 120.751 0.31 . . . . 0.0 110.611 179.94 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.922 HG12 ' CB ' ' A' ' 120' ' ' ALA . 11.6 m -60.06 -50.37 80.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.943 0.401 . . . . 0.0 110.55 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.522 ' N ' HG23 ' A' ' 63' ' ' VAL . . . 34.92 34.71 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.56 -0.745 . . . . 0.0 112.148 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.72 ' O ' HG22 ' A' ' 66' ' ' VAL . 0.5 OUTLIER 163.47 -81.12 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -179.679 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.834 HG13 ' HB ' ' A' ' 63' ' ' VAL . 11.3 m 54.63 -160.15 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 122.725 0.41 . . . . 0.0 110.911 -177.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.573 HG22 ' CB ' ' A' ' 97' ' ' ASN . 9.9 p -151.72 -28.02 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.72 HD22 ' CD1' ' A' ' 76' ' ' LEU . 0.3 OUTLIER 32.27 95.24 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.976 -0.556 . . . . 0.0 112.407 179.193 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.668 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 14.5 p -66.11 -117.67 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.69 179.701 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.455 ' N ' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER -95.06 -38.94 10.4 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.062 0.458 . . . . 0.0 110.963 179.974 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -64.0 -61.12 2.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.089 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.717 ' HB3' HD23 ' A' ' 68' ' ' LEU . 0.8 OUTLIER -59.27 -30.26 68.16 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.21 -179.646 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.455 HG22 ' HB3' ' A' ' 98' ' ' SER . 0.9 OUTLIER -63.39 -59.05 5.2 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 178.323 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -57.52 -24.75 57.78 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 1.006 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.1 OUTLIER -62.25 -56.88 14.2 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 114.742 -1.117 . . . . 0.0 110.066 178.773 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.727 HD21 HD13 ' A' ' 100' ' ' LEU . 0.4 OUTLIER -59.23 -38.58 80.32 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.33 0.586 . . . . 0.0 109.438 178.613 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.9 -48.7 79.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.078 -0.965 . . . . 0.0 111.35 -179.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.8 mm-40 -72.42 -42.42 65.11 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.311 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 4.7 p -68.91 -27.63 65.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.272 -179.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 81.2 m . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.573 -179.626 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . 0.414 HD22 ' N ' ' A' ' 41' ' ' GLY . 14.2 p30 . . . . . 0 C--O 1.238 0.5 0 N-CA-C 112.062 0.393 . . . . 0.0 112.062 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 1.009 ' CE2' HD21 ' A' ' 60' ' ' LEU . 2.4 m-85 -99.62 148.95 23.78 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 120.329 -0.548 . . . . 0.0 111.485 -179.331 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.686 ' O ' ' O ' ' A' ' 101' ' ' VAL . 0.0 OUTLIER -119.68 148.64 43.14 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.509 -179.116 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.689 HD12 ' N ' ' A' ' 90' ' ' LEU . 0.0 OUTLIER -148.9 150.61 33.25 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.307 0.575 . . . . 0.0 112.18 -179.335 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 18.0 tpt180 -121.94 141.65 51.1 Favored 'General case' 0 C--O 1.221 -0.435 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.805 ' O ' HG13 ' A' ' 93' ' ' VAL . 55.4 p -104.71 145.85 29.78 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.879 1.066 . . . . 0.0 113.879 -177.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.805 HG13 ' O ' ' A' ' 92' ' ' SER . 3.6 m . . . . . 0 CA--C 1.539 0.553 0 CA-C-N 113.297 -1.774 . . . . 0.0 107.908 179.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.668 ' HA ' ' HA ' ' A' ' 69' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.452 -0.346 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.526 ' O ' ' O ' ' A' ' 67' ' ' VAL . 1.5 t -137.39 165.4 26.32 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.431 0.634 . . . . 0.0 111.165 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -103.68 147.63 9.67 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 179.225 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.733 HD23 HG21 ' A' ' 63' ' ' VAL . 7.6 tp -103.77 105.76 16.06 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 121.909 0.862 . . . . 0.0 113.302 -177.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.686 ' O ' ' O ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -123.14 120.57 60.77 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 N-CA-C 103.743 -2.688 . . . . 0.0 103.743 175.467 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 0.716 ' OG ' HD11 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -157.96 166.17 33.27 Favored 'General case' 0 C--N 1.305 -1.341 0 C-N-CA 117.529 -1.669 . . . . 0.0 114.395 -173.895 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.984 HD23 HD12 ' A' ' 60' ' ' LEU . 0.1 OUTLIER 161.9 -90.16 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.105 0 CA-C-N 113.502 -1.681 . . . . 0.0 111.835 175.59 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.555 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 53.75 27.61 7.2 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 -179.416 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.555 ' CB ' ' O ' ' A' ' 104' ' ' ARG . 17.6 m 133.99 160.5 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.552 1.141 . . . . 0.0 108.1 -178.543 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.569 ' O ' ' HG3' ' A' ' 107' ' ' GLN . 1.0 OUTLIER -104.82 101.0 10.62 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 120.038 -0.665 . . . . 0.0 112.243 -178.703 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.798 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 5.5 mt-30 -169.85 159.82 8.16 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.415 177.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.734 ' HB3' ' HB3' ' A' ' 55' ' ' PHE . 2.4 tpt -158.56 153.73 25.47 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.629 0.604 . . . . 0.0 112.629 179.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . 0.7 HG22 ' CD1' ' A' ' 39' ' ' PHE . 0.1 OUTLIER -115.47 165.29 13.15 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.857 178.662 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.875 HD13 HG22 ' A' ' 12' ' ' VAL . 0.2 OUTLIER -50.94 -55.78 15.58 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.696 0.284 . . . . 0.0 111.288 -179.933 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . 0.743 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 0.9 OUTLIER -49.17 -65.96 0.48 Allowed 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.355 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 0.782 ' O ' HD22 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -49.57 -56.94 8.14 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.025 0.44 . . . . 0.0 110.83 -179.224 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 0.622 ' HB1' ' CZ ' ' A' ' 55' ' ' PHE . . . -40.44 -54.57 2.44 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.843 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.785 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -67.31 -33.34 75.07 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.099 179.708 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 1.006 HG22 ' CG ' ' A' ' 75' ' ' LYS . 54.9 t -54.36 -61.69 0.91 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.746 0 CA-C-O 121.756 0.788 . . . . 0.0 110.72 179.697 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.782 HD22 ' O ' ' A' ' 112' ' ' ASP . 0.1 OUTLIER -62.26 -43.2 99.37 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.177 -179.534 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 1.056 HD21 HD23 ' A' ' 8' ' ' LEU . 0.7 OUTLIER -66.99 -19.08 65.66 Favored 'General case' 0 CA--C 1.51 -0.565 0 C-N-CA 120.764 -0.375 . . . . 0.0 111.156 179.624 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.744 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 10.1 tt0 -70.7 -54.18 12.81 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 106.095 -1.817 . . . . 0.0 106.095 176.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.511 ' O ' ' HB2' ' A' ' 123' ' ' GLN . . . -69.83 -18.86 63.47 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.478 -1.237 . . . . 0.0 110.675 177.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.922 ' CB ' HG12 ' A' ' 63' ' ' VAL . . . -79.88 -62.72 1.6 Allowed 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 121.151 0.5 . . . . 0.0 110.432 179.543 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.748 HD22 ' CG ' ' A' ' 9' ' ' HIS . 0.1 OUTLIER -60.01 -24.78 64.76 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.525 -179.619 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.744 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -87.01 -41.69 13.68 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -179.903 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.511 ' HB2' ' O ' ' A' ' 119' ' ' ALA . 1.1 tm0? -84.8 -29.76 25.14 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -178.463 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -95.24 -65.97 0.94 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.543 0.571 . . . . 0.0 112.543 -178.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.325 -0.468 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.423 -178.17 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . 0.626 ' CG ' HD21 ' A' ' 27' ' ' LEU . 30.4 t30 . . . . . 0 CA--C 1.528 0.118 0 CA-C-O 120.874 0.369 . . . . 0.0 110.679 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.719 HD11 ' C ' ' A' ' 29' ' ' GLY . 0.3 OUTLIER -66.57 172.28 4.3 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.374 -179.487 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 53.5 p -74.0 -151.34 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.877 179.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.838 HD23 ' CE1' ' A' ' 9' ' ' HIS . 1.1 mt -95.27 -66.56 0.9 Allowed 'General case' 0 CA--C 1.504 -0.826 0 CA-C-O 121.531 0.681 . . . . 0.0 111.757 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.458 ' O ' ' HG2' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -35.73 -46.78 0.46 Allowed 'General case' 0 N--CA 1.435 -1.223 0 CA-C-N 115.205 -0.907 . . . . 0.0 112.914 -178.422 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -78.97 -42.49 26.68 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -179.584 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.858 HD23 HD21 ' A' ' 117' ' ' LEU . 11.2 tp -64.23 -35.47 80.93 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.545 0.688 . . . . 0.0 110.868 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 1.006 ' CD2' HD23 ' A' ' 117' ' ' LEU . 3.4 m170 -79.62 -43.1 23.52 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.727 -1.124 . . . . 0.0 110.873 -178.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.492 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 5.2 mmt85 -60.2 -37.57 80.66 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 178.375 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.836 ' HG2' HG13 ' A' ' 31' ' ' VAL . 5.9 tt0 -65.59 -65.91 0.61 Allowed 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.455 178.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.757 ' O ' HG12 ' A' ' 16' ' ' VAL . 7.4 p -55.08 -48.11 76.39 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.517 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.504 ' N ' HG13 ' A' ' 12' ' ' VAL . 83.9 p -54.81 -60.05 3.9 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.383 -179.454 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.492 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -53.97 -48.19 70.58 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -178.698 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.942 ' CD1' HD22 ' A' ' 110' ' ' LEU . 0.2 OUTLIER -60.28 -57.75 11.43 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 119.61 -0.836 . . . . 0.0 111.084 -179.267 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.828 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 9.9 p -69.28 -11.67 15.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -178.627 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.729 ' HG2' ' HE3' ' A' ' 114' ' ' LYS . 3.8 mm-40 -95.6 -4.36 44.68 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -148.83 -47.17 0.15 Allowed 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -87.81 -61.33 1.74 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -178.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.828 ' HB2' ' HA ' ' A' ' 16' ' ' VAL . 4.6 m -73.76 -47.24 40.5 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.037 -0.529 . . . . 0.0 112.318 -178.479 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 85.07 -39.85 2.99 Favored Glycine 0 CA--C 1.519 0.308 0 C-N-CA 120.519 -0.848 . . . . 0.0 111.782 -178.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.754 ' O ' HD12 ' A' ' 110' ' ' LEU . 7.5 t70 -170.59 -66.44 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.569 ' O ' ' O ' ' A' ' 22' ' ' ASP . 0.1 OUTLIER 28.46 -159.22 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.624 0.769 . . . . 0.0 112.506 178.945 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.746 ' HA ' HG22 ' A' ' 109' ' ' THR . 0.1 OUTLIER -104.03 156.08 18.15 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.063 -0.718 . . . . 0.0 109.063 179.005 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.444 ' H ' ' HA ' ' A' ' 109' ' ' THR . . . -104.68 119.69 6.33 Favored Glycine 0 N--CA 1.443 -0.85 0 C-N-CA 120.172 -1.013 . . . . 0.0 113.184 -178.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.99 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -104.58 115.5 30.46 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 178.67 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.626 HD21 ' CG ' ' A' ' 2' ' ' ASN . 2.8 tt -110.09 151.8 26.77 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.574 0.702 . . . . 0.0 112.605 -177.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.462 ' HG2' ' C ' ' A' ' 27' ' ' LEU . 4.9 ptp180 160.78 52.49 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 114.63 -1.168 . . . . 0.0 108.888 179.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.719 ' C ' HD11 ' A' ' 3' ' ' LEU . . . 100.76 -6.81 57.27 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.137 -178.24 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.414 ' HA ' ' NE2' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -166.36 165.55 17.14 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 179.868 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.836 HG13 ' HG2' ' A' ' 11' ' ' GLN . 0.2 OUTLIER -116.77 122.53 70.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.227 0.537 . . . . 0.0 110.432 178.709 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.99 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -120.22 167.1 12.6 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.008 -179.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.753 ' HB2' ' OG ' ' A' ' 20' ' ' SER . . . -102.2 127.72 49.02 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.274 0.559 . . . . 0.0 111.542 -179.024 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.518 HD21 HG23 ' A' ' 37' ' ' THR . 6.3 t30 -111.89 132.53 54.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.643 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.1 -22.04 3.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.228 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -57.72 -23.52 52.29 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.427 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.518 HG23 HD21 ' A' ' 34' ' ' ASN . 4.6 t -154.97 155.04 33.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.062 0.458 . . . . 0.0 110.626 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 23.2 p -81.84 -122.63 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.609 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.551 ' CZ ' HG23 ' A' ' 109' ' ' THR . 0.2 OUTLIER -176.32 -85.48 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 121.351 -0.14 . . . . 0.0 111.131 179.962 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.537 ' O ' ' C ' ' A' ' 41' ' ' GLY . 0.0 OUTLIER 56.06 88.68 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 122.45 0.3 . . . . 0.0 111.141 179.667 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.537 ' C ' ' O ' ' A' ' 40' ' ' GLN . . . 14.4 98.41 0.0 OUTLIER Glycine 0 C--N 1.346 1.108 0 O-C-N 123.498 0.499 . . . . 0.0 112.738 -179.193 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.819 HD11 ' HB2' ' A' ' 46' ' ' SER . 6.2 tp -151.08 159.9 44.22 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.481 -0.192 . . . . 0.0 110.481 -178.157 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.447 ' C ' ' H ' ' A' ' 45' ' ' ALA . 0.0 OUTLIER -107.37 33.1 4.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.942 0.401 . . . . 0.0 111.282 -179.457 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.747 HD12 ' HB3' ' A' ' 48' ' ' ALA . 0.9 OUTLIER 59.13 -0.54 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.13 179.777 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.447 ' H ' ' C ' ' A' ' 43' ' ' THR . . . -77.97 -40.94 37.74 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.914 0.388 . . . . 0.0 110.719 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.819 ' HB2' HD11 ' A' ' 42' ' ' LEU . 0.5 OUTLIER -71.25 -31.16 67.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.712 179.81 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 143.92 52.92 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.989 179.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.747 ' HB3' HD12 ' A' ' 44' ' ' ILE . . . -121.09 -173.72 2.67 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.739 0.304 . . . . 0.0 111.256 179.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 14.7 ttm180 -109.74 139.4 44.84 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.091 -179.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.71 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 12.2 mt-10 -56.66 -18.1 11.08 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.412 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . 0.658 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 0.8 OUTLIER -71.97 -56.98 4.71 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.316 -179.91 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.424 ' HB3' ' HG2' ' A' ' 107' ' ' GLN . 41.4 mt-10 -48.25 -44.23 33.19 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.033 0.444 . . . . 0.0 110.796 179.641 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.71 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -65.59 -58.69 5.15 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.507 -179.971 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.568 HG22 ' O ' ' A' ' 50' ' ' GLU . 14.1 m -49.27 -45.2 18.03 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-O 121.051 0.453 . . . . 0.0 110.352 179.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.783 ' CE1' ' HB1' ' A' ' 113' ' ' ALA . 0.2 OUTLIER -55.38 -53.62 53.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.827 178.649 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.696 ' HB2' ' C ' ' A' ' 107' ' ' GLN . . . -48.28 -45.85 35.16 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.577 179.176 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -64.07 -45.82 87.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.887 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.423 ' OG1' ' HA ' ' A' ' 55' ' ' PHE . 0.6 OUTLIER -64.35 -53.68 44.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.289 -179.528 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.857 HG23 HD12 ' A' ' 117' ' ' LEU . 4.6 p -60.66 -38.28 78.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.064 179.544 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.559 HD13 ' O ' ' A' ' 102' ' ' SER . 7.2 tp -61.23 -39.14 89.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.845 0.355 . . . . 0.0 110.268 178.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 33.8 m -69.53 -60.42 2.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.905 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . 0.541 ' HB3' HD21 ' A' ' 5' ' ' LEU . 14.2 m-70 -52.94 -27.67 19.97 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.837 0.351 . . . . 0.0 111.226 -179.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 1.103 HG21 ' HB3' ' A' ' 116' ' ' LEU . 3.8 t -102.41 46.78 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.045 -179.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.629 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . -76.56 57.77 1.27 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.412 -179.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.629 ' CB ' ' O ' ' A' ' 64' ' ' ALA . 26.0 t-20 132.31 -63.68 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.21 0.604 . . . . 0.0 111.381 179.632 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 1.089 HG11 HG13 ' A' ' 63' ' ' VAL . 35.4 m 42.47 -137.28 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.602 -179.455 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.51 ' O ' ' O ' ' A' ' 98' ' ' SER . 2.8 p -158.89 -31.95 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 121.027 0.441 . . . . 0.0 111.926 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.719 HD12 ' O ' ' A' ' 98' ' ' SER . 0.7 OUTLIER 40.85 95.67 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.647 179.226 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 22.0 p -66.78 -165.38 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.91 -34.15 71.36 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.017 0.437 . . . . 0.0 110.697 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -68.19 -51.33 46.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.63 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.692 ' O ' HD12 ' A' ' 76' ' ' LEU . 3.3 m-20 -60.46 -42.12 95.54 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.779 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 70.6 m -61.89 -44.64 96.39 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-O 121.103 0.478 . . . . 0.0 110.122 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.516 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . . . -68.81 -28.98 67.24 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 178.055 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 1.024 ' CG ' HG12 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -56.4 -57.52 11.95 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 114.061 -1.427 . . . . 0.0 109.834 178.354 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 1.014 HD22 HD21 ' A' ' 90' ' ' LEU . 5.9 mp -62.64 -53.43 54.66 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.164 179.244 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.661 HD12 ' C ' ' A' ' 77' ' ' LEU . 0.3 OUTLIER -54.52 -32.12 57.54 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.72 -179.763 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.405 ' HB2' ' O ' ' A' ' 74' ' ' ALA . 1.0 OUTLIER -67.87 -65.03 0.74 Allowed 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.917 0.389 . . . . 0.0 109.994 179.115 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.03 -22.46 60.73 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.743 179.282 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 31.4 m . . . . . 0 C--N 1.332 -0.174 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.967 179.984 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 37.3 p-10 . . . . . 0 C--O 1.236 0.385 0 CA-C-O 120.761 0.315 . . . . 0.0 111.176 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.632 ' CG ' ' HB2' ' A' ' 102' ' ' SER . 2.8 m-85 -103.13 139.69 38.32 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.835 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.763 ' CG ' HG13 ' A' ' 101' ' ' VAL . 0.7 OUTLIER -109.63 146.24 35.11 Favored 'General case' 0 N--CA 1.436 -1.134 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -178.985 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 1.014 HD21 HD22 ' A' ' 76' ' ' LEU . 36.7 mt -136.01 153.58 51.33 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 113.364 0.875 . . . . 0.0 113.364 -177.449 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.444 ' O ' ' CB ' ' A' ' 98' ' ' SER . 25.2 ttp180 -130.71 142.65 50.43 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 114.69 -1.141 . . . . 0.0 108.193 178.031 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.455 ' O ' HG13 ' A' ' 93' ' ' VAL . 3.8 p -104.66 140.64 37.74 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 113.796 1.036 . . . . 0.0 113.796 -178.084 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.455 HG13 ' O ' ' A' ' 92' ' ' SER . 27.8 m . . . . . 0 N--CA 1.443 -0.82 0 CA-C-N 113.833 -1.53 . . . . 0.0 107.769 178.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.406 ' HB3' ' O ' ' A' ' 67' ' ' VAL . 0.3 OUTLIER . . . . . 0 CA--C 1.521 -0.169 0 N-CA-C 110.221 -0.289 . . . . 0.0 110.221 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.719 ' O ' HD12 ' A' ' 68' ' ' LEU . 0.9 OUTLIER -140.73 164.01 31.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.485 0.659 . . . . 0.0 111.308 -179.927 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.533 HG22 ' O ' ' A' ' 65' ' ' ASN . 0.5 OUTLIER -104.19 151.21 6.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 178.954 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.93 HD13 ' CD1' ' A' ' 116' ' ' LEU . 1.0 OUTLIER -103.94 111.54 24.13 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -178.995 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.763 HG13 ' CG ' ' A' ' 89' ' ' ASP . 1.4 p -124.27 104.68 14.26 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 104.352 -2.462 . . . . 0.0 104.352 175.143 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 0.632 ' HB2' ' CG ' ' A' ' 88' ' ' TYR . 9.0 p -148.92 165.35 31.84 Favored 'General case' 0 C--N 1.311 -1.106 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -173.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.541 HD13 ' O ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 158.62 -91.08 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.077 0 CA-C-N 113.07 -1.877 . . . . 0.0 111.864 176.03 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.512 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 56.87 23.07 7.72 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 -178.641 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.541 ' O ' HD13 ' A' ' 103' ' ' LEU . 5.1 m 138.9 168.22 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.859 1.264 . . . . 0.0 108.154 -178.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.428 ' O ' ' O ' ' A' ' 42' ' ' LEU . 1.3 m-20 -104.89 102.59 12.11 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.082 -0.647 . . . . 0.0 112.348 -179.076 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.696 ' C ' ' HB2' ' A' ' 56' ' ' ALA . 0.6 OUTLIER -168.1 157.47 9.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.699 177.991 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.492 ' HG2' ' HB2' ' A' ' 113' ' ' ALA . 0.0 OUTLIER -165.64 145.03 6.4 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.21 0.529 . . . . 0.0 112.293 179.268 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . 0.746 HG22 ' HA ' ' A' ' 24' ' ' THR . 0.7 OUTLIER -104.26 163.47 12.39 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 178.256 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.942 HD22 ' CD1' ' A' ' 15' ' ' LEU . 5.2 mt -52.8 -61.39 2.32 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 120.165 -0.614 . . . . 0.0 109.838 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . 0.799 ' O ' HG13 ' A' ' 115' ' ' VAL . 2.5 tp60 -40.15 -63.38 0.62 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 120.713 0.292 . . . . 0.0 110.603 179.145 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 1.023 ' O ' HG22 ' A' ' 115' ' ' VAL . 8.0 m-20 -51.5 -58.51 6.1 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 121.265 0.555 . . . . 0.0 110.154 179.384 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 0.805 ' O ' HD13 ' A' ' 117' ' ' LEU . . . -48.4 -39.87 23.93 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.12 0.486 . . . . 0.0 110.108 178.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.729 ' HE3' ' HG2' ' A' ' 17' ' ' GLN . 0.0 OUTLIER -72.22 -26.97 62.24 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.877 179.729 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 1.024 HG12 ' CG ' ' A' ' 75' ' ' LYS . 10.8 m -70.48 -51.82 34.44 Favored 'Isoleucine or valine' 0 C--O 1.249 1.038 0 CA-C-O 121.406 0.622 . . . . 0.0 111.892 -179.079 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 1.103 ' HB3' HG21 ' A' ' 63' ' ' VAL . 0.5 OUTLIER -70.0 -37.84 75.82 Favored 'General case' 0 N--CA 1.439 -1.017 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 179.433 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 1.006 HD23 ' CD2' ' A' ' 9' ' ' HIS . 5.1 mp -65.6 -32.28 73.77 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.905 178.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 26.4 tp10 -62.17 -53.24 58.14 Favored 'General case' 0 C--N 1.31 -1.112 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 178.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.579 ' HB1' ' H ' ' A' ' 68' ' ' LEU . . . -74.47 -16.56 60.85 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 119.382 -0.927 . . . . 0.0 110.741 177.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.985 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -77.99 -61.51 1.98 Allowed 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.409 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.681 ' HB3' ' ND1' ' A' ' 9' ' ' HIS . 0.4 OUTLIER -56.55 -34.71 67.36 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 118.736 -1.186 . . . . 0.0 108.785 178.111 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.493 ' N ' ' HG ' ' A' ' 121' ' ' LEU . 0.1 OUTLIER -55.03 -65.28 0.61 Allowed 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 114.918 -1.037 . . . . 0.0 112.223 179.797 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.77 -13.25 24.27 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -177.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . 0.596 ' HB2' ' O ' ' A' ' 120' ' ' ALA . 5.0 mm-40 -97.68 -67.06 0.86 Allowed 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 -177.449 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . 0.677 ' HB2' ' HA ' ' A' ' 121' ' ' LEU . 10.1 t . . . . . 0 CA--C 1.5 -0.981 0 CA-C-N 114.293 -1.321 . . . . 0.0 112.496 -176.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . 0.728 ' ND2' HD12 ' A' ' 3' ' ' LEU . 11.2 t-20 . . . . . 0 C--O 1.231 0.111 0 CA-C-O 121.043 0.449 . . . . 0.0 110.885 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.728 HD12 ' ND2' ' A' ' 2' ' ' ASN . 0.0 OUTLIER -79.88 -76.02 0.23 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.098 179.579 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.503 ' O ' ' CB ' ' A' ' 8' ' ' LEU . 36.1 t -178.48 -151.72 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.766 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.567 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 23.1 mt -96.04 -64.7 1.03 Allowed 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 121.365 0.602 . . . . 0.0 111.453 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.448 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 0.9 OUTLIER -36.19 -59.16 0.64 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.766 -1.106 . . . . 0.0 112.958 -178.288 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . 0.408 ' O ' ' HB3' ' A' ' 10' ' ' ARG . 0.7 OUTLIER -73.32 -54.32 8.66 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 120.757 0.313 . . . . 0.0 110.733 -179.387 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.983 HD23 HD21 ' A' ' 117' ' ' LEU . 46.0 tp -42.5 -51.19 5.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.254 0.549 . . . . 0.0 110.166 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.74 ' CG ' HD22 ' A' ' 121' ' ' LEU . 9.6 t60 -64.34 -46.53 83.07 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 177.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.448 ' HB2' ' O ' ' A' ' 6' ' ' SER . 0.0 OUTLIER -50.84 -57.15 9.15 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.21 -1.359 . . . . 0.0 111.741 -179.545 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.663 ' HG3' HG22 ' A' ' 31' ' ' VAL . 2.3 pt20 -65.41 -51.37 60.78 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -179.145 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.876 HG23 HD23 ' A' ' 110' ' ' LEU . 8.9 p -58.75 -46.22 90.82 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-O 121.206 0.527 . . . . 0.0 110.614 179.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.845 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 24.5 t -56.56 -49.2 75.53 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.329 179.649 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.8 ttt85 -63.82 -30.5 71.59 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.952 0.405 . . . . 0.0 110.533 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.721 HD12 ' HA ' ' A' ' 12' ' ' VAL . 6.4 mt -67.56 -65.47 0.68 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.353 -179.422 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.499 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 0.9 OUTLIER -68.04 -27.7 38.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -178.566 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.401 ' HB2' ' O ' ' A' ' 13' ' ' SER . 1.8 mm-40 -87.09 -9.95 54.12 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.672 -179.523 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -151.94 38.44 0.59 Allowed 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 120.821 -0.351 . . . . 0.0 111.925 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 179.35 -67.69 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 179.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.565 ' CB ' HD13 ' A' ' 110' ' ' LEU . 15.3 m -72.33 -40.34 67.5 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -178.219 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . 0.432 ' H ' ' HA ' ' A' ' 16' ' ' VAL . . . 82.3 -50.42 4.32 Favored Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.374 -0.917 . . . . 0.0 112.192 -179.06 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -175.93 30.69 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.74 0.305 . . . . 0.0 111.412 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.46 ' HB2' ' HB3' ' A' ' 20' ' ' SER . 1.0 OUTLIER -79.22 -163.14 0.46 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.503 179.734 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.626 ' HA ' HG22 ' A' ' 109' ' ' THR . 40.5 m -104.13 149.44 25.23 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.413 ' CA ' ' HG ' ' A' ' 110' ' ' LEU . . . -107.21 145.29 16.0 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.2 -1.0 . . . . 0.0 113.639 -178.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.657 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 0.0 OUTLIER -108.86 123.6 49.31 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 178.939 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.759 HD23 ' N ' ' A' ' 28' ' ' ARG . 6.6 tt -104.27 163.52 12.36 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -178.304 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.759 ' N ' HD23 ' A' ' 27' ' ' LEU . 0.1 OUTLIER 145.86 58.67 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.425 1.09 . . . . 0.0 109.368 179.966 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.477 ' HA2' ' HG ' ' A' ' 3' ' ' LEU . . . 75.91 6.7 82.84 Favored Glycine 0 C--N 1.335 0.524 0 C-N-CA 120.109 -1.043 . . . . 0.0 110.727 -177.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.471 ' C ' ' ND2' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -166.12 165.9 17.43 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 -179.52 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.765 ' CG1' HD12 ' A' ' 8' ' ' LEU . 0.7 OUTLIER -131.89 118.09 36.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.522 0.677 . . . . 0.0 111.215 178.763 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.647 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -104.92 166.07 10.63 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.901 -179.38 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.547 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -103.9 116.36 32.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.239 0.542 . . . . 0.0 111.344 -179.528 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.404 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 5.9 t30 -97.74 120.59 38.4 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.718 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.0 ttpp -114.15 -25.47 8.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.986 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -60.01 -55.0 39.45 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.818 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.57 -169.44 2.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.548 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.492 ' O ' ' HB3' ' A' ' 39' ' ' PHE . 29.7 p -132.67 -43.17 0.91 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.465 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.649 ' CD1' HG23 ' A' ' 109' ' ' THR . 0.0 OUTLIER 91.2 175.02 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.269 0.628 . . . . 0.0 110.746 -179.545 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.576 ' HB3' ' O ' ' A' ' 39' ' ' PHE . 0.1 OUTLIER 150.08 62.82 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.878 0.871 . . . . 0.0 109.803 -179.667 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.772 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . 67.27 -88.78 0.16 Allowed Glycine 0 CA--C 1.522 0.511 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.072 -178.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.75 HD23 ' HB2' ' A' ' 48' ' ' ALA . 13.6 tp 42.86 172.07 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 117.41 0.605 . . . . 0.0 111.915 179.257 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -127.85 34.79 4.57 Favored 'General case' 0 C--N 1.329 -0.285 0 O-C-N 121.81 -0.556 . . . . 0.0 111.655 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.972 HD13 ' HB3' ' A' ' 48' ' ' ALA . 30.2 mm 56.61 7.34 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 179.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -91.6 -31.23 15.97 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.723 0.297 . . . . 0.0 111.456 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.62 ' HB2' HD11 ' A' ' 42' ' ' LEU . 0.3 OUTLIER -91.78 -53.26 4.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.22 -179.828 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.74 ' H ' HD21 ' A' ' 42' ' ' LEU . . . 177.52 71.36 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.585 -0.816 . . . . 0.0 112.799 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.972 ' HB3' HD13 ' A' ' 44' ' ' ILE . . . -135.31 161.67 34.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.674 0.273 . . . . 0.0 110.775 179.731 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 29.4 mtt180 -93.83 134.22 36.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.115 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.619 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 7.0 mt-10 -51.29 -27.0 8.27 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.164 0.507 . . . . 0.0 110.732 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . 0.507 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 31.1 p -69.82 -57.87 4.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.346 179.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.412 ' H ' ' HG3' ' A' ' 52' ' ' GLU . 40.3 mt-10 -44.28 -50.69 8.85 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.183 179.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.619 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -65.04 -51.73 59.92 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.425 -179.815 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 50' ' ' GLU . 53.7 t -56.6 -37.48 52.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.84 ' CE1' ' HB1' ' A' ' 113' ' ' ALA . 0.2 OUTLIER -59.96 -47.61 85.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.179 -0.918 . . . . 0.0 109.429 178.746 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.752 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -54.79 -64.55 0.8 Allowed 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.83 178.75 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.4 ' O ' ' CB ' ' A' ' 61' ' ' SER . 2.6 mm-40 -39.87 -48.73 2.35 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.814 179.25 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.485 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 0.9 OUTLIER -65.19 -54.05 35.53 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.557 179.787 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.872 HG23 HD12 ' A' ' 117' ' ' LEU . 0.6 OUTLIER -48.42 -41.15 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 N-CA-C 112.562 0.579 . . . . 0.0 112.562 -178.74 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.739 ' CD1' HD21 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -93.36 -17.06 23.98 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.414 -0.515 . . . . 0.0 110.674 179.875 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.485 ' HB2' ' HA ' ' A' ' 58' ' ' THR . 1.8 m -66.57 -63.21 1.12 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.702 178.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . 0.503 ' CE1' ' HA ' ' A' ' 59' ' ' VAL . 4.7 p-80 -64.19 -43.34 95.38 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 121.159 0.504 . . . . 0.0 109.674 179.572 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.855 HG22 ' HB2' ' A' ' 120' ' ' ALA . 4.8 t -54.77 -60.03 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.555 178.35 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.532 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 40.45 26.06 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 115.374 -0.83 . . . . 0.0 113.152 178.673 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.681 ' H ' HG12 ' A' ' 63' ' ' VAL . 7.3 t30 149.92 -68.89 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 122.788 0.435 . . . . 0.0 110.848 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.769 ' CG2' HG13 ' A' ' 63' ' ' VAL . 23.4 m 45.24 -162.5 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.723 ' HB ' ' HB3' ' A' ' 97' ' ' ASN . 10.7 m -142.16 77.05 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.099 0 CA-C-O 121.012 0.434 . . . . 0.0 110.432 -178.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 1.094 HD22 HD11 ' A' ' 76' ' ' LEU . 0.2 OUTLIER -70.93 80.73 0.65 Allowed 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.971 -179.026 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 69.0 p -48.11 166.61 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 178.363 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -39.81 -35.02 0.3 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.043 0.449 . . . . 0.0 111.753 -179.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.444 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 3.2 tp10 -64.19 -48.2 76.85 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.189 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.682 ' O ' HD12 ' A' ' 76' ' ' LEU . 81.0 m-20 -70.96 -52.13 21.64 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.447 179.612 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.668 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 89.9 m -45.68 -39.41 7.91 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.136 0.493 . . . . 0.0 110.207 178.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.461 ' HA ' ' HG ' ' A' ' 77' ' ' LEU . . . -73.65 -41.85 62.17 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 178.203 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.951 ' HB3' ' CG2' ' A' ' 115' ' ' VAL . 0.1 OUTLIER -50.29 -44.97 54.14 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 113.684 -1.598 . . . . 0.0 108.636 176.971 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 1.094 HD11 HD22 ' A' ' 68' ' ' LEU . 2.1 mp -64.24 -54.14 38.13 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.561 178.282 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.668 ' HG ' ' O ' ' A' ' 73' ' ' THR . 5.1 mt -49.18 -39.87 31.05 Favored 'General case' 0 C--N 1.34 0.192 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 179.273 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 16.1 mt-30 -59.96 -53.33 59.1 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.75 178.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . 0.542 ' CB ' ' HG3' ' A' ' 111' ' ' GLN . 0.0 OUTLIER -49.26 -49.25 44.24 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.297 179.337 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.808 -179.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . 0.473 ' O ' ' HB2' ' A' ' 104' ' ' ARG . 5.6 p-10 . . . . . 0 C--O 1.233 0.232 0 CA-C-O 120.884 0.373 . . . . 0.0 110.565 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.636 ' HE2' HD12 ' A' ' 90' ' ' LEU . 0.3 OUTLIER -80.64 132.57 35.62 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-O 121.216 0.531 . . . . 0.0 112.053 -179.474 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.792 ' O ' ' O ' ' A' ' 101' ' ' VAL . 0.5 OUTLIER -105.96 125.83 51.46 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 104.891 -2.263 . . . . 0.0 104.891 176.611 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.636 HD12 ' HE2' ' A' ' 88' ' ' TYR . 3.1 mt -122.17 134.49 54.72 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 115.45 1.648 . . . . 0.0 115.45 -174.276 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.8 ttt-85 -129.04 104.49 7.6 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 104.628 -2.36 . . . . 0.0 104.628 175.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.434 ' CB ' ' HB3' ' A' ' 98' ' ' SER . 2.7 m -104.21 165.35 11.11 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 115.842 1.793 . . . . 0.0 115.842 -174.119 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.704 HG23 ' HA ' ' A' ' 98' ' ' SER . 0.2 OUTLIER . . . . . 0 C--N 1.324 -0.517 0 CA-C-N 111.733 -2.485 . . . . 0.0 107.023 178.23 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.723 ' HB3' ' HB ' ' A' ' 67' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.216 -0.704 0 CA-C-O 121.236 0.541 . . . . 0.0 112.34 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.704 ' HA ' HG23 ' A' ' 93' ' ' VAL . 3.9 m -155.25 142.34 19.25 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.239 178.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.433 HG13 ' HA ' ' A' ' 65' ' ' ASN . 84.1 t -104.12 133.45 48.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.835 -177.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 1.053 HD11 ' HB3' ' A' ' 102' ' ' SER . 3.3 tm? -104.42 120.9 42.29 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 113.848 1.055 . . . . 0.0 113.848 -178.205 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.792 ' O ' ' O ' ' A' ' 89' ' ' ASP . 1.5 p -124.07 103.91 13.29 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 N-CA-C 103.686 -2.709 . . . . 0.0 103.686 174.299 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 1.053 ' HB3' HD11 ' A' ' 100' ' ' LEU . 1.2 t -144.2 165.58 27.44 Favored 'General case' 0 CA--C 1.492 -1.255 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -173.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.739 HD21 ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER 161.86 -81.71 0.0 OUTLIER 'General case' 0 N--CA 1.428 -1.549 0 CA-C-N 112.669 -2.059 . . . . 0.0 110.744 175.78 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.574 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 46.66 31.46 1.4 Allowed 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.341 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.584 ' HB3' ' N ' ' A' ' 42' ' ' LEU . 58.3 m 129.68 164.82 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.597 1.159 . . . . 0.0 108.453 -178.219 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.553 ' HB3' ' HB2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -104.96 102.19 11.72 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -177.737 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.772 ' HB2' ' O ' ' A' ' 41' ' ' GLY . 2.1 mt-30 -169.43 162.59 10.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.84 177.26 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.556 ' HB2' ' HB2' ' A' ' 56' ' ' ALA . 1.2 tpt -164.76 147.34 8.47 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.363 -0.535 . . . . 0.0 112.002 178.495 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . 0.649 HG23 ' CD1' ' A' ' 39' ' ' PHE . 0.3 OUTLIER -109.25 164.84 12.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.348 179.474 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.876 HD23 HG23 ' A' ' 12' ' ' VAL . 1.0 OUTLIER -50.44 -53.9 26.1 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.199 0.523 . . . . 0.0 110.17 179.316 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . 0.832 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 1.9 tp-100 -51.22 -65.94 0.47 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.281 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 0.6 ' HA ' HG12 ' A' ' 115' ' ' VAL . 1.2 t0 -50.14 -47.48 54.19 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-O 121.542 0.687 . . . . 0.0 110.782 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 0.862 ' HA ' HG21 ' A' ' 59' ' ' VAL . . . -53.47 -50.16 65.93 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.86 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.845 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -70.67 -33.58 71.09 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.797 -178.648 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.951 ' CG2' ' HB3' ' A' ' 75' ' ' LYS . 4.0 p -62.45 -52.18 63.08 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.104 0 C-N-CA 119.082 -1.047 . . . . 0.0 110.229 179.524 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.731 HD22 HG13 ' A' ' 59' ' ' VAL . 3.1 mp -64.2 -39.77 94.69 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-N 114.44 -1.255 . . . . 0.0 110.182 -178.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.983 HD21 HD23 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -74.26 -16.67 60.94 Favored 'General case' 0 CA--C 1.511 -0.52 0 C-N-CA 120.369 -0.532 . . . . 0.0 111.161 178.99 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.715 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 0.0 OUTLIER -72.17 -47.96 46.94 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 106.152 -1.795 . . . . 0.0 106.152 176.77 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.423 ' O ' ' HB2' ' A' ' 123' ' ' GLN . . . -72.46 -28.19 62.77 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.846 177.102 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.855 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -68.89 -62.35 1.42 Allowed 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.948 179.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.74 HD22 ' CG ' ' A' ' 9' ' ' HIS . 0.1 OUTLIER -60.47 -37.57 81.44 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.718 -179.502 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.715 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.1 OUTLIER -70.17 -34.46 73.02 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -179.836 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.606 ' HB2' HG22 ' A' ' 67' ' ' VAL . 0.0 OUTLIER -90.95 -26.63 19.17 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.554 0.575 . . . . 0.0 112.554 -178.542 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -95.68 -66.26 0.92 Allowed 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 -178.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.327 -0.383 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -178.081 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 5.4 p30 . . . . . 0 N--CA 1.461 0.095 0 CA-C-O 121.009 0.433 . . . . 0.0 111.137 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 1.008 HD11 HD13 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -95.48 -94.98 0.18 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.383 179.048 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.433 ' O ' ' HB2' ' A' ' 8' ' ' LEU . 40.6 t -141.96 -168.74 2.76 Favored 'General case' 0 C--N 1.335 -0.062 0 CA-C-O 120.742 0.306 . . . . 0.0 110.592 179.459 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.884 HD23 HD23 ' A' ' 117' ' ' LEU . 0.8 OUTLIER -95.51 -66.18 0.93 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.457 0.646 . . . . 0.0 111.397 -179.914 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.58 -37.55 87.95 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.492 -178.698 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . 0.512 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 0.5 OUTLIER -66.12 -52.25 50.3 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 178.469 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 1.008 HD13 HD11 ' A' ' 3' ' ' LEU . 42.5 tp -49.24 -54.22 17.82 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.113 178.328 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.598 ' CG ' HD22 ' A' ' 121' ' ' LEU . 42.7 t-80 -53.45 -41.44 66.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.883 178.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.512 ' HB2' ' O ' ' A' ' 7' ' ' ASP . 3.1 mmt85 -56.47 -57.76 10.93 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.691 -179.506 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.814 ' HG3' HG12 ' A' ' 31' ' ' VAL . 0.6 OUTLIER -64.81 -49.95 68.65 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 120.444 -0.502 . . . . 0.0 111.624 -179.313 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.957 HG23 HD23 ' A' ' 110' ' ' LEU . 9.8 p -60.08 -47.9 90.06 Favored 'Isoleucine or valine' 0 C--O 1.24 0.578 0 CA-C-O 121.119 0.485 . . . . 0.0 110.803 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.658 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 53.0 m -63.59 -49.35 73.7 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.28 179.305 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.443 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 13.3 mtp180 -61.76 -23.5 66.21 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.414 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.622 HD12 ' HA ' ' A' ' 12' ' ' VAL . 8.7 mt -72.61 -61.89 1.64 Allowed 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 121.009 0.433 . . . . 0.0 110.656 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.711 HG13 ' C ' ' A' ' 21' ' ' GLY . 23.1 t -70.24 -30.92 45.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.242 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.437 ' CG ' ' O ' ' A' ' 13' ' ' SER . 0.4 OUTLIER -71.71 -19.09 62.1 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.132 -179.51 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.443 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 1.8 pt20 -155.63 50.4 0.55 Allowed 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.697 178.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -178.75 -66.5 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.814 0.34 . . . . 0.0 111.885 179.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.462 ' HB2' ' HA ' ' A' ' 16' ' ' VAL . 1.8 m -77.27 -81.37 0.09 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.536 -178.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . 0.711 ' C ' HG13 ' A' ' 16' ' ' VAL . . . 124.55 -45.25 1.19 Allowed Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 121.081 -0.581 . . . . 0.0 111.802 -179.591 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 179.94 32.08 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.101 0.477 . . . . 0.0 110.141 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.418 ' HB3' ' O ' ' A' ' 34' ' ' ASN . 21.4 m -80.36 -163.3 0.54 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.202 -179.586 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.753 HG21 ' CD2' ' A' ' 39' ' ' PHE . 20.5 m -104.56 142.34 34.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.946 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -105.3 139.91 14.86 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.437 -0.887 . . . . 0.0 113.49 -178.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.919 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -110.59 135.38 51.32 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 179.193 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.58 HD23 ' N ' ' A' ' 28' ' ' ARG . 4.4 tt -104.89 160.58 14.9 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -178.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.58 ' N ' HD23 ' A' ' 27' ' ' LEU . 0.0 OUTLIER 158.75 55.31 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.202 -179.947 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.431 ' O ' HD23 ' A' ' 3' ' ' LEU . . . 76.7 2.74 77.18 Favored Glycine 0 C--N 1.334 0.426 0 N-CA-C 110.632 -0.987 . . . . 0.0 110.632 -177.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.448 ' C ' ' ND2' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -166.18 165.47 17.58 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 -179.845 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.814 HG12 ' HG3' ' A' ' 11' ' ' GLN . 1.7 p -116.35 128.92 73.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 121.4 0.619 . . . . 0.0 111.205 178.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.919 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -115.56 165.68 12.75 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.076 -0.965 . . . . 0.0 110.416 179.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.591 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -104.0 137.99 41.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.199 0.524 . . . . 0.0 111.855 -179.327 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.526 HD21 HG23 ' A' ' 37' ' ' THR . 2.9 t30 -122.27 113.81 19.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.319 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.86 -23.53 10.52 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.258 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -50.92 -45.02 60.29 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.891 0.377 . . . . 0.0 110.742 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.579 HG21 ' CE1' ' A' ' 39' ' ' PHE . 10.2 t -128.2 -158.12 0.86 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.259 179.404 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 26.0 p -155.11 100.93 2.21 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.953 0.406 . . . . 0.0 111.036 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.867 ' O ' HG23 ' A' ' 109' ' ' THR . 10.9 m-85 -86.26 131.85 34.13 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.682 0.754 . . . . 0.0 111.911 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.654 ' H ' ' NE2' ' A' ' 107' ' ' GLN . 0.1 OUTLIER -160.03 81.88 0.71 Allowed 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.519 -1.218 . . . . 0.0 109.811 179.728 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.41 ' H ' ' CB ' ' A' ' 107' ' ' GLN . . . 69.32 101.34 0.04 OUTLIER Glycine 0 CA--C 1.525 0.662 0 CA-C-N 115.954 -0.566 . . . . 0.0 113.179 -179.705 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.743 ' HB2' ' NE2' ' A' ' 107' ' ' GLN . 0.0 OUTLIER -159.71 -144.34 0.11 Allowed 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 110.256 -0.275 . . . . 0.0 110.256 179.096 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.587 ' H ' HD12 ' A' ' 42' ' ' LEU . 0.2 OUTLIER -162.19 21.95 0.1 Allowed 'General case' 0 CA--C 1.529 0.145 0 O-C-N 121.832 -0.543 . . . . 0.0 112.088 -179.515 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.655 ' HA ' ' HB3' ' A' ' 48' ' ' ALA . 1.8 mp 66.44 4.45 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 179.512 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.62 -57.15 3.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.902 0.382 . . . . 0.0 111.184 -179.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.0 p -61.63 -59.6 4.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.989 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -179.78 76.81 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.327 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.677 ' HB1' ' OE2' ' A' ' 52' ' ' GLU . . . -138.4 -158.61 0.87 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.552 0.215 . . . . 0.0 111.151 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.415 ' O ' ' OE2' ' A' ' 52' ' ' GLU . 9.6 mtm180 -140.5 -174.54 3.99 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 120.874 0.369 . . . . 0.0 111.253 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.764 ' O ' HG23 ' A' ' 54' ' ' VAL . 21.7 tt0 -85.29 -30.83 23.44 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.979 0.418 . . . . 0.0 111.212 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . 0.592 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 0.3 OUTLIER -59.14 -65.31 0.69 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.842 -179.999 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.677 ' OE2' ' HB1' ' A' ' 48' ' ' ALA . 0.1 OUTLIER -35.59 -65.38 0.25 Allowed 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.662 179.947 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.502 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -51.08 -52.31 44.75 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.522 179.822 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.764 HG23 ' O ' ' A' ' 50' ' ' GLU . 94.6 t -55.91 -35.35 40.18 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 CA-C-O 121.007 0.432 . . . . 0.0 109.941 179.104 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.675 ' O ' HG12 ' A' ' 59' ' ' VAL . 0.2 OUTLIER -70.86 -45.23 64.81 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.409 179.299 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.567 ' HB2' ' HB2' ' A' ' 108' ' ' MET . . . -61.77 -46.93 87.44 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.39 179.48 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 -62.82 -44.04 97.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.648 179.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.505 ' OG1' HD13 ' A' ' 27' ' ' LEU . 16.7 p -64.53 -56.54 13.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.933 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 1.082 HG23 HD12 ' A' ' 117' ' ' LEU . 12.3 p -60.4 -44.18 95.55 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.59 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.808 HD13 HD23 ' A' ' 103' ' ' LEU . 4.7 tp -55.96 -42.77 76.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.903 0.383 . . . . 0.0 110.226 179.293 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 62.7 m -61.83 -58.77 6.68 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.832 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 10.8 m-70 -55.16 -32.74 62.38 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.136 0.493 . . . . 0.0 110.312 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 1.09 HG13 HG11 ' A' ' 66' ' ' VAL . 3.6 t -100.26 59.2 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.282 179.393 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.492 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . -83.4 34.67 0.48 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.61 -179.509 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.522 ' HA ' HG22 ' A' ' 99' ' ' VAL . 7.4 t-20 153.82 -61.78 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 122.855 0.462 . . . . 0.0 110.379 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 1.09 HG11 HG13 ' A' ' 63' ' ' VAL . 18.8 m 40.77 -163.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 1.006 HG22 ' HB2' ' A' ' 123' ' ' GLN . 29.3 m -148.44 75.23 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.437 -1.112 0 CA-C-O 120.939 0.399 . . . . 0.0 111.131 -178.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.929 ' CD2' HD11 ' A' ' 76' ' ' LEU . 0.3 OUTLIER -65.0 98.73 0.31 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.874 -179.849 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.832 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 1.4 p -66.92 -172.3 0.18 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.61 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.72 -34.62 12.41 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 120.97 0.414 . . . . 0.0 110.702 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.591 ' O ' ' HE2' ' A' ' 75' ' ' LYS . 0.1 OUTLIER -72.28 -65.72 0.74 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.41 179.776 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.866 ' O ' HD12 ' A' ' 76' ' ' LEU . 0.6 OUTLIER -52.84 -33.98 51.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.45 179.583 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.787 HG23 ' O ' ' A' ' 68' ' ' LEU . 11.7 p -62.55 -55.87 23.25 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 178.02 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.67 -24.39 61.15 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 108.609 -0.885 . . . . 0.0 108.609 177.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 1.087 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -62.52 -65.2 0.72 Allowed 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.733 -1.122 . . . . 0.0 109.981 178.716 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.929 HD11 ' CD2' ' A' ' 68' ' ' LEU . 4.3 mp -50.73 -39.94 53.09 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 178.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.86 -64.17 0.92 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.706 178.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 5.7 tt0 -58.52 -52.39 65.84 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.832 -179.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . 0.486 ' CB ' ' HG2' ' A' ' 111' ' ' GLN . 1.3 t -53.83 -27.65 30.96 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.485 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 89.0 m . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.321 -179.326 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . 0.515 ' HA ' ' HB2' ' A' ' 104' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--O 1.23 0.079 0 CA-C-O 120.394 0.14 . . . . 0.0 111.187 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.511 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 5.0 m-85 -92.4 138.43 31.52 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 120.257 -0.577 . . . . 0.0 111.026 -179.623 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.788 ' CG ' HG13 ' A' ' 101' ' ' VAL . 1.2 t0 -120.23 148.01 44.22 Favored 'General case' 0 N--CA 1.436 -1.129 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -179.129 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.768 HD12 ' N ' ' A' ' 90' ' ' LEU . 0.0 OUTLIER -147.72 165.44 30.49 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -177.966 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.594 ' O ' ' CB ' ' A' ' 98' ' ' SER . 10.9 ttm105 -137.4 158.72 43.8 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 114.414 -1.266 . . . . 0.0 108.869 178.705 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.794 ' O ' HG13 ' A' ' 93' ' ' VAL . 56.8 p -104.42 159.35 15.8 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.714 0.769 . . . . 0.0 112.567 -179.013 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.794 HG13 ' O ' ' A' ' 92' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.44 -0.948 0 CA-C-N 113.931 -1.486 . . . . 0.0 108.17 -179.057 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.832 ' HA ' ' HA ' ' A' ' 69' ' ' THR . 0.6 OUTLIER . . . . . 0 N--CA 1.45 -0.429 0 N-CA-C 109.959 -0.386 . . . . 0.0 109.959 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.594 ' CB ' ' O ' ' A' ' 91' ' ' ARG . 0.2 OUTLIER -140.79 164.53 29.97 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.493 0.663 . . . . 0.0 110.878 179.663 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.522 HG22 ' HA ' ' A' ' 65' ' ' ASN . 0.5 OUTLIER -104.2 145.61 12.73 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.328 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.713 HD13 ' CD1' ' A' ' 116' ' ' LEU . 0.3 OUTLIER -103.55 104.88 15.0 Favored 'General case' 0 CA--C 1.507 -0.695 0 C-N-CA 119.431 -0.908 . . . . 0.0 112.557 -179.131 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.788 HG13 ' CG ' ' A' ' 89' ' ' ASP . 1.3 p -116.35 103.24 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.186 0 N-CA-C 103.256 -2.868 . . . . 0.0 103.256 173.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 0.638 ' O ' HD23 ' A' ' 103' ' ' LEU . 0.1 OUTLIER -144.85 163.6 33.59 Favored 'General case' 0 C--N 1.303 -1.452 0 C-N-CA 119.131 -1.028 . . . . 0.0 112.597 -174.613 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.808 HD23 HD13 ' A' ' 60' ' ' LEU . 0.1 OUTLIER 159.45 -82.3 0.0 OUTLIER 'General case' 0 N--CA 1.435 -1.197 0 CA-C-N 113.801 -1.545 . . . . 0.0 111.39 176.967 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.569 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 46.28 32.98 1.65 Allowed 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.999 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.659 ' HB3' ' N ' ' A' ' 42' ' ' LEU . 52.7 m 129.55 162.96 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.674 1.19 . . . . 0.0 108.104 -178.021 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.412 ' HB3' ' HB3' ' A' ' 53' ' ' LYS . 0.7 OUTLIER -104.84 102.11 11.67 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 119.838 -0.745 . . . . 0.0 112.394 -178.865 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.743 ' NE2' ' HB2' ' A' ' 42' ' ' LEU . 1.3 mt-30 -168.29 127.98 1.24 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.397 177.698 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.567 ' HB2' ' HB2' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -130.85 143.29 50.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.353 0.597 . . . . 0.0 112.324 -179.575 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . 0.867 HG23 ' O ' ' A' ' 39' ' ' PHE . 0.3 OUTLIER -104.55 165.12 11.27 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.432 179.378 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.957 HD23 HG23 ' A' ' 12' ' ' VAL . 0.3 OUTLIER -53.75 -59.53 4.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.779 0.323 . . . . 0.0 110.673 179.983 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . 0.867 ' O ' HG23 ' A' ' 115' ' ' VAL . 1.2 tp60 -49.26 -59.57 3.57 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 121.1 0.476 . . . . 0.0 110.986 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 0.878 ' O ' HD22 ' A' ' 116' ' ' LEU . 1.3 m-20 -50.68 -47.47 58.86 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.139 0.495 . . . . 0.0 110.59 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 0.599 ' HB1' ' CE1' ' A' ' 55' ' ' PHE . . . -49.94 -60.04 3.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.692 179.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.663 ' NZ ' HG22 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -66.13 -21.5 66.34 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.153 179.87 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 1.087 HG22 ' CG ' ' A' ' 75' ' ' LYS . 46.0 t -62.62 -61.64 1.55 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.82 0 CA-C-O 121.876 0.846 . . . . 0.0 109.839 179.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.9 ' CB ' HG21 ' A' ' 63' ' ' VAL . 0.0 OUTLIER -63.99 -39.8 94.94 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 114.8 -1.091 . . . . 0.0 109.879 179.837 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 1.082 HD12 HG23 ' A' ' 59' ' ' VAL . 0.2 OUTLIER -71.06 -18.63 62.55 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.946 179.86 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.563 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 2.7 tt0 -71.99 -54.09 10.98 Favored 'General case' 0 N--CA 1.441 -0.923 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 176.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -71.33 -22.56 61.91 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 114.679 -1.146 . . . . 0.0 111.028 177.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.783 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -76.01 -54.42 6.89 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.214 179.754 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.598 HD22 ' CG ' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -63.71 -27.94 69.56 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.83 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.563 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -73.18 -43.7 61.01 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.917 -0.583 . . . . 0.0 112.064 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 1.006 ' HB2' HG22 ' A' ' 67' ' ' VAL . 1.5 tt0 -95.11 -25.79 16.29 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 113.496 0.924 . . . . 0.0 113.496 -178.169 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . 0.402 ' CG ' ' O ' ' A' ' 120' ' ' ALA . 2.5 mm-40 -85.24 -66.41 0.9 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 -177.551 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 4.7 p . . . . . 0 C--N 1.325 -0.473 0 CA-C-O 120.989 0.423 . . . . 0.0 112.079 -178.652 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . 0.408 ' HB3' ' CG2' ' A' ' 58' ' ' THR . 5.4 p-10 . . . . . 0 CA--C 1.528 0.118 0 CA-C-O 120.732 0.301 . . . . 0.0 110.776 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 1.115 HD22 ' O ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER -138.57 103.11 4.78 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 121.221 0.534 . . . . 0.0 111.225 179.816 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.612 ' O ' ' O ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER 40.15 175.1 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.707 0.765 . . . . 0.0 112.853 179.679 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.739 HD22 ' HA ' ' A' ' 121' ' ' LEU . 0.3 OUTLIER -95.93 -65.84 0.95 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.718 179.308 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.418 ' HB2' HD13 ' A' ' 121' ' ' LEU . 1.0 OUTLIER -60.18 -33.05 71.67 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.677 -1.147 . . . . 0.0 111.706 -179.113 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -65.48 -50.49 65.13 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 178.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.888 HD23 HD11 ' A' ' 117' ' ' LEU . 22.3 tp -55.32 -44.58 75.95 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.887 179.252 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.569 ' CD2' HD22 ' A' ' 121' ' ' LEU . 79.9 t60 -64.82 -41.32 95.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.557 0.694 . . . . 0.0 110.0 179.238 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 1.5 mtt180 -57.91 -50.13 74.38 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.996 -179.34 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.671 ' HG3' ' CG1' ' A' ' 31' ' ' VAL . 1.4 pt20 -66.63 -56.67 9.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.487 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.969 ' HA ' HD12 ' A' ' 15' ' ' LEU . 10.8 p -53.74 -48.32 61.17 Favored 'Isoleucine or valine' 0 C--O 1.242 0.704 0 CA-C-O 121.322 0.582 . . . . 0.0 111.142 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.679 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 62.7 m -62.52 -40.46 96.84 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.256 -179.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.466 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 1.2 tpm_? -64.69 -30.89 71.92 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.979 0.418 . . . . 0.0 110.095 -179.797 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.969 HD12 ' HA ' ' A' ' 12' ' ' VAL . 4.6 mt -71.33 -65.08 0.8 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.844 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.721 ' CG2' ' HB3' ' A' ' 110' ' ' LEU . 50.2 t -58.77 -45.95 91.02 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.403 0 C-N-CA 120.556 -0.458 . . . . 0.0 111.434 -179.003 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.45 ' CG ' ' O ' ' A' ' 13' ' ' SER . 6.1 mm-40 -62.7 -12.69 25.29 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.604 -178.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.466 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 3.6 pt20 -170.59 60.18 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.163 0 CA-C-O 120.786 0.326 . . . . 0.0 111.56 178.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.534 ' N ' ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER 177.79 -58.72 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 179.817 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.1 m -87.93 -79.63 0.29 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.853 0.359 . . . . 0.0 111.748 -178.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . 0.414 ' O ' ' CB ' ' A' ' 22' ' ' ASP . . . 107.64 54.11 0.65 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.726 -179.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.582 ' H ' HG13 ' A' ' 16' ' ' VAL . 0.0 OUTLIER 83.2 0.43 1.13 Allowed 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 179.338 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -60.73 -167.03 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 110.37 -0.233 . . . . 0.0 110.37 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.514 ' HA ' HG22 ' A' ' 109' ' ' THR . 12.7 m -104.47 138.31 41.05 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.528 ' CA ' ' HG ' ' A' ' 110' ' ' LEU . . . -114.57 156.24 15.79 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.209 -0.996 . . . . 0.0 113.236 -179.067 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.905 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -114.73 151.04 34.35 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.35 -0.241 . . . . 0.0 110.35 179.407 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.769 HD23 ' O ' ' A' ' 27' ' ' LEU . 5.9 tt -130.18 106.93 8.93 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.141 0.496 . . . . 0.0 112.037 -179.588 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.612 ' HG2' ' HD2' ' A' ' 26' ' ' LYS . 0.2 OUTLIER -134.33 52.28 2.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.584 -0.734 . . . . 0.0 109.253 178.457 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.413 ' O ' ' HG ' ' A' ' 3' ' ' LEU . . . 83.79 4.22 88.94 Favored Glycine 0 C--N 1.332 0.358 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 -176.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.463 ' C ' ' ND2' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -166.07 166.7 17.0 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 106.701 -1.592 . . . . 0.0 106.701 -179.512 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.847 HG13 HD11 ' A' ' 15' ' ' LEU . 11.3 p -113.54 137.96 44.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 C-N-CA 120.003 -0.679 . . . . 0.0 112.281 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.905 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -126.74 164.88 20.35 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.654 178.656 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -104.51 148.19 26.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.139 0.495 . . . . 0.0 111.623 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 42.2 t30 -135.97 117.52 14.85 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.301 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.14 3.33 9.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.4 -179.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -61.46 -53.08 61.14 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.951 0.405 . . . . 0.0 110.537 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.537 ' C ' HG22 ' A' ' 38' ' ' THR . 0.0 OUTLIER -128.04 -89.37 0.53 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.193 179.626 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.596 ' O ' ' HB3' ' A' ' 39' ' ' PHE . 0.1 OUTLIER 166.01 -105.45 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 110.259 -0.275 . . . . 0.0 110.259 179.457 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.7 ' CD1' HG23 ' A' ' 109' ' ' THR . 0.1 OUTLIER 169.25 -164.46 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 179.63 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.565 ' HB3' ' O ' ' A' ' 39' ' ' PHE . 0.1 OUTLIER 150.86 55.44 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.371 0.669 . . . . 0.0 110.441 179.833 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.559 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . 67.1 -65.39 0.21 Allowed Glycine 0 CA--C 1.523 0.578 0 C-N-CA 120.995 -0.621 . . . . 0.0 112.616 -179.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.804 ' O ' ' HB3' ' A' ' 105' ' ' SER . 0.4 OUTLIER 24.28 -138.83 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.203 0.601 . . . . 0.0 112.58 179.444 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.521 HG23 ' O ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -172.64 22.43 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 O-C-N 121.849 -0.532 . . . . 0.0 112.065 -179.934 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.709 HD12 ' N ' ' A' ' 44' ' ' ILE . 1.3 mp 63.37 2.42 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 120.822 0.344 . . . . 0.0 111.687 179.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.93 -22.15 25.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.839 0.352 . . . . 0.0 111.003 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.45 ' CB ' HD21 ' A' ' 42' ' ' LEU . 0.3 OUTLIER -101.8 -30.91 11.01 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.397 -179.705 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 177.94 -30.03 0.07 OUTLIER Glycine 0 CA--C 1.519 0.342 0 C-N-CA 120.169 -1.015 . . . . 0.0 113.556 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.57 ' HB2' ' OE1' ' A' ' 107' ' ' GLN . . . -48.32 173.46 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 117.1 0.45 . . . . 0.0 111.488 -179.584 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.438 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 23.0 mtp85 -121.89 173.24 7.63 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.527 -179.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.87 ' O ' HG22 ' A' ' 54' ' ' VAL . 0.8 OUTLIER -66.81 -29.97 70.05 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.115 0.483 . . . . 0.0 110.54 179.762 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . 0.536 ' CB ' ' CB ' ' A' ' 26' ' ' LYS . 0.3 OUTLIER -49.75 -65.18 0.61 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.461 179.548 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.505 ' HB2' ' HG2' ' A' ' 107' ' ' GLN . 0.2 OUTLIER -52.56 -62.21 1.79 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.264 -179.15 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.593 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -46.68 -59.14 3.22 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 -178.563 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.87 HG22 ' O ' ' A' ' 50' ' ' GLU . 15.9 m -51.91 -47.36 41.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.46 0 CA-C-O 120.887 0.375 . . . . 0.0 110.732 -179.783 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.567 ' HE2' HG23 ' A' ' 31' ' ' VAL . 0.1 OUTLIER -57.29 -46.68 82.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.553 179.156 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.691 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -54.69 -50.99 66.94 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-O 120.85 0.357 . . . . 0.0 110.681 179.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -57.92 -40.24 79.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.4 179.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.47 HG22 ' CD2' ' A' ' 62' ' ' HIS . 0.9 OUTLIER -67.28 -63.98 0.95 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.978 179.791 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.919 ' O ' HG22 ' A' ' 63' ' ' VAL . 14.4 p -53.36 -40.88 42.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.793 0.33 . . . . 0.0 110.342 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.852 HD13 ' CD2' ' A' ' 103' ' ' LEU . 0.5 OUTLIER -64.09 -38.8 92.37 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.758 179.464 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 61.3 m -72.69 -44.86 61.23 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.167 179.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . 0.47 ' CD2' HG22 ' A' ' 58' ' ' THR . 53.3 m-70 -51.72 -54.4 28.74 Favored 'General case' 0 CA--C 1.521 -0.163 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.126 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 1.041 HG12 HG11 ' A' ' 66' ' ' VAL . 0.0 OUTLIER -54.11 -78.8 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.806 179.266 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.61 ' H ' HG23 ' A' ' 63' ' ' VAL . . . 60.96 17.0 7.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.354 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.557 ' O ' HG22 ' A' ' 66' ' ' VAL . 0.6 OUTLIER 153.1 -68.22 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 122.765 0.426 . . . . 0.0 110.943 -179.831 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 1.041 HG11 HG12 ' A' ' 63' ' ' VAL . 23.1 m 49.01 -164.95 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.054 -179.473 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.813 ' HB ' ' HB3' ' A' ' 97' ' ' ASN . 15.8 m -152.26 50.26 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.169 0 CA-C-O 121.129 0.49 . . . . 0.0 110.842 -178.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.886 HD22 ' CD1' ' A' ' 76' ' ' LEU . 1.0 OUTLIER -43.33 103.93 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.343 -179.485 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.403 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 15.7 p -71.67 -164.82 0.13 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.773 178.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.1 -34.91 68.8 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.912 0.386 . . . . 0.0 110.808 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -70.69 -50.07 40.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.076 0.465 . . . . 0.0 110.434 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.833 ' HB3' HD23 ' A' ' 68' ' ' LEU . 66.7 m-20 -66.71 -36.25 82.05 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.641 179.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 38.8 m -65.87 -40.78 91.94 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.05 0.452 . . . . 0.0 109.812 178.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.13 -27.11 62.41 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 177.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 1.035 ' HG3' HG12 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -57.1 -59.72 4.67 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 114.044 -1.434 . . . . 0.0 109.642 178.228 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.907 HD21 HD21 ' A' ' 100' ' ' LEU . 3.2 mp -61.65 -49.89 74.71 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 178.707 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -44.07 -58.45 2.82 Favored 'General case' 0 CA--C 1.523 -0.086 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.263 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 25.8 mt-30 -61.07 -44.42 97.4 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.401 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -62.1 -22.44 65.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.96 179.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.278 -179.66 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 22.1 p-10 . . . . . 0 C--O 1.235 0.337 0 CA-C-O 120.635 0.255 . . . . 0.0 111.302 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.429 ' OH ' ' HG3' ' A' ' 108' ' ' MET . 24.8 m-85 -98.43 139.45 34.15 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 120.841 0.353 . . . . 0.0 110.376 179.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.686 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.4 OUTLIER -112.87 144.74 41.91 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 179.301 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.73 HD21 HD22 ' A' ' 100' ' ' LEU . 14.7 mt -137.62 132.46 33.05 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 114.618 1.34 . . . . 0.0 114.618 -176.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.558 ' HB3' ' HB ' ' A' ' 99' ' ' VAL . 4.1 ttp180 -104.78 165.48 11.04 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 105.291 -2.114 . . . . 0.0 105.291 175.137 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.608 ' HA ' ' HA ' ' A' ' 98' ' ' SER . 9.7 p -134.33 164.15 28.05 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 116.235 1.939 . . . . 0.0 116.235 -177.258 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.676 ' C ' ' O ' ' A' ' 97' ' ' ASN . 1.5 t . . . . . 0 C--O 1.237 0.429 0 CA-C-N 111.5 -2.591 . . . . 0.0 107.142 178.148 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.813 ' HB3' ' HB ' ' A' ' 67' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.433 -1.325 0 CA-C-O 121.842 0.83 . . . . 0.0 113.019 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.624 ' CA ' HG23 ' A' ' 93' ' ' VAL . 1.6 m -152.92 149.91 28.72 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 114.434 -1.257 . . . . 0.0 107.758 178.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.558 ' HB ' ' HB3' ' A' ' 91' ' ' ARG . 38.9 t -104.07 156.1 5.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 C-N-CA 120.634 -0.427 . . . . 0.0 111.787 -177.259 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.907 HD21 HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -109.2 128.14 54.8 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -177.899 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.686 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 17.7 t -141.3 104.31 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.929 0 N-CA-C 104.712 -2.329 . . . . 0.0 104.712 174.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 0.53 ' O ' HD23 ' A' ' 103' ' ' LEU . 0.1 OUTLIER -145.78 165.23 29.45 Favored 'General case' 0 C--N 1.311 -1.082 0 C-N-CA 118.495 -1.282 . . . . 0.0 113.788 -174.909 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.852 ' CD2' HD13 ' A' ' 60' ' ' LEU . 0.0 OUTLIER 154.51 -89.36 0.0 OUTLIER 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 113.456 -1.702 . . . . 0.0 111.358 176.896 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.533 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 59.07 21.33 9.26 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 -179.52 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.804 ' HB3' ' O ' ' A' ' 42' ' ' LEU . 5.4 m 140.92 173.26 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.432 1.093 . . . . 0.0 108.612 -178.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.81 102.22 11.78 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 119.986 -0.685 . . . . 0.0 112.545 -178.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.691 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -168.15 165.06 13.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.4 177.621 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.744 ' CE ' ' HB2' ' A' ' 113' ' ' ALA . 2.1 ttp -165.75 147.45 7.2 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.062 0.458 . . . . 0.0 111.916 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . 0.7 HG23 ' CD1' ' A' ' 39' ' ' PHE . 0.6 OUTLIER -114.7 161.38 18.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.794 178.867 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.721 ' HB3' ' CG2' ' A' ' 16' ' ' VAL . 18.2 mt -50.35 -59.22 4.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.89 0.376 . . . . 0.0 110.61 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . 0.904 ' O ' HG13 ' A' ' 115' ' ' VAL . 14.6 tp60 -45.13 -64.63 0.67 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.935 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 0.855 ' O ' HG22 ' A' ' 115' ' ' VAL . 0.4 OUTLIER -51.31 -38.14 51.4 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-O 121.526 0.679 . . . . 0.0 110.405 179.516 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 0.744 ' HB2' ' CE ' ' A' ' 108' ' ' MET . . . -55.05 -52.36 63.44 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.116 179.672 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.796 ' HZ2' HG22 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -79.63 -20.57 46.47 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.824 -178.866 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 1.035 HG12 ' HG3' ' A' ' 75' ' ' LYS . 9.0 m -65.17 -50.63 72.94 Favored 'Isoleucine or valine' 0 C--O 1.244 0.767 0 CA-C-O 122.129 0.966 . . . . 0.0 109.243 179.173 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.943 HD12 HG23 ' A' ' 115' ' ' VAL . 7.5 mp -69.31 -45.67 68.98 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 114.298 -1.319 . . . . 0.0 109.548 178.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.888 HD11 HD23 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -68.89 -15.2 63.43 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.805 179.328 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.648 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 8.6 tp10 -74.03 -51.74 14.91 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 106.295 -1.742 . . . . 0.0 106.295 177.101 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.497 ' HB2' ' OD2' ' A' ' 72' ' ' ASP . . . -72.34 -28.8 63.27 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.572 177.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.778 ' HA ' HG12 ' A' ' 66' ' ' VAL . . . -69.27 -55.16 11.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.98 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.739 ' HA ' HD22 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -64.24 -48.93 73.92 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.262 -179.73 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.648 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -59.28 -39.88 84.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.906 -179.833 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.584 ' HG3' HG13 ' A' ' 67' ' ' VAL . 12.0 tm0? -84.84 -34.04 22.74 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -178.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -96.48 -68.4 0.8 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -177.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.463 0.22 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -178.219 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . 0.554 ' ND2' HD22 ' A' ' 8' ' ' LEU . 0.7 OUTLIER . . . . . 0 N--CA 1.465 0.309 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.494 HD11 ' CA ' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -159.69 -46.37 0.05 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.831 0.348 . . . . 0.0 110.983 -179.752 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 169.59 138.65 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.423 -179.855 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 1.07 HD21 ' HB1' ' A' ' 120' ' ' ALA . 0.0 OUTLIER -55.97 -65.46 0.6 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.739 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p -49.98 -42.8 49.72 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.092 0.405 . . . . 0.0 112.092 -179.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . 0.422 ' O ' ' NE2' ' A' ' 11' ' ' GLN . 1.4 m-20 -73.42 -60.51 2.21 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 121.116 0.484 . . . . 0.0 110.009 179.724 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.932 HD23 HD11 ' A' ' 117' ' ' LEU . 12.4 tp -47.0 -44.18 20.03 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.394 179.157 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.734 ' CG ' HD22 ' A' ' 121' ' ' LEU . 38.4 t-80 -65.26 -44.84 86.8 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.644 0.735 . . . . 0.0 109.35 178.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.8 mmt85 -54.78 -54.67 39.08 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.772 -1.104 . . . . 0.0 111.584 -179.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.627 ' HG3' HG22 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -65.95 -48.14 72.32 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 120.951 -0.3 . . . . 0.0 111.757 -179.274 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.035 HG23 HD23 ' A' ' 110' ' ' LEU . 9.6 p -63.52 -49.6 81.89 Favored 'Isoleucine or valine' 0 C--O 1.243 0.725 0 CA-C-O 121.056 0.455 . . . . 0.0 111.266 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.654 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 72.8 m -56.41 -57.88 10.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.38 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.456 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 30.8 ttm180 -59.69 -35.47 74.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.149 0.5 . . . . 0.0 110.628 -179.645 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.573 ' CD1' HG23 ' A' ' 31' ' ' VAL . 10.6 mt -56.92 -65.33 0.63 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.866 -0.606 . . . . 0.0 112.155 -179.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.635 HG22 ' HB3' ' A' ' 20' ' ' SER . 1.4 t -70.93 -26.44 27.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 C-N-CA 120.276 -0.57 . . . . 0.0 110.724 -179.429 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.47 ' CG ' ' O ' ' A' ' 13' ' ' SER . 8.1 mm-40 -72.83 -21.87 60.89 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.367 179.596 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.456 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 11.7 pt20 -161.66 60.85 0.26 Allowed 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.767 0.317 . . . . 0.0 111.189 179.323 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 176.39 -61.62 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.778 179.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.652 ' OG ' ' HB1' ' A' ' 33' ' ' ALA . 0.4 OUTLIER -78.43 -81.28 0.1 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.78 0.324 . . . . 0.0 111.647 -179.229 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 106.06 60.32 0.61 Allowed Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.327 -179.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.8 t70 68.76 28.4 5.53 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.783 0.325 . . . . 0.0 111.142 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -91.02 -162.92 0.96 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.369 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.691 HG23 HG22 ' A' ' 109' ' ' THR . 0.0 OUTLIER -103.96 165.24 11.17 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 179.579 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.521 ' HA2' ' O ' ' A' ' 32' ' ' ALA . . . -133.67 153.02 20.67 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.013 -1.089 . . . . 0.0 113.276 -179.182 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.736 ' HG3' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -116.9 131.38 56.97 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 179.491 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.512 HD21 ' HA ' ' A' ' 2' ' ' ASN . 1.9 tt -105.93 146.75 29.6 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.168 0.509 . . . . 0.0 111.777 -179.526 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.584 ' NH2' HG11 ' A' ' 54' ' ' VAL . 0.0 OUTLIER 171.31 53.94 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.032 -179.935 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 86.27 -0.65 87.34 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 110.261 -1.135 . . . . 0.0 110.261 -177.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.432 ' C ' ' ND2' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -165.95 165.49 18.05 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 179.683 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.627 HG22 ' HG3' ' A' ' 11' ' ' GLN . 0.9 OUTLIER -121.02 116.62 50.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 C-N-CA 120.151 -0.62 . . . . 0.0 111.351 179.794 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.736 ' HB3' ' HG3' ' A' ' 26' ' ' LYS . . . -104.74 166.99 10.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.596 -179.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.652 ' HB1' ' OG ' ' A' ' 20' ' ' SER . . . -102.8 138.42 39.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.345 0.593 . . . . 0.0 111.872 -178.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 17.5 t30 -118.98 118.08 30.52 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.487 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.74 -29.79 5.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.226 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -59.38 -44.33 92.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.924 0.392 . . . . 0.0 110.911 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 30.6 p -121.33 -174.86 2.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.711 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 45.3 p -124.0 -115.64 0.29 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.14 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.56 ' C ' ' NE2' ' A' ' 107' ' ' GLN . 0.4 OUTLIER -171.47 -84.81 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.529 179.712 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.56 ' N ' ' CG ' ' A' ' 39' ' ' PHE . 0.5 OUTLIER 80.74 32.26 0.15 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 122.726 0.41 . . . . 0.0 112.001 179.872 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.534 ' N ' HE21 ' A' ' 107' ' ' GLN . . . 71.55 -20.11 0.83 Allowed Glycine 0 CA--C 1.526 0.746 0 C-N-CA 121.286 -0.483 . . . . 0.0 113.447 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.902 HD11 ' HB2' ' A' ' 46' ' ' SER . 7.0 tp -25.95 140.33 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.292 0.637 . . . . 0.0 112.635 179.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -99.15 30.47 3.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.392 -179.799 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.624 HD11 ' HD2' ' A' ' 53' ' ' LYS . 1.2 mp 67.5 3.24 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 179.79 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.71 -27.97 23.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.692 0.282 . . . . 0.0 111.475 -179.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.902 ' HB2' HD11 ' A' ' 42' ' ' LEU . 0.3 OUTLIER -91.32 -36.21 13.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.511 -179.632 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 156.13 48.49 0.01 OUTLIER Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.368 -0.92 . . . . 0.0 113.163 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.536 ' HB1' ' OE1' ' A' ' 107' ' ' GLN . . . -119.15 -172.46 2.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.851 0.358 . . . . 0.0 110.749 179.566 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -119.69 129.32 54.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.132 179.268 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.917 ' O ' HG22 ' A' ' 54' ' ' VAL . 2.6 mt-10 -43.42 -30.06 0.51 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.96 0.41 . . . . 0.0 111.043 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . 0.648 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -51.32 -59.92 3.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.303 179.769 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.618 ' CB ' ' HG2' ' A' ' 107' ' ' GLN . 3.3 mm-40 -53.57 -40.07 65.31 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.348 0.594 . . . . 0.0 109.886 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.624 ' HD2' HD11 ' A' ' 44' ' ' ILE . 0.1 OUTLIER -62.79 -65.49 0.68 Allowed 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.941 179.254 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.94 ' O ' HG23 ' A' ' 58' ' ' THR . 0.5 OUTLIER -51.37 -40.65 24.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 CA-C-O 120.862 0.363 . . . . 0.0 110.319 179.919 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.583 ' CZ ' ' HB1' ' A' ' 113' ' ' ALA . 0.8 OUTLIER -56.76 -44.86 82.2 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 178.586 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.716 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -56.61 -60.21 3.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.145 0.498 . . . . 0.0 109.794 178.56 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.452 ' O ' ' CB ' ' A' ' 61' ' ' SER . 2.0 mm-40 -46.95 -37.38 8.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.323 179.547 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.94 HG23 ' O ' ' A' ' 54' ' ' VAL . 26.3 p -66.87 -50.78 61.41 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.608 -179.423 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 1.007 ' CG1' HD12 ' A' ' 117' ' ' LEU . 0.1 OUTLIER -62.2 -46.33 96.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 120.187 -0.605 . . . . 0.0 112.349 -179.065 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.664 HD11 HD21 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -73.86 -28.48 61.6 Favored 'General case' 0 CA--C 1.515 -0.404 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.412 -179.313 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.452 ' CB ' ' O ' ' A' ' 57' ' ' GLN . 7.0 t -65.26 -54.58 27.22 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.019 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . 0.49 ' HB3' ' CD2' ' A' ' 5' ' ' LEU . 0.1 OUTLIER -69.06 -20.86 64.11 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 177.894 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 1.07 HG22 ' HB2' ' A' ' 120' ' ' ALA . 94.3 t -110.73 60.19 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.039 178.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -80.77 21.94 0.63 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.137 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 164.95 -53.08 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.908 0.385 . . . . 0.0 110.387 -179.55 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.94 ' CG1' HG13 ' A' ' 63' ' ' VAL . 27.2 m 43.49 -134.87 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.895 179.727 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.526 ' O ' ' O ' ' A' ' 98' ' ' SER . 3.5 p -156.4 -31.74 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 C-N-CA 120.586 -0.446 . . . . 0.0 111.835 -179.836 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 1.077 HD22 HD11 ' A' ' 76' ' ' LEU . 1.1 mt 37.84 98.73 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.434 -0.803 . . . . 0.0 113.052 178.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 33.9 p -73.46 -179.0 3.26 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.236 -0.654 . . . . 0.0 109.236 178.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.49 -34.09 3.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.998 0.428 . . . . 0.0 110.964 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -64.92 -63.06 1.2 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.929 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.92 ' O ' HD12 ' A' ' 76' ' ' LEU . 0.6 OUTLIER -55.86 -39.3 71.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.761 -179.899 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.67 -59.84 4.29 Favored 'General case' 0 C--O 1.241 0.625 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.507 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . . . -56.9 -28.86 62.43 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 177.579 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 1.083 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -60.91 -54.82 40.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.651 -1.159 . . . . 0.0 110.412 179.057 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 1.077 HD11 HD22 ' A' ' 68' ' ' LEU . 4.0 mp -60.71 -54.09 49.46 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.674 179.651 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.631 HD12 ' N ' ' A' ' 78' ' ' GLN . 3.7 pp -57.88 -29.2 64.85 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 120.462 -0.495 . . . . 0.0 110.583 -179.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.631 ' N ' HD12 ' A' ' 77' ' ' LEU . 44.4 tt0 -66.26 -59.41 3.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.985 0.421 . . . . 0.0 110.215 179.063 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 84.1 p -57.91 -28.25 64.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.799 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 4.3 m . . . . . 0 C--N 1.331 -0.238 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.284 -179.964 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 30.6 p30 . . . . . 0 C--O 1.236 0.346 0 CA-C-O 120.718 0.294 . . . . 0.0 111.556 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.515 ' CG ' ' HB3' ' A' ' 102' ' ' SER . 0.9 OUTLIER -99.06 141.75 31.42 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.226 -179.499 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.664 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.0 OUTLIER -113.42 139.55 48.82 Favored 'General case' 0 N--CA 1.436 -1.157 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 179.945 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.682 HD11 ' CB ' ' A' ' 76' ' ' LEU . 22.8 mt -137.37 147.18 45.31 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 112.909 0.707 . . . . 0.0 112.909 -177.583 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.439 ' O ' ' CB ' ' A' ' 98' ' ' SER . 25.9 mtm180 -125.32 142.69 51.35 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 177.797 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.534 ' O ' HG13 ' A' ' 93' ' ' VAL . 4.0 p -105.3 139.13 40.41 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 113.49 0.922 . . . . 0.0 113.49 -178.567 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.534 HG13 ' O ' ' A' ' 92' ' ' SER . 20.5 m . . . . . 0 N--CA 1.444 -0.774 0 CA-C-N 113.674 -1.603 . . . . 0.0 107.641 178.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.45 ' HB3' ' O ' ' A' ' 67' ' ' VAL . 0.2 OUTLIER . . . . . 0 C--O 1.226 -0.17 0 N-CA-C 110.545 -0.168 . . . . 0.0 110.545 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.526 ' O ' ' O ' ' A' ' 67' ' ' VAL . 0.9 OUTLIER -135.78 165.43 25.62 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.523 0.678 . . . . 0.0 111.384 -179.895 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.415 ' N ' ' O ' ' A' ' 91' ' ' ARG . 0.6 OUTLIER -103.52 148.92 7.88 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.227 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.903 ' HB2' HD11 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -103.72 108.34 19.59 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 -177.699 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.664 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -127.04 106.18 15.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 N-CA-C 104.735 -2.32 . . . . 0.0 104.735 175.378 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 0.569 ' OG ' ' N ' ' A' ' 89' ' ' ASP . 37.2 m -151.49 164.66 36.3 Favored 'General case' 0 C--N 1.309 -1.184 0 C-N-CA 117.922 -1.511 . . . . 0.0 114.776 -174.57 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.664 HD21 HD11 ' A' ' 60' ' ' LEU . 0.0 OUTLIER 157.16 -90.92 0.0 OUTLIER 'General case' 0 N--CA 1.435 -1.2 0 CA-C-N 112.877 -1.965 . . . . 0.0 111.745 175.635 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.665 ' O ' ' HB2' ' A' ' 105' ' ' SER . 0.0 OUTLIER 60.74 12.36 3.69 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 120.692 -0.403 . . . . 0.0 109.97 -179.218 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.665 ' HB2' ' O ' ' A' ' 104' ' ' ARG . 0.3 OUTLIER 157.94 162.25 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 -178.948 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.572 ' HB3' ' HG3' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -107.3 101.03 10.44 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 119.482 -0.887 . . . . 0.0 112.793 -179.08 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.716 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -169.12 164.33 11.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.714 177.033 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.496 ' HB2' ' HB2' ' A' ' 56' ' ' ALA . 0.7 OUTLIER -165.16 147.88 8.1 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 179.68 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . 0.691 HG22 HG23 ' A' ' 24' ' ' THR . 2.3 p -107.92 165.22 11.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.751 179.04 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 1.035 HD23 HG23 ' A' ' 12' ' ' VAL . 2.6 mt -56.21 -53.2 59.93 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.716 -0.393 . . . . 0.0 110.18 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . 0.874 ' O ' HG23 ' A' ' 115' ' ' VAL . 1.1 tp60 -49.22 -65.57 0.54 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.985 0.422 . . . . 0.0 110.089 179.431 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 0.889 ' O ' HD22 ' A' ' 116' ' ' LEU . 0.6 OUTLIER -48.71 -43.34 37.2 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.883 179.201 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 0.712 ' HB3' HG21 ' A' ' 12' ' ' VAL . . . -52.51 -62.7 1.47 Allowed 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.928 179.361 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.654 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -62.65 -26.98 68.91 Favored 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.75 179.975 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 1.083 HG22 ' CG ' ' A' ' 75' ' ' LYS . 59.1 t -56.89 -65.3 0.41 Allowed 'Isoleucine or valine' 0 C--O 1.248 0.99 0 CA-C-O 122.252 1.025 . . . . 0.0 110.495 179.101 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.889 HD22 ' O ' ' A' ' 112' ' ' ASP . 0.0 OUTLIER -60.33 -41.43 93.53 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 114.554 -1.203 . . . . 0.0 109.349 -179.7 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 1.035 HD23 HD13 ' A' ' 5' ' ' LEU . 0.2 OUTLIER -67.41 -18.39 65.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.001 179.169 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.654 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 0.9 OUTLIER -73.23 -44.59 59.29 Favored 'General case' 0 CA--C 1.503 -0.845 0 N-CA-C 106.721 -1.585 . . . . 0.0 106.721 177.968 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.509 ' HB1' ' H ' ' A' ' 68' ' ' LEU . . . -78.04 -28.6 49.05 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.106 177.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 1.07 ' HB1' HD21 ' A' ' 5' ' ' LEU . . . -69.37 -53.99 16.75 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.46 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.734 HD22 ' CG ' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -65.08 -44.47 88.79 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.765 179.869 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.654 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -56.62 -46.2 81.07 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.638 179.819 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.401 ' N ' ' HG2' ' A' ' 122' ' ' ARG . 19.9 mm100 -86.96 -28.94 22.41 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -177.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . 0.462 ' CG ' ' O ' ' A' ' 120' ' ' ALA . 0.5 OUTLIER -96.04 -67.03 0.87 Allowed 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 113.761 1.023 . . . . 0.0 113.761 -177.992 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.478 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -177.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . 0.428 ' CB ' HG21 ' A' ' 58' ' ' THR . 1.2 p-10 . . . . . 0 N--CA 1.457 -0.116 0 CA-C-O 121.021 0.439 . . . . 0.0 110.88 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 1.023 HD11 HD13 ' A' ' 8' ' ' LEU . 0.2 OUTLIER -106.91 -176.01 2.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.238 179.133 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -59.66 -176.91 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.905 0.384 . . . . 0.0 111.109 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 1.096 HD21 ' HB1' ' A' ' 120' ' ' ALA . 0.1 OUTLIER -90.72 -62.77 1.38 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.218 179.718 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.456 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 93.0 p -44.14 -38.51 3.72 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.773 -179.41 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.42 -47.61 32.72 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.878 0.37 . . . . 0.0 110.138 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 1.084 HD23 HD21 ' A' ' 117' ' ' LEU . 26.9 tp -60.4 -48.71 80.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.117 179.313 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.882 ' ND1' HD22 ' A' ' 121' ' ' LEU . 35.9 t-80 -61.99 -40.59 96.15 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 178.654 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.456 ' HB2' ' O ' ' A' ' 6' ' ' SER . 7.8 mtp180 -60.32 -55.13 37.35 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.34 179.815 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.67 ' HG3' ' CG1' ' A' ' 31' ' ' VAL . 2.6 pt20 -60.56 -55.42 33.55 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.643 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.793 ' O ' HG23 ' A' ' 16' ' ' VAL . 14.6 p -56.63 -51.71 62.79 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 CA-C-O 120.854 0.359 . . . . 0.0 111.371 179.774 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.624 ' HA ' ' HE2' ' A' ' 114' ' ' LYS . 44.1 t -65.05 -23.85 67.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 0.0 112.021 -179.669 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -77.54 -40.67 41.76 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 120.721 -0.392 . . . . 0.0 111.429 -179.014 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.884 HD13 HD21 ' A' ' 110' ' ' LEU . 0.0 OUTLIER -72.0 -46.84 55.73 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 119.472 -0.891 . . . . 0.0 109.224 179.343 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.933 HG22 ' HB3' ' A' ' 110' ' ' LEU . 42.0 t -57.84 -55.85 19.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.529 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.444 ' HG2' ' HE3' ' A' ' 114' ' ' LYS . 0.0 OUTLIER -70.5 -6.48 36.41 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.154 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.455 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 7.3 pt20 -171.87 64.47 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.586 -0.446 . . . . 0.0 111.883 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.455 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 1.9 tt0 174.58 -59.62 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.112 179.467 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.72 ' CB ' HD13 ' A' ' 110' ' ' LEU . 58.5 m -102.06 -42.32 6.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.402 -179.348 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 94.15 -46.7 2.22 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.643 -0.789 . . . . 0.0 111.766 -179.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.422 ' O ' ' O ' ' A' ' 23' ' ' CYS . 0.0 OUTLIER -176.71 12.5 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 111.636 0.236 . . . . 0.0 111.636 179.794 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.944 ' O ' HG22 ' A' ' 109' ' ' THR . 48.2 m -57.06 -154.08 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.935 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.746 HG21 ' CD2' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -104.28 151.13 23.78 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 121.068 0.461 . . . . 0.0 111.061 -179.727 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -104.81 135.97 12.83 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.651 -0.785 . . . . 0.0 113.481 -178.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.986 ' HB3' ' HB3' ' A' ' 32' ' ' ALA . 2.5 tmtm? -104.7 120.65 41.84 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.098 -0.705 . . . . 0.0 109.098 179.078 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.562 HD13 ' HA ' ' A' ' 55' ' ' PHE . 0.4 OUTLIER -104.42 145.86 29.67 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.44 0.638 . . . . 0.0 112.578 -178.488 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 162.23 63.97 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.621 179.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.694 ' O ' HD23 ' A' ' 3' ' ' LEU . . . 76.03 -4.45 46.53 Favored Glycine 0 C--N 1.336 0.569 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.098 -177.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.532 ' C ' ' ND2' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -166.36 166.23 16.72 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 -179.927 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.827 ' CG1' HD11 ' A' ' 15' ' ' LEU . 13.9 p -111.04 143.71 20.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.193 0.52 . . . . 0.0 111.592 178.667 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.986 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . . . -124.9 165.32 18.28 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.538 178.625 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -104.82 115.3 30.07 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -178.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.579 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 33.3 t30 -102.55 136.67 41.95 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.659 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.1 ptmt -154.43 36.32 0.42 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.044 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -115.4 -23.06 9.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.265 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.515 ' C ' HG23 ' A' ' 38' ' ' THR . 3.4 m -125.99 -47.72 1.64 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.997 0.427 . . . . 0.0 110.88 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.515 HG23 ' C ' ' A' ' 37' ' ' THR . 2.5 p 82.83 86.46 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 122.046 0.927 . . . . 0.0 111.469 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.746 ' CD2' HG21 ' A' ' 24' ' ' THR . 2.0 m-85 -82.02 131.85 35.25 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 113.952 -1.477 . . . . 0.0 110.575 179.348 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 2.4 pm0 -115.74 -34.57 4.78 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.439 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.547 ' O ' ' HB2' ' A' ' 105' ' ' SER . . . 151.98 50.75 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 N-CA-C 111.372 -0.691 . . . . 0.0 111.372 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.797 HD11 ' H ' ' A' ' 46' ' ' SER . 0.0 OUTLIER -108.14 -173.8 2.37 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.962 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.661 ' H ' HD12 ' A' ' 42' ' ' LEU . 94.1 m -119.08 67.43 0.79 Allowed 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -178.016 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.798 ' HA ' ' HB3' ' A' ' 48' ' ' ALA . 1.0 OUTLIER 45.76 5.97 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 178.591 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.511 ' N ' ' O ' ' A' ' 43' ' ' THR . . . -72.0 -57.35 4.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.693 0.282 . . . . 0.0 111.584 -179.145 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.797 ' H ' HD11 ' A' ' 42' ' ' LEU . 0.2 OUTLIER -58.31 -61.31 2.67 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.867 0.365 . . . . 0.0 110.687 -179.773 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -179.69 31.06 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.672 179.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.798 ' HB3' ' HA ' ' A' ' 44' ' ' ILE . . . -80.58 -166.91 1.18 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.014 0.435 . . . . 0.0 111.216 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.537 ' N ' ' OE2' ' A' ' 52' ' ' GLU . 3.2 mmt180 -137.82 -159.15 0.93 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.165 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.918 ' O ' HG22 ' A' ' 54' ' ' VAL . 3.6 mp0 -95.17 -30.71 13.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.594 0.235 . . . . 0.0 111.606 -179.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . 0.512 ' CB ' ' HG2' ' A' ' 26' ' ' LYS . 0.6 OUTLIER -62.04 -45.41 93.67 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.283 -0.417 . . . . 0.0 112.051 -179.228 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.537 ' OE2' ' N ' ' A' ' 49' ' ' ARG . 0.8 OUTLIER -59.28 -65.24 0.7 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.029 0.443 . . . . 0.0 110.294 179.94 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.697 ' HE2' HD11 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -46.44 -59.44 2.96 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.604 179.648 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.918 HG22 ' O ' ' A' ' 50' ' ' GLU . 11.7 m -49.09 -44.12 16.08 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-O 120.988 0.423 . . . . 0.0 110.308 179.561 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.588 ' HE2' HG23 ' A' ' 31' ' ' VAL . 0.4 OUTLIER -53.5 -53.14 55.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.805 178.768 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.735 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -55.07 -46.44 75.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.811 179.447 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -66.12 -42.25 89.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.221 0.534 . . . . 0.0 110.561 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.428 HG21 ' CB ' ' A' ' 2' ' ' ASN . 93.0 m -60.01 -47.54 85.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.956 -179.858 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.813 ' CG2' HD12 ' A' ' 117' ' ' LEU . 11.1 p -69.96 -38.03 74.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.853 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.624 HD13 ' O ' ' A' ' 102' ' ' SER . 4.0 tp -59.29 -37.59 78.06 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 121.146 0.498 . . . . 0.0 109.766 179.551 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 15.5 t -72.2 -52.96 14.08 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.032 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . 0.545 ' HB3' HD22 ' A' ' 5' ' ' LEU . 7.2 m-70 -55.49 -35.06 65.15 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 121.092 0.472 . . . . 0.0 110.322 179.573 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 1.031 HG13 ' CG1' ' A' ' 66' ' ' VAL . 57.0 t -83.7 -69.97 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.176 179.172 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.493 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 42.82 28.67 0.14 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.605 178.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.529 ' H ' HG12 ' A' ' 63' ' ' VAL . 0.7 OUTLIER 157.37 -75.97 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.782 0 CA-C-O 120.709 0.29 . . . . 0.0 111.647 179.853 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 1.031 ' CG1' HG13 ' A' ' 63' ' ' VAL . 35.4 m 46.52 -139.25 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.614 -179.475 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.506 ' O ' ' O ' ' A' ' 98' ' ' SER . 3.5 p -158.05 -20.84 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -179.199 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.659 HD23 ' HB3' ' A' ' 72' ' ' ASP . 2.0 mp 36.68 90.13 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 179.705 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 30.5 p -67.18 -173.69 0.29 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 179.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.5 -30.49 8.43 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.954 0.406 . . . . 0.0 110.749 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.09 -65.04 0.72 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.691 179.661 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.659 ' HB3' HD23 ' A' ' 68' ' ' LEU . 0.9 OUTLIER -54.95 -35.06 63.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.978 -179.942 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.0 m -59.36 -61.69 2.44 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 109.125 -0.695 . . . . 0.0 109.125 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.529 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . . . -56.86 -26.24 58.24 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 121.501 0.667 . . . . 0.0 109.241 177.744 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 1.057 ' CG ' HG22 ' A' ' 115' ' ' VAL . 1.0 OUTLIER -62.18 -62.32 1.85 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.718 -1.128 . . . . 0.0 111.005 179.4 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 1.025 HD13 HD21 ' A' ' 90' ' ' LEU . 0.6 OUTLIER -59.33 -49.52 77.5 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.691 179.891 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.632 HD12 ' C ' ' A' ' 77' ' ' LEU . 1.5 pp -61.16 -29.43 69.78 Favored 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.222 179.653 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.1 -56.95 11.28 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 178.73 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -59.13 -29.2 67.23 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.289 179.113 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 51.6 m . . . . . 0 C--N 1.331 -0.214 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.181 179.945 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . 0.536 ' HA ' ' HB2' ' A' ' 104' ' ' ARG . 0.6 OUTLIER . . . . . 0 C--O 1.251 1.162 0 CA-C-O 121.051 0.453 . . . . 0.0 111.006 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 1.315 ' HA ' ' OG ' ' A' ' 102' ' ' SER . 95.0 m-85 -99.13 125.42 44.66 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 115.608 -0.724 . . . . 0.0 112.179 -178.353 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.787 ' CG ' HG13 ' A' ' 101' ' ' VAL . 0.7 OUTLIER -104.64 136.54 43.98 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 -179.966 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 1.025 HD21 HD13 ' A' ' 76' ' ' LEU . 30.6 mt -129.48 155.08 46.3 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 -176.352 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.716 ' HB2' HG12 ' A' ' 99' ' ' VAL . 0.0 OUTLIER -132.31 161.71 32.86 Favored 'General case' 0 C--O 1.215 -0.746 0 CA-C-N 114.703 -1.135 . . . . 0.0 108.558 177.585 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.794 ' O ' HG13 ' A' ' 93' ' ' VAL . 22.9 p -103.64 158.64 16.23 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.882 0.849 . . . . 0.0 112.676 -178.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.794 HG13 ' O ' ' A' ' 92' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.437 -1.117 0 CA-C-N 113.695 -1.593 . . . . 0.0 107.884 -179.141 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.576 ' O ' ' O ' ' A' ' 93' ' ' VAL . 0.4 OUTLIER . . . . . 0 N--CA 1.454 -0.264 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.689 ' CB ' ' O ' ' A' ' 91' ' ' ARG . 0.2 OUTLIER -139.27 164.98 28.39 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.294 0.569 . . . . 0.0 110.784 179.772 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.716 HG12 ' HB2' ' A' ' 91' ' ' ARG . 0.5 OUTLIER -104.2 152.25 6.57 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.292 179.636 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.679 HD13 ' CD1' ' A' ' 116' ' ' LEU . 7.5 tp -103.19 105.24 15.48 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 121.638 0.732 . . . . 0.0 112.56 -178.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.787 HG13 ' CG ' ' A' ' 89' ' ' ASP . 1.6 p -123.68 110.04 24.8 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.96 0 N-CA-C 104.982 -2.229 . . . . 0.0 104.982 175.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 1.315 ' OG ' ' HA ' ' A' ' 88' ' ' TYR . 2.5 t -166.85 166.79 15.42 Favored 'General case' 0 CA--C 1.495 -1.171 0 N-CA-C 115.27 1.582 . . . . 0.0 115.27 -174.178 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.637 ' O ' ' C ' ' A' ' 104' ' ' ARG . 0.1 OUTLIER 168.99 -45.41 0.01 OUTLIER 'General case' 0 N--CA 1.435 -1.215 0 CA-C-N 113.721 -1.581 . . . . 0.0 112.09 174.032 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.637 ' C ' ' O ' ' A' ' 103' ' ' LEU . 0.0 OUTLIER 16.1 81.25 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.671 0 O-C-N 123.58 0.55 . . . . 0.0 110.044 178.457 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.636 ' O ' HD13 ' A' ' 103' ' ' LEU . 0.7 OUTLIER 86.02 -166.43 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 -176.28 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.615 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -132.42 101.74 5.46 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 119.989 -0.684 . . . . 0.0 110.629 179.368 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.735 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 1.5 mt-30 -169.13 165.51 11.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.441 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.699 ' SD ' HG11 ' A' ' 59' ' ' VAL . 0.7 OUTLIER -159.87 143.09 14.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.488 0.661 . . . . 0.0 112.588 178.505 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . 0.944 HG22 ' O ' ' A' ' 23' ' ' CYS . 0.2 OUTLIER -104.31 164.77 11.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.572 -1.195 . . . . 0.0 109.048 178.31 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.933 ' HB3' HG22 ' A' ' 16' ' ' VAL . 2.4 mt -57.32 -51.77 68.03 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.708 0.289 . . . . 0.0 111.044 -179.368 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . 0.909 ' O ' HG23 ' A' ' 115' ' ' VAL . 0.1 OUTLIER -54.7 -61.45 2.3 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.576 179.364 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 0.833 ' O ' HD22 ' A' ' 116' ' ' LEU . 11.7 m-20 -44.07 -53.81 6.04 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-O 121.074 0.464 . . . . 0.0 111.295 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 0.602 ' HB3' HG21 ' A' ' 12' ' ' VAL . . . -49.92 -60.27 3.08 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.188 179.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.638 ' HD2' HG11 ' A' ' 16' ' ' VAL . 0.2 OUTLIER -54.02 -32.49 54.45 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.414 179.473 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 1.057 HG22 ' CG ' ' A' ' 75' ' ' LYS . 48.1 t -61.99 -65.36 0.51 Allowed 'Isoleucine or valine' 0 C--O 1.241 0.63 0 CA-C-O 121.737 0.78 . . . . 0.0 111.912 -178.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.833 HD22 ' O ' ' A' ' 112' ' ' ASP . 0.3 OUTLIER -63.32 -34.12 77.0 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.298 -178.941 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 1.084 HD21 HD23 ' A' ' 8' ' ' LEU . 0.6 OUTLIER -73.15 -21.92 60.61 Favored 'General case' 0 CA--C 1.512 -0.498 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.549 178.898 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.567 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 6.5 tp10 -70.17 -46.89 63.7 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 106.267 -1.753 . . . . 0.0 106.267 177.134 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.545 ' HB2' ' OD2' ' A' ' 72' ' ' ASP . . . -74.36 -24.25 59.14 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.085 -1.416 . . . . 0.0 110.236 177.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 1.096 ' HB1' HD21 ' A' ' 5' ' ' LEU . . . -77.01 -50.72 12.49 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.471 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.882 HD22 ' ND1' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -62.68 -38.88 92.09 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.715 179.383 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.567 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.1 OUTLIER -73.7 -38.34 64.89 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.313 -179.558 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 29.6 mm100 -89.89 -24.88 21.24 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -178.033 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . 0.405 ' HG3' HD23 ' A' ' 5' ' ' LEU . 20.5 mm-40 -84.72 -66.97 0.83 Allowed 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.415 -179.245 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 9.5 t . . . . . 0 C--N 1.324 -0.507 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.363 -179.926 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 6.5 p30 . . . . . 0 CA--C 1.529 0.162 0 CA-C-O 120.734 0.302 . . . . 0.0 110.765 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.861 HD22 ' OE1' ' A' ' 11' ' ' GLN . 5.4 mp -85.49 -99.29 0.06 Allowed 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.735 179.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.418 ' O ' ' CB ' ' A' ' 8' ' ' LEU . 1.4 m -168.33 161.05 11.84 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 179.672 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.807 HD21 ' HB3' ' A' ' 62' ' ' HIS . 21.7 mt -56.82 -65.08 0.68 Allowed 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 121.37 0.605 . . . . 0.0 111.002 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.8 t -46.71 -45.4 19.47 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-N 115.165 -0.925 . . . . 0.0 112.091 -178.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.23 -64.5 1.12 Allowed 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.805 0.336 . . . . 0.0 110.65 -179.682 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.8 HD23 ' CD2' ' A' ' 117' ' ' LEU . 5.6 tp -44.27 -42.35 6.57 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.258 179.351 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.585 ' CD2' HD22 ' A' ' 121' ' ' LEU . 85.0 t60 -70.51 -44.19 68.13 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.325 178.364 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.404 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 11.3 mmt180 -55.67 -53.66 53.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.768 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.861 ' OE1' HD22 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -63.46 -54.78 31.19 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 120.885 -0.326 . . . . 0.0 111.253 -179.88 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.941 ' HA ' HD12 ' A' ' 15' ' ' LEU . 13.2 p -54.19 -48.58 66.1 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 CA-C-O 121.189 0.519 . . . . 0.0 110.942 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.632 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 60.8 m -62.96 -33.78 76.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.484 -0.78 . . . . 0.0 112.101 -179.519 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.404 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -74.28 -29.0 61.46 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.318 -179.295 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.941 HD12 ' HA ' ' A' ' 12' ' ' VAL . 0.5 OUTLIER -75.84 -50.77 14.16 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.517 179.628 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.873 ' CG2' ' HB3' ' A' ' 110' ' ' LEU . 69.6 t -66.71 -54.42 25.6 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.408 0 CA-C-O 121.202 0.525 . . . . 0.0 111.519 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 13' ' ' SER . 0.3 OUTLIER -63.23 -8.59 8.61 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.767 -178.46 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -141.88 25.12 1.98 Allowed 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 120.996 -0.282 . . . . 0.0 111.594 179.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.453 ' N ' ' O ' ' A' ' 15' ' ' LEU . 3.8 tt0 179.73 -69.93 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.944 ' CB ' HD13 ' A' ' 110' ' ' LEU . 0.7 OUTLIER -83.44 68.83 9.89 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.992 0.425 . . . . 0.0 111.917 -178.161 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -36.41 -34.55 0.09 OUTLIER Glycine 0 CA--C 1.521 0.441 0 CA-C-N 115.73 -0.668 . . . . 0.0 114.009 -179.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -166.57 9.04 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -179.508 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.55 ' HB2' ' HB3' ' A' ' 20' ' ' SER . 96.2 m -53.72 -171.26 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.708 0.289 . . . . 0.0 110.819 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.594 HG21 ' HB3' ' A' ' 39' ' ' PHE . 8.2 m -103.57 148.04 26.46 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 179.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.403 ' HA2' ' O ' ' A' ' 32' ' ' ALA . . . -104.51 144.23 15.8 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.095 -1.05 . . . . 0.0 113.507 -178.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.938 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -112.35 126.45 55.29 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 179.17 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.846 HD12 ' HA ' ' A' ' 55' ' ' PHE . 0.4 OUTLIER -104.67 144.2 32.05 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.308 0.575 . . . . 0.0 111.893 -178.846 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.441 ' H ' HD23 ' A' ' 27' ' ' LEU . 0.0 OUTLIER 171.12 57.28 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.135 179.891 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.841 ' C ' HD11 ' A' ' 3' ' ' LEU . . . 84.52 -2.25 88.13 Favored Glycine 0 N--CA 1.451 -0.35 0 N-CA-C 111.129 -0.788 . . . . 0.0 111.129 -177.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.569 ' N ' HD11 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -166.45 165.5 16.97 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 179.731 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.708 HG22 ' HG3' ' A' ' 11' ' ' GLN . 1.3 m -119.78 117.8 54.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 C-N-CA 119.857 -0.737 . . . . 0.0 111.487 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.938 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -108.26 166.87 10.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.111 -179.296 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.736 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -103.33 132.24 49.75 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.221 0.534 . . . . 0.0 111.485 -179.305 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.403 ' O ' ' HB3' ' A' ' 23' ' ' CYS . 5.2 t30 -115.33 121.24 42.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.67 -179.52 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.5 tttt -113.69 -10.88 13.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.512 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -79.91 -66.78 0.83 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.781 0.324 . . . . 0.0 111.27 -179.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.6 168.93 17.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.332 -179.531 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 61.6 p -131.48 114.58 15.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.496 179.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.729 ' CZ ' HG22 ' A' ' 109' ' ' THR . 0.0 OUTLIER -79.59 -179.72 7.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.19 -179.586 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.502 ' N ' ' CG ' ' A' ' 39' ' ' PHE . 0.8 OUTLIER 165.63 36.28 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.512 179.716 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.496 ' C ' ' HB2' ' A' ' 107' ' ' GLN . . . 89.37 -34.83 3.86 Favored Glycine 0 CA--C 1.52 0.375 0 CA-C-N 115.76 -0.655 . . . . 0.0 112.367 -179.33 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.622 HD21 ' HB3' ' A' ' 46' ' ' SER . 0.4 OUTLIER -21.0 139.51 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.404 0.681 . . . . 0.0 112.785 179.579 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.9 27.41 1.82 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.599 -179.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.825 HG23 ' O ' ' A' ' 48' ' ' ALA . 8.7 mm 65.65 5.6 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -87.24 -29.12 21.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.777 0.322 . . . . 0.0 111.439 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.622 ' HB3' HD21 ' A' ' 42' ' ' LEU . 1.3 t -87.21 -32.52 19.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.081 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.41 40.16 0.03 OUTLIER Glycine 0 CA--C 1.518 0.281 0 C-N-CA 120.462 -0.875 . . . . 0.0 113.197 179.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.825 ' O ' HG23 ' A' ' 44' ' ' ILE . . . -106.86 169.28 8.64 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.841 0.32 . . . . 0.0 110.846 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.453 ' C ' HD12 ' A' ' 44' ' ' ILE . 14.9 mtp180 -87.98 132.13 34.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.844 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.63 ' O ' HG23 ' A' ' 54' ' ' VAL . 7.9 tt0 -52.12 -30.46 26.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.056 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . 0.51 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 19.5 p -61.31 -55.11 35.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.969 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.524 ' CB ' ' HG2' ' A' ' 107' ' ' GLN . 13.8 mt-10 -51.6 -44.36 62.81 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.082 0.468 . . . . 0.0 110.411 179.733 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.469 ' HG3' ' HB3' ' A' ' 106' ' ' ASP . 0.1 OUTLIER -56.57 -62.52 1.67 Allowed 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.33 178.945 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.63 HG23 ' O ' ' A' ' 50' ' ' GLU . 33.5 t -49.81 -32.04 7.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 121.167 0.508 . . . . 0.0 110.33 179.262 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.846 ' HA ' HD12 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -64.98 -48.02 75.47 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.362 179.306 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.438 ' HB2' ' C ' ' A' ' 107' ' ' GLN . . . -59.27 -39.12 81.89 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-O 121.028 0.442 . . . . 0.0 110.061 179.118 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.1 mm-40 -69.21 -33.85 73.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.943 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.403 HG21 HD11 ' A' ' 27' ' ' LEU . 48.3 m -75.59 -50.97 13.94 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 120.911 0.386 . . . . 0.0 110.505 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.765 HG13 ' O ' ' A' ' 55' ' ' PHE . 3.0 m -62.75 -37.33 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.694 179.737 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.776 HD13 HD23 ' A' ' 103' ' ' LEU . 4.9 tp -70.14 -44.51 68.71 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.556 179.415 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 74.8 m -60.85 -62.23 2.01 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.612 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . 0.807 ' HB3' HD21 ' A' ' 5' ' ' LEU . 1.9 m-70 -49.33 -43.27 43.52 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 121.08 0.467 . . . . 0.0 110.703 -179.768 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 1.011 HG11 HD23 ' A' ' 100' ' ' LEU . 67.7 t -74.2 -80.15 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.242 179.228 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.539 ' HB3' ' O ' ' A' ' 63' ' ' VAL . . . 75.21 -26.02 0.2 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.358 -0.383 . . . . 0.0 112.005 179.389 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.442 ' O ' HG22 ' A' ' 66' ' ' VAL . 1.5 p30 -170.03 -51.99 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.065 0.46 . . . . 0.0 110.396 -179.197 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.993 ' CG1' HG13 ' A' ' 63' ' ' VAL . 35.9 m 46.56 -139.72 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.555 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.532 ' O ' ' O ' ' A' ' 98' ' ' SER . 3.4 p -153.47 -24.85 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 N-CA-C 113.367 0.876 . . . . 0.0 113.367 -179.259 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.843 HD23 ' HB3' ' A' ' 72' ' ' ASP . 1.5 mp 34.07 98.42 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 112.659 0.615 . . . . 0.0 112.659 179.432 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.594 HG23 ' NH1' ' A' ' 122' ' ' ARG . 68.8 p -60.66 -122.94 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 179.081 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.35 -39.54 9.98 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.347 0.594 . . . . 0.0 109.869 179.139 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.501 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 2.1 tt0 -59.6 -64.92 0.77 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.215 -179.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.843 ' HB3' HD23 ' A' ' 68' ' ' LEU . 96.1 m-20 -52.44 -33.14 42.77 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.237 -179.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 97.8 m -61.62 -63.9 1.12 Allowed 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.66 -24.25 60.84 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 177.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 1.082 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.2 OUTLIER -59.23 -65.09 0.72 Allowed 'General case' 0 C--O 1.234 0.261 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.428 179.017 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 1.097 HD13 HD21 ' A' ' 90' ' ' LEU . 0.4 OUTLIER -58.55 -38.92 78.84 Favored 'General case' 0 CA--C 1.52 -0.206 0 N-CA-C 109.425 -0.584 . . . . 0.0 109.425 178.981 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -50.75 -49.83 57.1 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.726 179.648 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -67.36 -53.04 33.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.878 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.33 -21.54 59.93 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.161 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 45.8 m . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.145 -179.819 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 16.5 p-10 . . . . . 0 C--O 1.234 0.269 0 N-CA-C 111.457 0.169 . . . . 0.0 111.457 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.81 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 1.3 m-85 -103.05 137.28 41.44 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.691 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.733 ' CG ' HG13 ' A' ' 101' ' ' VAL . 0.4 OUTLIER -105.1 140.84 37.67 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 121.958 0.885 . . . . 0.0 110.921 -177.597 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 1.097 HD21 HD13 ' A' ' 76' ' ' LEU . 11.3 mt -132.2 150.1 52.23 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.137 -0.938 . . . . 0.0 113.134 -178.027 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.453 ' O ' ' CB ' ' A' ' 98' ' ' SER . 0.0 OUTLIER -137.18 148.99 46.94 Favored 'General case' 0 C--O 1.219 -0.534 0 N-CA-C 107.67 -1.234 . . . . 0.0 107.67 177.551 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.621 ' O ' HG13 ' A' ' 93' ' ' VAL . 11.4 p -111.26 141.88 44.2 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 -178.384 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.621 HG13 ' O ' ' A' ' 92' ' ' SER . 15.9 m . . . . . 0 N--CA 1.448 -0.565 0 CA-C-N 113.848 -1.524 . . . . 0.0 108.283 178.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.519 -0.225 0 CA-C-O 120.555 0.216 . . . . 0.0 110.616 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.532 ' O ' ' O ' ' A' ' 67' ' ' VAL . 0.2 OUTLIER -133.1 165.57 24.45 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.518 0.675 . . . . 0.0 111.122 -179.981 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -103.93 140.04 23.19 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 179.087 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 1.011 HD23 HG11 ' A' ' 63' ' ' VAL . 8.7 tp -104.29 106.37 16.84 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -178.2 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.733 HG13 ' CG ' ' A' ' 89' ' ' ASP . 0.5 OUTLIER -122.48 123.05 67.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 104.741 -2.318 . . . . 0.0 104.741 176.361 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 0.81 ' HB2' ' HA ' ' A' ' 88' ' ' TYR . 72.2 p -165.31 166.79 18.44 Favored 'General case' 0 C--N 1.312 -1.06 0 C-N-CA 116.876 -1.93 . . . . 0.0 116.161 -173.782 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.776 HD23 HD13 ' A' ' 60' ' ' LEU . 0.1 OUTLIER 161.5 -89.73 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 112.815 -1.993 . . . . 0.0 111.789 175.52 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.573 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 52.75 40.16 29.95 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 -179.729 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.573 ' CB ' ' O ' ' A' ' 104' ' ' ARG . 57.7 m 116.64 156.65 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.392 1.077 . . . . 0.0 108.298 -177.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.469 ' HB3' ' HG3' ' A' ' 53' ' ' LYS . 1.5 m-20 -104.92 102.55 12.07 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -178.27 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.652 ' OE1' ' HB1' ' A' ' 48' ' ' ALA . 0.7 OUTLIER -167.65 148.55 5.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.058 177.522 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.77 ' HE2' ' CZ ' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -143.72 159.22 42.88 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -179.98 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . 0.729 HG22 ' CZ ' ' A' ' 39' ' ' PHE . 1.2 t -117.5 160.82 20.59 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.405 -1.27 . . . . 0.0 109.409 179.133 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.944 HD13 ' CB ' ' A' ' 20' ' ' SER . 1.0 OUTLIER -50.24 -55.92 13.29 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 120.732 0.301 . . . . 0.0 111.284 -179.502 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . 0.894 ' O ' HG23 ' A' ' 115' ' ' VAL . 0.2 OUTLIER -50.37 -65.36 0.57 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.243 -179.853 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 0.88 ' O ' HD22 ' A' ' 116' ' ' LEU . 11.5 m-20 -47.64 -55.46 9.33 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.88 0.371 . . . . 0.0 110.986 -179.58 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 0.53 ' HB1' ' CE1' ' A' ' 55' ' ' PHE . . . -42.39 -59.04 1.98 Allowed 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.104 179.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.675 ' HE2' ' HB ' ' A' ' 16' ' ' VAL . 0.0 OUTLIER -63.26 -34.62 78.07 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.084 179.894 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 1.082 HG22 ' CG ' ' A' ' 75' ' ' LYS . 93.3 t -52.48 -65.37 0.3 Allowed 'Isoleucine or valine' 0 C--O 1.248 1.009 0 CA-C-O 122.127 0.965 . . . . 0.0 111.342 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 1.0 ' HB3' HG21 ' A' ' 63' ' ' VAL . 0.0 OUTLIER -61.35 -42.94 99.51 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 114.485 -1.234 . . . . 0.0 110.237 -178.876 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.8 ' CD2' HD23 ' A' ' 8' ' ' LEU . 0.2 OUTLIER -68.09 -16.1 63.87 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.245 179.952 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.593 ' O ' ' HG2' ' A' ' 122' ' ' ARG . 2.7 tm-20 -72.15 -56.58 5.33 Favored 'General case' 0 N--CA 1.438 -1.06 0 N-CA-C 105.453 -2.055 . . . . 0.0 105.453 176.53 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.663 ' HB2' ' OD2' ' A' ' 72' ' ' ASP . . . -64.24 -33.98 77.05 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 114.166 -1.379 . . . . 0.0 110.866 177.725 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.966 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -64.16 -57.88 8.25 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.035 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.629 ' HG ' ' N ' ' A' ' 122' ' ' ARG . 0.1 OUTLIER -56.87 -45.81 82.24 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.997 -179.324 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.629 ' N ' ' HG ' ' A' ' 121' ' ' LEU . 0.0 OUTLIER -63.1 -65.7 0.65 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 119.549 -0.861 . . . . 0.0 111.97 -179.823 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -53.65 -29.79 40.08 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.177 -0.92 . . . . 0.0 113.041 -178.302 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . 0.41 ' CG ' ' O ' ' A' ' 120' ' ' ALA . 4.6 mm-40 -95.11 -66.24 0.93 Allowed 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -178.685 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.327 -0.389 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -178.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . 0.566 ' ND2' HD22 ' A' ' 8' ' ' LEU . 8.6 p-10 . . . . . 0 CA--C 1.536 0.441 0 N-CA-C 111.68 0.252 . . . . 0.0 111.68 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.789 HD21 ' CA ' ' A' ' 30' ' ' ASN . 0.6 OUTLIER -99.9 16.37 24.04 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.457 0.17 . . . . 0.0 111.428 -179.342 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.1 m 72.79 -166.6 0.12 Allowed 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -178.568 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.865 HD21 ' HB3' ' A' ' 62' ' ' HIS . 7.7 mt -95.51 -64.89 1.01 Allowed 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.234 0.54 . . . . 0.0 111.916 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.756 ' HA ' HD13 ' A' ' 121' ' ' LEU . 1.9 p -45.19 -47.07 12.51 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.297 -0.865 . . . . 0.0 112.367 -178.013 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . 0.43 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 0.6 OUTLIER -73.4 -64.56 0.96 Allowed 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 120.857 0.361 . . . . 0.0 110.078 179.73 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.824 HD23 HD21 ' A' ' 117' ' ' LEU . 14.5 tp -41.39 -47.5 3.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.363 179.134 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.579 ' CG ' HD22 ' A' ' 121' ' ' LEU . 32.6 t-80 -64.97 -43.87 91.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.614 178.538 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.43 ' HB2' ' O ' ' A' ' 7' ' ' ASP . 3.4 mmt-85 -53.68 -54.08 42.98 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.995 -1.002 . . . . 0.0 111.586 -179.634 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.723 ' HG3' HG12 ' A' ' 31' ' ' VAL . 1.0 OUTLIER -67.72 -51.27 51.28 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.518 -179.505 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.855 HG23 HD23 ' A' ' 110' ' ' LEU . 11.0 p -57.69 -44.36 85.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 CA-C-O 121.137 0.494 . . . . 0.0 110.644 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.791 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 95.0 p -62.84 -51.63 66.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.727 179.417 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.495 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 1.0 OUTLIER -66.64 -17.6 64.93 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.934 179.977 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.488 HD13 HG22 ' A' ' 31' ' ' VAL . 4.9 mt -79.6 -59.62 2.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.709 -179.552 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.499 ' HB ' ' NZ ' ' A' ' 114' ' ' LYS . 1.0 OUTLIER -71.42 -27.66 29.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 C-N-CA 120.904 -0.319 . . . . 0.0 110.92 -179.798 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.406 ' HB2' ' O ' ' A' ' 13' ' ' SER . 5.6 mm-40 -74.98 -13.97 60.57 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.804 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.495 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 10.5 pt20 -170.48 62.53 0.04 OUTLIER 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.78 0.324 . . . . 0.0 111.167 179.498 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 173.12 -60.11 0.01 OUTLIER 'General case' 0 C--O 1.232 0.16 0 CA-C-O 120.835 0.35 . . . . 0.0 111.37 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.716 ' OG ' ' HB2' ' A' ' 33' ' ' ALA . 15.0 m -85.2 -36.85 20.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.603 -179.237 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 55.95 71.83 0.67 Allowed Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.335 -179.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 53.77 97.05 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.967 0.413 . . . . 0.0 110.881 -179.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.689 ' O ' HG23 ' A' ' 109' ' ' THR . 0.2 OUTLIER -161.82 -161.25 0.76 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.021 -179.731 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.67 HG22 ' OE2' ' A' ' 52' ' ' GLU . 35.4 m -104.1 136.73 43.19 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.336 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.465 ' CA ' ' HG ' ' A' ' 110' ' ' LEU . . . -104.8 140.83 15.15 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.407 -0.901 . . . . 0.0 113.554 -178.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.971 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -104.95 133.65 49.38 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.194 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.641 HD22 HG12 ' A' ' 54' ' ' VAL . 1.2 tt -104.72 148.87 26.11 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.327 0.584 . . . . 0.0 111.927 -179.252 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.548 HH21 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER 169.01 58.37 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 114.993 -1.003 . . . . 0.0 108.969 -179.821 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.633 ' CA ' HD11 ' A' ' 3' ' ' LEU . . . 72.3 6.07 64.38 Favored Glycine 0 CA--C 1.52 0.358 0 N-CA-C 110.424 -1.071 . . . . 0.0 110.424 -177.173 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.789 ' CA ' HD21 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -166.36 165.15 17.37 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 -179.74 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.723 HG12 ' HG3' ' A' ' 11' ' ' GLN . 0.8 OUTLIER -119.54 122.85 69.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.399 0.618 . . . . 0.0 111.234 179.021 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.971 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -111.91 166.04 11.56 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.313 179.528 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.719 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -103.73 142.68 33.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.318 0.58 . . . . 0.0 112.176 -178.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.472 HD22 ' HB ' ' A' ' 24' ' ' THR . 6.7 t30 -126.96 120.2 28.52 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.1 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.05 21.61 3.49 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.99 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -106.08 -23.98 12.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.192 -179.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 12.3 t -135.7 -176.54 4.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.095 0.474 . . . . 0.0 111.615 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.594 ' O ' ' NE2' ' A' ' 40' ' ' GLN . 41.5 p -120.66 126.53 50.46 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.24 -179.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.714 ' O ' ' HB2' ' A' ' 42' ' ' LEU . 3.2 p90 -81.87 -43.28 18.41 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.132 -179.559 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.594 ' NE2' ' O ' ' A' ' 38' ' ' THR . 0.8 OUTLIER 21.09 69.85 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.17 0.988 . . . . 0.0 113.164 -179.669 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.583 ' O ' ' HB2' ' A' ' 105' ' ' SER . . . 36.72 46.02 1.09 Allowed Glycine 0 C--O 1.226 -0.391 0 C-N-CA 120.907 -0.664 . . . . 0.0 112.313 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.72 ' HB3' ' OE1' ' A' ' 107' ' ' GLN . 1.3 tp -85.06 -156.93 0.27 Allowed 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.745 HG23 ' H ' ' A' ' 106' ' ' ASP . 0.2 OUTLIER -155.93 31.67 0.35 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.238 0.542 . . . . 0.0 111.197 179.81 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.904 HG23 ' O ' ' A' ' 48' ' ' ALA . 4.7 mp 54.23 5.17 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.656 179.296 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.431 ' H ' ' C ' ' A' ' 43' ' ' THR . . . -87.8 -22.85 24.28 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.931 0.396 . . . . 0.0 110.672 179.556 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -108.34 -28.06 9.62 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.0 179.846 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 160.12 73.3 0.02 OUTLIER Glycine 0 C--N 1.333 0.398 0 C-N-CA 120.295 -0.955 . . . . 0.0 113.512 179.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.904 ' O ' HG23 ' A' ' 44' ' ' ILE . . . -152.53 174.33 14.05 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.836 0.35 . . . . 0.0 111.245 179.136 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -105.52 147.45 28.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.611 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.723 ' O ' HG23 ' A' ' 54' ' ' VAL . 33.1 tt0 -50.34 -39.99 47.81 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.265 0.555 . . . . 0.0 110.861 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . 0.593 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 2.8 p -48.32 -55.17 11.34 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.189 179.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.67 ' OE2' HG22 ' A' ' 24' ' ' THR . 3.1 mp0 -40.52 -62.46 0.77 Allowed 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 120.794 0.33 . . . . 0.0 111.04 179.725 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.66 ' HG2' ' N ' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -54.02 -40.11 66.75 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.713 179.513 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.723 HG23 ' O ' ' A' ' 50' ' ' GLU . 40.7 t -63.33 -43.37 98.57 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.197 0 CA-C-O 121.192 0.52 . . . . 0.0 110.017 179.76 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.722 ' O ' HG12 ' A' ' 59' ' ' VAL . 0.1 OUTLIER -63.82 -32.91 74.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.334 179.386 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.438 ' HB2' ' HB2' ' A' ' 108' ' ' MET . . . -68.56 -59.18 3.33 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.035 179.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -56.48 -37.46 70.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.813 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.412 HG21 HD22 ' A' ' 27' ' ' LEU . 7.5 p -64.71 -60.58 2.94 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.74 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.953 HG23 HD12 ' A' ' 117' ' ' LEU . 10.1 p -62.29 -45.01 99.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.78 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.796 HD13 HD23 ' A' ' 103' ' ' LEU . 6.3 tp -56.06 -39.23 71.75 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 120.972 0.415 . . . . 0.0 110.282 179.306 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 44.1 m -65.24 -59.08 4.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.131 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . 0.865 ' HB3' HD21 ' A' ' 5' ' ' LEU . 9.8 m170 -54.52 -42.81 71.27 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 121.186 0.517 . . . . 0.0 110.111 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 1.085 HG13 HG11 ' A' ' 66' ' ' VAL . 2.7 t -88.52 54.14 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.443 179.368 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.453 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . -84.16 36.94 0.59 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.292 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.859 ' O ' HG22 ' A' ' 99' ' ' VAL . 0.8 OUTLIER 156.8 -62.99 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 122.744 0.417 . . . . 0.0 110.825 -179.757 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 1.085 HG11 HG13 ' A' ' 63' ' ' VAL . 33.3 m 40.73 -147.91 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.983 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.527 ' O ' ' O ' ' A' ' 98' ' ' SER . 4.9 p -149.62 -25.88 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -179.393 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.624 HD12 ' O ' ' A' ' 98' ' ' SER . 0.6 OUTLIER 32.75 88.94 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.616 0.598 . . . . 0.0 112.616 178.933 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.644 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 0.9 OUTLIER -75.13 -169.77 1.01 Allowed 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.694 -0.403 . . . . 0.0 110.729 179.508 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -40.28 -41.32 1.31 Allowed 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.2 -0.454 . . . . 0.0 112.162 -179.284 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.405 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 0.8 OUTLIER -60.78 -65.11 0.74 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.086 -179.743 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.96 ' O ' HD22 ' A' ' 76' ' ' LEU . 55.0 m-20 -58.47 -44.8 89.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.249 -179.613 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.592 ' HA ' HD23 ' A' ' 76' ' ' LEU . 0.6 OUTLIER -48.93 -57.98 5.6 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.547 0.689 . . . . 0.0 109.659 178.83 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.67 -27.22 68.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.059 -0.973 . . . . 0.0 108.87 177.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 1.039 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -63.76 -46.57 84.71 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.935 -1.029 . . . . 0.0 109.227 178.436 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 1.059 HD13 HG11 ' A' ' 115' ' ' VAL . 1.4 mm? -61.06 -59.84 4.71 Favored 'General case' 0 C--N 1.343 0.284 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 178.078 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.632 ' HA ' HG22 ' A' ' 80' ' ' THR . 5.9 mt -55.19 -30.87 60.8 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.906 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -64.13 -51.99 61.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.303 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . 0.46 ' CB ' ' HG2' ' A' ' 111' ' ' GLN . 0.3 OUTLIER -68.31 -26.43 65.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.257 179.851 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.632 HG22 ' HA ' ' A' ' 77' ' ' LEU . 0.6 OUTLIER . . . . . 0 C--N 1.331 -0.239 0 CA-C-O 120.734 0.302 . . . . 0.0 111.33 -179.519 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . 0.405 ' CB ' ' HA3' ' A' ' 41' ' ' GLY . 12.4 p-10 . . . . . 0 C--O 1.235 0.335 0 N-CA-C 111.634 0.235 . . . . 0.0 111.634 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.588 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 0.1 OUTLIER -106.38 153.87 21.61 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.24 0.543 . . . . 0.0 111.118 -179.877 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.744 ' CG ' HG13 ' A' ' 101' ' ' VAL . 0.4 OUTLIER -120.12 150.06 41.22 Favored 'General case' 0 N--CA 1.435 -1.177 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -179.208 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.758 HD11 ' CB ' ' A' ' 76' ' ' LEU . 49.3 mt -142.21 161.64 37.49 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -177.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.4 133.65 40.78 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 114.334 -1.303 . . . . 0.0 107.9 177.716 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.873 ' O ' HG13 ' A' ' 93' ' ' VAL . 90.4 p -104.33 150.41 24.5 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -177.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.873 HG13 ' O ' ' A' ' 92' ' ' SER . 1.1 m . . . . . 0 CA--C 1.539 0.555 0 CA-C-N 113.596 -1.638 . . . . 0.0 108.355 179.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.644 ' HA ' ' HA ' ' A' ' 69' ' ' THR . 0.2 OUTLIER . . . . . 0 N--CA 1.452 -0.371 0 CA-C-O 120.651 0.263 . . . . 0.0 110.469 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.624 ' O ' HD12 ' A' ' 68' ' ' LEU . 4.1 t -139.97 161.19 38.19 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.294 0.569 . . . . 0.0 110.635 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.859 HG22 ' O ' ' A' ' 65' ' ' ASN . 1.2 t -103.35 150.0 7.08 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.975 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 178.878 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.626 HD13 ' CD1' ' A' ' 116' ' ' LEU . 0.3 OUTLIER -103.68 114.13 28.16 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -178.105 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.744 HG13 ' CG ' ' A' ' 89' ' ' ASP . 1.3 p -126.06 103.8 12.12 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.11 0 N-CA-C 103.198 -2.89 . . . . 0.0 103.198 174.108 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 0.66 ' O ' HD23 ' A' ' 103' ' ' LEU . 8.2 p -143.82 165.24 28.23 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 113.879 1.066 . . . . 0.0 113.879 -174.016 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.947 HD13 ' O ' ' A' ' 105' ' ' SER . 0.1 OUTLIER 155.13 -88.13 0.0 OUTLIER 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 113.817 -1.538 . . . . 0.0 112.019 176.589 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.472 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 60.23 21.13 10.52 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 -178.54 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.947 ' O ' HD13 ' A' ' 103' ' ' LEU . 4.6 m 144.43 176.32 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 114.471 -1.24 . . . . 0.0 108.104 -179.082 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.745 ' H ' HG23 ' A' ' 43' ' ' THR . 0.3 OUTLIER -104.04 101.17 10.94 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.315 -0.554 . . . . 0.0 111.037 -179.483 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.72 ' OE1' ' HB3' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -168.51 151.35 5.32 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.429 178.665 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.446 ' HB3' ' HB3' ' A' ' 55' ' ' PHE . 0.9 OUTLIER -153.64 147.91 25.87 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.144 0.497 . . . . 0.0 111.613 178.369 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . 0.689 HG23 ' O ' ' A' ' 23' ' ' CYS . 0.3 OUTLIER -115.28 160.94 19.16 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.229 -179.916 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.855 HD23 HG23 ' A' ' 12' ' ' VAL . 0.4 OUTLIER -48.91 -60.46 2.74 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.683 0.278 . . . . 0.0 110.444 179.818 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . 0.882 ' O ' HG23 ' A' ' 115' ' ' VAL . 3.3 tp60 -45.47 -65.18 0.57 Allowed 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.537 179.586 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 0.956 ' O ' HD22 ' A' ' 116' ' ' LEU . 29.6 m-20 -45.95 -53.13 10.48 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.113 0.482 . . . . 0.0 110.482 179.331 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 0.526 ' HB1' ' CE1' ' A' ' 55' ' ' PHE . . . -44.81 -63.16 0.97 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.202 179.732 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.791 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -64.41 -27.07 68.75 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.657 -179.756 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 1.059 HG11 HD13 ' A' ' 76' ' ' LEU . 92.6 t -58.72 -64.96 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.868 0 CA-C-O 122.148 0.975 . . . . 0.0 110.627 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.956 HD22 ' O ' ' A' ' 112' ' ' ASP . 0.1 OUTLIER -62.95 -40.08 96.57 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 114.512 -1.222 . . . . 0.0 110.04 -179.415 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.953 HD12 HG23 ' A' ' 59' ' ' VAL . 0.2 OUTLIER -67.78 -22.26 65.2 Favored 'General case' 0 CA--C 1.511 -0.536 0 O-C-N 123.235 0.335 . . . . 0.0 110.925 179.641 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.575 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 5.5 tp10 -69.03 -51.65 36.91 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 106.345 -1.724 . . . . 0.0 106.345 177.291 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.661 ' HB2' ' OD2' ' A' ' 72' ' ' ASP . . . -73.72 -19.15 60.89 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 114.464 -1.244 . . . . 0.0 110.877 177.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.915 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -77.59 -59.93 2.58 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.684 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.756 HD13 ' HA ' ' A' ' 6' ' ' SER . 0.1 OUTLIER -59.82 -30.14 68.72 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.739 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.575 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.9 OUTLIER -68.45 -54.82 14.52 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.33 -179.7 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.86 -30.07 26.74 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -177.142 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . 0.529 ' OE1' ' HB1' ' A' ' 120' ' ' ALA . 2.7 mt-10 -78.05 -66.57 0.83 Allowed 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.222 -0.591 . . . . 0.0 112.366 -178.35 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.324 -0.541 0 CA-C-O 121.094 0.474 . . . . 0.0 111.747 -179.086 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 12.8 p-10 . . . . . 0 CA--C 1.532 0.266 0 CA-C-O 120.412 0.148 . . . . 0.0 110.716 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.79 HD21 ' HA ' ' A' ' 30' ' ' ASN . 5.5 mp -71.39 -79.69 0.07 Allowed 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.941 0.4 . . . . 0.0 110.8 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.49 ' O ' ' HB2' ' A' ' 8' ' ' LEU . 0.4 OUTLIER -165.54 -166.43 0.97 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.963 179.934 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.731 HD21 ' HB1' ' A' ' 120' ' ' ALA . 0.4 OUTLIER -95.68 -66.36 0.91 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 122.013 0.911 . . . . 0.0 111.6 -179.949 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p -63.97 -38.36 90.8 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.46 -1.246 . . . . 0.0 112.337 -178.16 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.97 -34.12 64.13 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.517 -0.473 . . . . 0.0 109.919 179.324 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.929 HD23 HD11 ' A' ' 117' ' ' LEU . 13.5 tp -66.98 -49.7 64.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.947 179.24 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.678 ' CG ' HD22 ' A' ' 121' ' ' LEU . 56.5 t-80 -61.09 -46.11 91.98 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.969 178.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.41 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 5.0 mtp180 -56.73 -42.36 79.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.857 179.367 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.793 ' HG3' HG22 ' A' ' 31' ' ' VAL . 5.4 tp-100 -67.13 -65.65 0.66 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.834 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.038 HG23 HD23 ' A' ' 110' ' ' LEU . 14.4 p -52.29 -46.93 46.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 121.071 0.462 . . . . 0.0 111.204 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.714 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 41.0 m -64.28 -37.88 89.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.802 -179.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.41 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 3.7 mmt180 -69.0 -30.7 69.15 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.513 -179.573 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.955 HD12 ' HA ' ' A' ' 12' ' ' VAL . 2.4 mt -72.67 -62.11 1.56 Allowed 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.671 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.782 ' CG2' ' HB3' ' A' ' 110' ' ' LEU . 56.3 t -57.7 -53.61 42.44 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.471 0 CA-C-O 121.217 0.532 . . . . 0.0 111.425 -179.489 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -62.55 -7.35 4.52 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.539 -178.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -150.12 37.15 0.69 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 120.953 -0.299 . . . . 0.0 111.699 179.266 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.491 ' N ' ' O ' ' A' ' 15' ' ' LEU . 1.4 mt-10 168.33 -66.79 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.903 ' CB ' HD13 ' A' ' 110' ' ' LEU . 0.8 OUTLIER -76.29 80.09 3.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.669 -177.669 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -66.64 73.5 0.16 Allowed Glycine 0 C--N 1.311 -0.843 0 CA-C-N 114.937 -1.029 . . . . 0.0 112.759 179.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.8 t70 75.94 22.09 1.49 Allowed 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 179.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.538 ' HB2' HD12 ' A' ' 110' ' ' LEU . 96.4 m -70.21 -165.79 0.11 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 179.329 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.552 ' HA ' ' HA ' ' A' ' 109' ' ' THR . 0.2 OUTLIER -104.39 163.42 12.45 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.818 0.342 . . . . 0.0 110.506 179.692 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -104.28 131.2 10.54 Favored Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.131 -1.033 . . . . 0.0 113.344 -179.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.784 ' HB3' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -104.42 110.75 23.13 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.927 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.0 tt -104.0 139.47 39.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.474 0.654 . . . . 0.0 112.231 -178.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 165.08 51.71 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.109 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.51 ' C ' HD11 ' A' ' 3' ' ' LEU . . . 94.02 -5.53 72.22 Favored Glycine 0 CA--C 1.519 0.287 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.402 -178.259 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.79 ' HA ' HD21 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -165.55 151.98 9.86 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.818 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.793 HG22 ' HG3' ' A' ' 11' ' ' GLN . 1.5 m -104.81 123.91 59.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.469 179.19 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.784 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . . . -114.02 166.34 11.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.211 -178.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.834 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -103.29 105.97 16.38 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.22 0.533 . . . . 0.0 111.25 -179.628 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.448 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 0.8 OUTLIER -85.11 124.57 31.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.559 -179.884 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -125.08 28.19 6.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.923 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -110.39 -39.35 4.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.795 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.475 HG21 ' O ' ' A' ' 47' ' ' GLY . 0.8 OUTLIER -104.96 -53.46 2.66 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.115 -179.963 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.6 p 60.58 96.13 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.351 0.596 . . . . 0.0 109.627 -179.269 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.597 ' HB3' ' NE2' ' A' ' 107' ' ' GLN . 18.7 m-85 -133.13 -177.52 4.55 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 113.745 1.017 . . . . 0.0 113.745 -177.793 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.426 ' N ' ' CD ' ' A' ' 40' ' ' GLN . 0.0 OUTLIER -149.75 -56.31 0.18 Allowed 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 114.838 -1.074 . . . . 0.0 110.703 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.523 ' HA3' ' CB ' ' A' ' 87' ' ' ASN . . . -150.66 101.27 0.21 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.495 -0.86 . . . . 0.0 112.911 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.719 HD23 ' NE2' ' A' ' 107' ' ' GLN . 0.1 OUTLIER -156.74 172.84 17.9 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.787 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.707 ' H ' HD12 ' A' ' 42' ' ' LEU . 0.2 OUTLIER -108.67 40.9 1.69 Allowed 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -176.946 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.66 ' HA ' ' HB3' ' A' ' 48' ' ' ALA . 3.3 mt 55.1 0.89 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 179.299 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.47 ' H ' ' C ' ' A' ' 43' ' ' THR . . . -68.83 -35.92 77.56 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.204 0.526 . . . . 0.0 109.974 179.541 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.541 ' H ' HD11 ' A' ' 42' ' ' LEU . 6.6 t -74.96 -59.77 2.59 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.393 179.257 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . 0.475 ' O ' HG21 ' A' ' 37' ' ' THR . . . 173.5 31.75 0.03 OUTLIER Glycine 0 CA--C 1.52 0.36 0 C-N-CA 120.638 -0.792 . . . . 0.0 113.246 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.66 ' HB3' ' HA ' ' A' ' 44' ' ' ILE . . . -67.67 -167.42 0.07 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.268 0.556 . . . . 0.0 111.535 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 17.0 mmm180 -145.67 143.4 29.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.937 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.666 ' O ' HG23 ' A' ' 54' ' ' VAL . 4.6 mp0 -45.06 -31.49 1.37 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.884 0.373 . . . . 0.0 111.381 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . 0.434 ' CB ' ' HG2' ' A' ' 26' ' ' LYS . 0.4 OUTLIER -60.49 -61.49 2.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.253 -179.936 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.419 ' HG2' ' CG2' ' A' ' 24' ' ' THR . 54.1 mt-10 -48.88 -65.35 0.58 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.122 0.487 . . . . 0.0 110.957 -179.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.627 ' HD2' HD11 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -45.01 -57.59 3.74 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.345 179.72 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.685 ' O ' HG23 ' A' ' 58' ' ' THR . 78.2 t -52.58 -35.25 20.45 Favored 'Isoleucine or valine' 0 C--O 1.232 0.133 0 CA-C-O 120.945 0.402 . . . . 0.0 110.534 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.586 ' HB3' ' HB3' ' A' ' 108' ' ' MET . 0.2 OUTLIER -65.35 -47.31 76.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.306 179.462 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.813 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -55.6 -49.2 73.43 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-O 120.982 0.42 . . . . 0.0 110.59 179.339 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -59.98 -45.57 92.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.816 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.685 HG23 ' O ' ' A' ' 54' ' ' VAL . 82.0 p -66.97 -52.83 37.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.804 -179.559 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.654 HG23 HD12 ' A' ' 117' ' ' LEU . 13.4 p -56.2 -46.49 81.29 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-O 120.828 0.347 . . . . 0.0 111.267 -179.189 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.463 ' N ' HG13 ' A' ' 59' ' ' VAL . 1.1 tp -67.62 -36.85 81.59 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.533 179.743 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 33.3 m -61.44 -65.23 0.72 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.123 -0.49 . . . . 0.0 112.036 -179.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . 0.856 ' NE2' HG23 ' A' ' 63' ' ' VAL . 9.7 p-80 -50.09 -44.99 52.2 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.019 0.438 . . . . 0.0 110.365 -179.726 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 1.009 HG21 ' HB3' ' A' ' 116' ' ' LEU . 16.8 t -63.79 -66.63 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.776 178.552 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.503 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 37.82 36.17 0.09 Allowed 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.541 178.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.549 ' H ' HG12 ' A' ' 63' ' ' VAL . 11.2 t-20 154.97 -80.44 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 122.479 0.311 . . . . 0.0 110.979 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.98 ' CG1' HG13 ' A' ' 63' ' ' VAL . 17.0 m 45.38 -154.41 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.546 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.845 HG13 ' O ' ' A' ' 67' ' ' VAL . 3.2 p -163.98 69.34 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.334 -0.084 0 CA-C-O 121.869 0.842 . . . . 0.0 111.4 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.842 HD23 ' HB3' ' A' ' 72' ' ' ASP . 1.0 OUTLIER -53.39 107.0 0.2 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.12 -0.945 . . . . 0.0 112.32 -179.904 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.732 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 74.1 p -71.14 -176.83 1.52 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 0.0 109.778 178.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.416 ' HA ' ' OG1' ' A' ' 73' ' ' THR . 0.0 OUTLIER -46.08 -34.59 4.26 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.159 0.504 . . . . 0.0 111.115 -179.786 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.406 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 0.8 OUTLIER -68.83 -65.05 0.75 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.793 179.987 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.842 ' HB3' HD23 ' A' ' 68' ' ' LEU . 43.9 m-20 -55.21 -29.45 57.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.971 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.439 ' CG2' ' HB3' ' A' ' 98' ' ' SER . 1.5 p -65.65 -60.95 2.38 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 178.443 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.73 -25.97 55.92 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 177.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 1.101 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.1 OUTLIER -57.71 -65.07 0.7 Allowed 'General case' 0 C--O 1.234 0.262 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.564 178.922 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.848 HD21 HD11 ' A' ' 116' ' ' LEU . 0.4 OUTLIER -59.01 -38.96 80.44 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 121.2 0.524 . . . . 0.0 109.87 179.085 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -52.25 -44.37 64.85 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.617 179.766 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -72.31 -58.24 3.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.887 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . 0.412 ' CB ' ' HG2' ' A' ' 111' ' ' GLN . 0.0 OUTLIER -56.53 -23.93 43.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.491 -179.822 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.644 HG23 ' OD1' ' A' ' 87' ' ' ASN . 51.1 m . . . . . 0 C--N 1.329 -0.287 0 CA-C-O 120.772 0.32 . . . . 0.0 111.63 -179.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . 0.644 ' OD1' HG23 ' A' ' 80' ' ' THR . 11.5 p-10 . . . . . 0 C--O 1.244 0.772 0 CA-C-O 121.585 0.707 . . . . 0.0 110.496 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.69 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 3.1 m-85 -108.83 138.35 45.29 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.53 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.649 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.1 OUTLIER -104.64 150.49 24.65 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.444 -178.437 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.665 HD23 ' HA ' ' A' ' 100' ' ' LEU . 12.5 mt -138.53 144.65 40.03 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -178.013 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -132.88 114.53 14.17 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 178.178 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.512 ' HA ' ' CB ' ' A' ' 98' ' ' SER . 1.6 m -104.24 146.25 29.05 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 113.739 1.015 . . . . 0.0 113.739 -177.043 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.529 ' O ' ' O ' ' A' ' 97' ' ' ASN . 12.7 m . . . . . 0 N--CA 1.447 -0.594 0 CA-C-N 114.107 -1.406 . . . . 0.0 108.753 179.163 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.762 ' HB2' HG22 ' A' ' 67' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.518 -0.285 0 CA-C-O 121.281 0.563 . . . . 0.0 111.422 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.52 ' O ' ' N ' ' A' ' 68' ' ' LEU . 39.9 t -146.28 165.12 30.19 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.472 -179.165 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.457 ' H ' ' HG ' ' A' ' 98' ' ' SER . 2.3 t -116.07 152.9 17.73 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.541 179.242 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.665 ' HA ' HD23 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -104.69 126.39 51.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.7 0.762 . . . . 0.0 112.447 -179.586 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.649 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -130.71 110.67 18.9 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 N-CA-C 104.976 -2.231 . . . . 0.0 104.976 175.955 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 0.768 ' O ' ' HB2' ' A' ' 103' ' ' LEU . 17.8 p -153.14 165.33 35.97 Favored 'General case' 0 C--N 1.309 -1.169 0 C-N-CA 118.401 -1.32 . . . . 0.0 114.544 -174.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.768 ' HB2' ' O ' ' A' ' 102' ' ' SER . 0.8 OUTLIER 136.21 74.72 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 113.21 -1.814 . . . . 0.0 112.457 176.05 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.573 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -108.51 29.02 7.78 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 177.464 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.535 ' HB3' ' N ' ' A' ' 42' ' ' LEU . 2.8 m 153.35 163.49 0.01 OUTLIER 'General case' 0 C--O 1.231 0.117 0 CA-C-N 114.188 -1.369 . . . . 0.0 107.509 -178.489 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.457 ' O ' ' HG3' ' A' ' 107' ' ' GLN . 0.8 OUTLIER -104.79 100.98 10.61 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.977 -179.159 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.813 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 4.1 mt-30 -169.17 163.35 10.99 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.708 177.656 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.586 ' HB3' ' HB3' ' A' ' 55' ' ' PHE . 1.0 OUTLIER -165.93 135.23 3.25 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.293 0.568 . . . . 0.0 112.126 178.293 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . 0.552 ' HA ' ' HA ' ' A' ' 24' ' ' THR . 0.4 OUTLIER -103.13 160.93 14.21 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.004 178.608 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 1.038 HD23 HG23 ' A' ' 12' ' ' VAL . 4.0 mt -45.77 -54.71 7.53 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -178.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . 0.843 ' O ' HG23 ' A' ' 115' ' ' VAL . 0.1 OUTLIER -48.31 -65.45 0.57 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.747 0.308 . . . . 0.0 111.04 -179.928 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 0.502 ' O ' ' HB ' ' A' ' 115' ' ' VAL . 1.6 m-20 -47.2 -46.02 23.62 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.247 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 0.49 ' HB1' ' CE1' ' A' ' 55' ' ' PHE . . . -52.08 -60.54 3.08 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.648 179.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.842 ' NZ ' HG22 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -65.34 -22.53 66.83 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.993 179.745 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 1.101 HG22 ' CG ' ' A' ' 75' ' ' LYS . 53.0 t -61.51 -61.95 1.35 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.876 0 CA-C-O 121.894 0.854 . . . . 0.0 109.973 179.556 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 1.009 ' HB3' HG21 ' A' ' 63' ' ' VAL . 9.1 mp -61.83 -39.48 91.97 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.595 179.653 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.929 HD11 HD23 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -68.05 -23.17 64.93 Favored 'General case' 0 CA--C 1.507 -0.685 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.677 179.265 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.559 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 9.3 tp10 -66.62 -54.95 17.83 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 106.271 -1.751 . . . . 0.0 106.271 177.114 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.528 ' HB2' ' HA ' ' A' ' 68' ' ' LEU . . . -67.99 -20.13 64.99 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.497 177.226 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.915 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -77.04 -64.49 1.12 Allowed 'General case' 0 CA--C 1.509 -0.627 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.717 179.802 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.913 HD23 ' O ' ' A' ' 117' ' ' LEU . 0.2 OUTLIER -60.63 -21.76 63.06 Favored 'General case' 0 N--CA 1.444 -0.74 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.63 179.416 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.559 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 14.6 ttm-85 -73.9 -57.35 4.04 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.904 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.773 ' HB2' HG12 ' A' ' 67' ' ' VAL . 0.8 OUTLIER -94.37 -21.18 19.12 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -177.395 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -86.42 -66.58 0.89 Allowed 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -178.091 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.325 -0.458 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -178.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . 0.49 ' CB ' HG21 ' A' ' 58' ' ' THR . 3.7 p-10 . . . . . 0 CA--C 1.531 0.231 0 CA-C-O 120.64 0.257 . . . . 0.0 110.712 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.781 HD11 ' C ' ' A' ' 29' ' ' GLY . 5.4 mp -84.95 -80.47 0.21 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.857 0.361 . . . . 0.0 111.054 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.431 ' O ' ' HB2' ' A' ' 8' ' ' LEU . 0.1 OUTLIER 171.3 154.33 0.07 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.884 -179.89 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.896 HD21 ' HB3' ' A' ' 62' ' ' HIS . 30.1 mt -49.17 -65.12 0.62 Allowed 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 121.205 0.526 . . . . 0.0 111.936 -179.392 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.2 t -42.4 -56.76 2.87 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.225 -0.898 . . . . 0.0 112.516 -178.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.86 -56.16 5.61 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.663 0.268 . . . . 0.0 111.055 -179.517 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.837 HD23 HD21 ' A' ' 117' ' ' LEU . 15.8 tp -45.52 -55.01 6.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.106 0.479 . . . . 0.0 110.218 179.317 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.631 ' CG ' HD22 ' A' ' 121' ' ' LEU . 51.5 t-80 -59.62 -47.76 84.33 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.532 178.564 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.2 mmt-85 -49.99 -45.63 51.84 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.512 179.607 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.696 ' CG ' HG22 ' A' ' 31' ' ' VAL . 0.2 OUTLIER -64.68 -65.51 0.66 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.517 179.98 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.799 HG21 ' HB3' ' A' ' 113' ' ' ALA . 12.5 p -57.92 -48.17 84.62 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.768 -179.242 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.766 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 39.6 p -58.24 -53.55 57.03 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.098 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.455 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 8.9 ttm-85 -65.1 -23.81 67.25 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.831 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.446 ' CB ' HD11 ' A' ' 110' ' ' LEU . 7.5 mt -69.94 -61.73 1.66 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.806 0.336 . . . . 0.0 111.46 -179.727 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.734 HG23 HD12 ' A' ' 110' ' ' LEU . 1.2 t -71.41 -27.74 29.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.035 -179.609 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.413 ' CG ' ' O ' ' A' ' 13' ' ' SER . 9.5 mm-40 -72.57 -20.2 61.36 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.727 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.455 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 7.1 pt20 -162.42 57.43 0.23 Allowed 'General case' 0 CA--C 1.527 0.087 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.539 179.516 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 178.64 -60.71 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.159 0 N-CA-C 111.86 0.319 . . . . 0.0 111.86 179.614 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.482 ' OG ' ' HB2' ' A' ' 33' ' ' ALA . 70.2 m -85.89 -78.86 0.26 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.878 0.371 . . . . 0.0 111.514 -179.069 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . 0.591 ' H ' ' HA ' ' A' ' 16' ' ' VAL . . . 123.3 -28.47 5.55 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 121.1 -0.571 . . . . 0.0 112.722 -179.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.491 ' HB3' ' O ' ' A' ' 21' ' ' GLY . 0.0 OUTLIER 167.43 6.08 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.801 0.301 . . . . 0.0 111.61 179.958 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.452 ' O ' ' O ' ' A' ' 22' ' ' ASP . 62.9 m -51.76 -164.75 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.083 0.468 . . . . 0.0 111.535 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.639 ' HA ' ' HA ' ' A' ' 109' ' ' THR . 12.5 m -103.61 155.53 18.48 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.673 ' HA2' HD23 ' A' ' 110' ' ' LEU . . . -106.02 129.05 9.6 Favored Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.249 -0.976 . . . . 0.0 113.878 -178.183 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.96 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -109.87 123.62 49.91 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.504 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.541 HD23 ' N ' ' A' ' 28' ' ' ARG . 9.9 tt -107.61 154.5 21.34 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.156 0.503 . . . . 0.0 111.739 -178.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.541 ' N ' HD23 ' A' ' 27' ' ' LEU . 2.7 mtt180 161.5 52.08 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.067 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.781 ' C ' HD11 ' A' ' 3' ' ' LEU . . . 96.32 -9.44 67.23 Favored Glycine 0 N--CA 1.452 -0.286 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -178.024 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.466 ' N ' HD11 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -165.77 165.04 18.75 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 179.665 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.696 HG22 ' CG ' ' A' ' 11' ' ' GLN . 1.5 m -112.69 138.24 42.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 C-N-CA 120.359 -0.536 . . . . 0.0 110.979 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.96 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -130.42 165.85 21.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.544 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.482 ' HB2' ' OG ' ' A' ' 20' ' ' SER . . . -103.49 115.09 29.88 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.137 0.494 . . . . 0.0 111.574 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.55 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 0.8 OUTLIER -90.93 119.56 31.22 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.184 179.786 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.27 -22.42 10.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.019 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.682 ' CG ' HG23 ' A' ' 37' ' ' THR . 2.2 pt-20 -55.37 -48.52 74.16 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.854 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.682 HG23 ' CG ' ' A' ' 36' ' ' GLU . 8.9 p -103.33 -161.24 0.82 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.411 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 58.7 p -132.83 -35.99 1.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -179.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.78 ' CD1' HG23 ' A' ' 109' ' ' THR . 0.0 OUTLIER 74.25 172.82 0.28 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.828 0.347 . . . . 0.0 110.236 -179.356 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.56 ' N ' ' CG ' ' A' ' 39' ' ' PHE . 0.2 OUTLIER 169.36 37.52 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.122 179.708 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.669 ' C ' ' HB2' ' A' ' 107' ' ' GLN . . . 82.66 -22.05 6.93 Favored Glycine 0 CA--C 1.519 0.313 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.15 -179.141 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.68 HD21 ' CB ' ' A' ' 46' ' ' SER . 12.6 tp -24.17 138.68 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.257 0.623 . . . . 0.0 112.186 179.195 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.509 HG22 ' O ' ' A' ' 43' ' ' THR . 12.8 m -91.58 26.56 2.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.795 -179.42 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.908 HD13 ' HB3' ' A' ' 48' ' ' ALA . 4.4 mm 71.69 3.18 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 179.537 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -74.05 -26.88 60.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.768 0.318 . . . . 0.0 111.113 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.68 ' CB ' HD21 ' A' ' 42' ' ' LEU . 0.5 OUTLIER -95.33 -40.52 9.49 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.074 -179.903 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.79 38.45 0.03 OUTLIER Glycine 0 CA--C 1.519 0.318 0 C-N-CA 120.394 -0.908 . . . . 0.0 113.353 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.908 ' HB3' HD13 ' A' ' 44' ' ' ILE . . . -81.98 159.19 23.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.936 0.368 . . . . 0.0 110.624 179.483 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.45 ' HB3' ' HG2' ' A' ' 52' ' ' GLU . 0.0 OUTLIER -80.2 130.61 35.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.695 179.902 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.715 ' O ' HG22 ' A' ' 54' ' ' VAL . 4.7 mp0 -52.76 -25.66 11.92 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.075 0.464 . . . . 0.0 110.868 179.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . 0.568 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 92.8 p -69.55 -48.65 59.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.026 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.552 ' H ' ' HG2' ' A' ' 52' ' ' GLU . 0.0 OUTLIER -55.28 -56.99 13.69 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 179.15 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.684 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -52.06 -58.78 5.53 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.667 179.654 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.715 HG22 ' O ' ' A' ' 50' ' ' GLU . 16.0 m -52.73 -45.86 49.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 CA-C-O 121.17 0.509 . . . . 0.0 110.401 179.726 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.635 ' CZ ' ' HB1' ' A' ' 113' ' ' ALA . 0.9 OUTLIER -51.42 -46.86 63.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.363 179.237 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.735 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -59.05 -46.65 87.71 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.13 179.168 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 -57.93 -40.58 80.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.417 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.49 HG21 ' CB ' ' A' ' 2' ' ' ASN . 89.2 m -68.4 -58.57 4.15 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.212 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 1.025 HG23 HD12 ' A' ' 117' ' ' LEU . 7.2 p -55.92 -42.45 71.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.021 -179.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.854 HD22 ' HG ' ' A' ' 103' ' ' LEU . 4.9 tp -64.41 -45.2 88.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.553 179.725 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 72.3 m -57.08 -61.2 2.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.872 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . 0.896 ' HB3' HD21 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -49.85 -40.03 40.96 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.009 0.433 . . . . 0.0 110.211 179.572 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.951 HG21 ' HB3' ' A' ' 116' ' ' LEU . 56.1 t -71.47 -80.39 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.648 178.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.419 ' O ' ' HB2' ' A' ' 65' ' ' ASN . . . 67.12 -6.11 0.62 Allowed 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 178.298 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.443 ' C ' HG22 ' A' ' 66' ' ' VAL . 2.6 t-20 175.35 -56.2 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 120.806 0.336 . . . . 0.0 110.172 -179.587 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.914 ' CG1' HG13 ' A' ' 63' ' ' VAL . 27.7 m 42.94 -157.68 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.326 178.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.828 HG22 ' HB3' ' A' ' 97' ' ' ASN . 0.5 OUTLIER -161.53 89.66 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 CA-C-O 122.088 0.947 . . . . 0.0 108.708 179.531 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.611 ' HB3' ' CB ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -89.99 112.64 24.12 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.812 -1.085 . . . . 0.0 113.007 -177.34 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.511 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 9.2 p -62.63 174.95 0.88 Allowed 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.34 -0.845 . . . . 0.0 109.389 178.248 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -43.8 -30.34 0.65 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.869 0.366 . . . . 0.0 111.445 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.415 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 0.2 OUTLIER -63.04 -65.31 0.71 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.138 -179.909 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.634 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 60.1 m-20 -62.25 -28.95 70.06 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.42 -179.644 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.564 HG22 ' N ' ' A' ' 74' ' ' ALA . 0.8 OUTLIER -61.34 -60.32 3.91 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 179.047 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.595 ' HB1' ' OE1' ' A' ' 78' ' ' GLN . . . -58.87 -28.16 65.87 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.487 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 1.055 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -56.08 -52.49 64.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.601 -1.181 . . . . 0.0 110.154 178.513 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 1.026 HD21 HD11 ' A' ' 116' ' ' LEU . 0.5 OUTLIER -67.01 -54.19 24.07 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.308 179.089 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.653 HD12 ' C ' ' A' ' 77' ' ' LEU . 0.4 OUTLIER -54.83 -24.76 24.47 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.4 -179.901 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.595 ' OE1' ' HB1' ' A' ' 74' ' ' ALA . 2.8 mt-30 -75.65 -63.66 1.25 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.399 179.096 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . 0.449 ' CB ' ' HG2' ' A' ' 111' ' ' GLN . 0.0 OUTLIER -56.54 -23.09 37.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.498 179.985 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 2.0 m . . . . . 0 C--N 1.33 -0.276 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -179.185 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . 0.441 ' HA ' ' HB2' ' A' ' 104' ' ' ARG . 8.5 t-20 . . . . . 0 C--O 1.239 0.526 0 CA-C-O 121.073 0.463 . . . . 0.0 110.907 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.584 ' CE2' HD21 ' A' ' 116' ' ' LEU . 5.2 m-85 -107.37 140.56 40.1 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 120.62 -0.432 . . . . 0.0 111.438 -179.453 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.673 ' CG ' HG13 ' A' ' 101' ' ' VAL . 0.7 OUTLIER -108.92 145.36 35.53 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 -179.593 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.826 HD21 HD13 ' A' ' 76' ' ' LEU . 6.2 mt -132.67 148.39 52.35 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 -177.254 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.451 ' O ' ' O ' ' A' ' 99' ' ' VAL . 5.1 ttp180 -146.36 105.04 3.84 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 105.715 -1.957 . . . . 0.0 105.715 177.363 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.687 ' HB2' ' HB3' ' A' ' 98' ' ' SER . 0.1 OUTLIER -103.37 165.4 11.05 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 116.22 1.933 . . . . 0.0 116.22 -174.041 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.573 ' HB ' HD22 ' A' ' 97' ' ' ASN . 0.2 OUTLIER . . . . . 0 C--O 1.242 0.705 0 CA-C-N 111.48 -2.6 . . . . 0.0 106.863 177.67 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.828 ' HB3' HG22 ' A' ' 67' ' ' VAL . 0.0 OUTLIER . . . . . 0 CA--C 1.506 -0.729 0 CA-C-O 121.368 0.604 . . . . 0.0 111.877 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.687 ' HB3' ' HB2' ' A' ' 92' ' ' SER . 3.7 m -153.96 141.33 19.66 Favored 'General case' 0 N--CA 1.436 -1.173 0 CA-C-N 114.987 -1.006 . . . . 0.0 109.633 178.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.451 ' O ' ' O ' ' A' ' 91' ' ' ARG . 76.4 t -104.99 123.04 58.84 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.143 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.499 -179.516 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.834 HD22 HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -102.91 133.33 48.18 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 122.094 0.949 . . . . 0.0 112.821 -178.028 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.673 HG13 ' CG ' ' A' ' 89' ' ' ASP . 0.2 OUTLIER -127.26 117.22 46.63 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 N-CA-C 104.943 -2.243 . . . . 0.0 104.943 176.829 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 0.774 ' O ' ' HB2' ' A' ' 103' ' ' LEU . 0.1 OUTLIER -146.36 165.15 30.19 Favored 'General case' 0 C--N 1.307 -1.267 0 C-N-CA 118.589 -1.244 . . . . 0.0 114.205 -174.91 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.854 ' HG ' HD22 ' A' ' 60' ' ' LEU . 0.6 OUTLIER 126.13 72.41 0.0 OUTLIER 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 112.816 -1.993 . . . . 0.0 112.759 176.11 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.441 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -89.3 -5.28 57.69 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.714 -1.13 . . . . 0.0 108.171 176.889 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' A' ' 41' ' ' GLY . 70.1 m -175.79 172.94 2.42 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 113.891 -1.504 . . . . 0.0 107.405 179.299 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.44 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.4 OUTLIER -104.77 102.4 11.97 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 119.581 -0.848 . . . . 0.0 112.326 -178.982 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.735 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 2.2 mt-30 -168.49 165.22 12.57 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.394 178.393 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.658 ' HB2' ' HB2' ' A' ' 56' ' ' ALA . 4.1 tpt -162.04 149.87 14.54 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 179.333 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . 0.78 HG23 ' CD1' ' A' ' 39' ' ' PHE . 0.7 OUTLIER -116.88 165.21 13.58 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.98 178.732 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.734 HD12 HG23 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -51.73 -59.09 4.69 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 120.837 0.351 . . . . 0.0 110.323 179.513 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . 0.938 ' O ' HG23 ' A' ' 115' ' ' VAL . 2.7 tp60 -48.59 -65.54 0.55 Allowed 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.726 179.743 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 0.677 ' O ' HD22 ' A' ' 116' ' ' LEU . 4.0 t0 -41.95 -54.1 3.6 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-O 121.317 0.579 . . . . 0.0 111.212 179.697 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 0.799 ' HB3' HG21 ' A' ' 12' ' ' VAL . . . -47.98 -64.17 0.87 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.219 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.766 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -60.71 -25.31 66.33 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.956 -0.297 . . . . 0.0 111.253 -179.673 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 1.055 HG22 ' CG ' ' A' ' 75' ' ' LYS . 89.7 t -60.57 -65.49 0.47 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.819 0 CA-C-O 121.58 0.705 . . . . 0.0 110.996 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 1.026 HD11 HD21 ' A' ' 76' ' ' LEU . 0.1 OUTLIER -65.26 -37.41 87.13 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.368 -179.402 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 1.025 HD12 HG23 ' A' ' 59' ' ' VAL . 0.1 OUTLIER -67.59 -24.6 65.52 Favored 'General case' 0 CA--C 1.508 -0.669 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.397 179.422 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.488 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 1.1 tp10 -67.65 -50.38 58.21 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 177.097 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.541 ' CB ' HD23 ' A' ' 68' ' ' LEU . . . -69.62 -24.21 63.62 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.507 -1.224 . . . . 0.0 110.376 177.242 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.899 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -75.69 -65.34 0.91 Allowed 'General case' 0 CA--C 1.51 -0.588 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.711 -179.692 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.631 HD22 ' CG ' ' A' ' 9' ' ' HIS . 0.1 OUTLIER -56.16 -31.72 63.63 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.115 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.488 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 2.3 ttt85 -66.95 -48.8 67.45 Favored 'General case' 0 CA--C 1.528 0.102 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.597 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.61 ' HG3' HG12 ' A' ' 67' ' ' VAL . 0.0 OUTLIER -89.24 -19.1 25.8 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -177.658 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . 0.43 ' HB2' ' CD1' ' A' ' 5' ' ' LEU . 3.5 mm-40 -95.35 -66.51 0.91 Allowed 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -178.541 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.327 -0.385 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -178.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . 0.458 ' HB3' ' CG2' ' A' ' 58' ' ' THR . 6.6 p30 . . . . . 0 CA--C 1.531 0.244 0 CA-C-O 120.88 0.371 . . . . 0.0 111.714 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.926 HD11 HD13 ' A' ' 8' ' ' LEU . 0.2 OUTLIER -88.51 -95.69 0.1 Allowed 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.187 -179.846 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.513 ' O ' ' HB2' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -166.45 146.39 5.98 Favored 'General case' 0 CA--C 1.527 0.082 0 CA-C-O 120.608 0.242 . . . . 0.0 110.349 -179.893 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.728 HD21 ' HB3' ' A' ' 62' ' ' HIS . 19.5 mt -45.87 -65.06 0.6 Allowed 'General case' 0 CA--C 1.51 -0.57 0 CA-C-O 121.018 0.437 . . . . 0.0 111.913 -179.444 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -41.71 -62.05 0.97 Allowed 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.625 -178.327 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . 0.405 ' OD2' HD12 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -59.79 -47.06 87.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.842 179.822 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.926 HD13 HD11 ' A' ' 3' ' ' LEU . 0.1 OUTLIER -54.81 -65.82 0.51 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.997 -179.642 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.53 ' CG ' ' CD2' ' A' ' 121' ' ' LEU . 40.5 t-80 -51.73 -34.3 38.46 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-O 121.61 0.719 . . . . 0.0 109.72 179.166 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.409 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -60.38 -61.38 2.64 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.665 -1.152 . . . . 0.0 110.523 179.919 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.641 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 7.1 pt20 -64.44 -53.22 51.83 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 120.774 -0.37 . . . . 0.0 111.743 -179.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.828 HG23 HD23 ' A' ' 110' ' ' LEU . 13.1 p -51.42 -48.45 34.27 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 121.078 0.466 . . . . 0.0 111.077 -179.67 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.642 ' HA ' ' NZ ' ' A' ' 114' ' ' LYS . 52.4 p -67.58 -31.41 71.44 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.417 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.409 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -72.71 -27.0 61.8 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -178.384 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.641 ' HG ' ' O ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -93.45 -37.99 11.66 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 119.308 -0.957 . . . . 0.0 110.579 179.565 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.886 HG13 ' O ' ' A' ' 20' ' ' SER . 59.5 t -68.67 -50.08 58.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 120.864 0.364 . . . . 0.0 111.239 179.688 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.401 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 2.6 mm100 -70.08 -5.66 28.38 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.392 -179.499 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.401 ' HG2' ' O ' ' A' ' 17' ' ' GLN . 9.0 mt-30 -145.14 32.22 1.11 Allowed 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 111.671 0.248 . . . . 0.0 111.671 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.449 ' N ' ' O ' ' A' ' 15' ' ' LEU . 0.4 OUTLIER 175.46 -71.95 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 179.847 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.952 ' CB ' HD13 ' A' ' 110' ' ' LEU . 0.7 OUTLIER -76.65 75.87 3.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.595 -178.629 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -62.83 74.72 0.03 OUTLIER Glycine 0 C--N 1.318 -0.445 0 CA-C-N 115.219 -0.9 . . . . 0.0 112.882 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.42 ' N ' ' O ' ' A' ' 20' ' ' SER . 16.3 t70 78.53 9.84 1.94 Allowed 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 179.226 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.464 ' O ' ' OG1' ' A' ' 109' ' ' THR . 0.9 OUTLIER -61.78 -167.49 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.191 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.132 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.502 ' CG2' ' HB3' ' A' ' 39' ' ' PHE . 94.6 m -103.56 142.34 34.45 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.629 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.614 ' CA ' ' HG ' ' A' ' 110' ' ' LEU . . . -104.76 149.45 16.89 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.049 -1.072 . . . . 0.0 114.157 -178.101 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.821 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -114.19 133.35 55.66 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 178.552 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.703 HD13 ' OG1' ' A' ' 58' ' ' THR . 7.8 tt -113.17 149.94 32.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.377 0.608 . . . . 0.0 111.966 -179.285 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 165.42 64.23 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.183 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.608 ' C ' HD22 ' A' ' 3' ' ' LEU . . . 78.25 -4.87 57.38 Favored Glycine 0 C--N 1.334 0.417 0 C-N-CA 120.681 -0.771 . . . . 0.0 111.214 -177.89 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.497 ' C ' ' ND2' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -166.26 166.11 17.01 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 -179.772 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.609 ' CG1' ' HG3' ' A' ' 11' ' ' GLN . 13.5 p -105.71 144.76 14.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.223 0.535 . . . . 0.0 111.765 179.361 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.821 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -129.68 159.76 35.45 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.25 178.385 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.78 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -104.17 120.78 41.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.21 0.529 . . . . 0.0 111.832 -179.246 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.459 ' ND2' ' HB ' ' A' ' 24' ' ' THR . 5.0 t30 -104.41 110.11 22.24 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.133 179.528 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -110.82 -32.29 6.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.518 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -63.67 -49.13 74.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.736 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -95.46 171.85 8.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.613 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.4 p -141.15 110.3 6.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.062 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.75 ' CZ ' HG22 ' A' ' 109' ' ' THR . 0.0 OUTLIER -62.64 -175.85 0.1 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.374 179.829 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.507 ' HB3' ' O ' ' A' ' 39' ' ' PHE . 1.1 pm0 160.94 44.56 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.094 179.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.405 ' HA2' ' HB2' ' A' ' 107' ' ' GLN . . . 48.8 88.61 0.01 OUTLIER Glycine 0 CA--C 1.52 0.346 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.006 -178.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.459 HD13 ' HA ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -125.9 -155.12 0.66 Allowed 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 -179.948 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.83 8.46 3.54 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.77 HD13 ' HB3' ' A' ' 48' ' ' ALA . 3.6 mm 75.2 2.32 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 179.685 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -93.85 -24.28 17.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.814 0.34 . . . . 0.0 110.896 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.6 t -93.59 -66.64 0.91 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.003 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -163.13 32.76 0.29 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.556 -0.83 . . . . 0.0 112.904 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.77 ' HB3' HD13 ' A' ' 44' ' ' ILE . . . -99.54 165.7 11.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.647 0.26 . . . . 0.0 110.925 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -109.74 149.39 29.85 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.876 0.37 . . . . 0.0 111.188 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.653 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 1.0 OUTLIER -58.66 -26.83 64.19 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.849 179.719 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . 0.513 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 20.6 p -70.34 -52.31 23.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.817 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.517 ' HB3' ' HG2' ' A' ' 107' ' ' GLN . 1.0 OUTLIER -53.03 -52.08 59.62 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.991 0.424 . . . . 0.0 110.535 179.434 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.653 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -57.9 -54.9 41.69 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.313 -179.967 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.626 HG22 ' O ' ' A' ' 50' ' ' GLU . 19.4 m -55.9 -46.56 80.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 CA-C-O 121.114 0.483 . . . . 0.0 110.165 179.6 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.828 ' O ' HG13 ' A' ' 59' ' ' VAL . 0.5 OUTLIER -50.78 -45.73 59.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.899 178.767 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.734 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -60.36 -41.98 94.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.407 179.143 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.8 mm-40 -66.42 -36.91 84.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.371 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.703 ' OG1' HD13 ' A' ' 27' ' ' LEU . 59.5 p -73.9 -50.72 18.88 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 121.091 0.472 . . . . 0.0 110.045 179.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.828 HG13 ' O ' ' A' ' 55' ' ' PHE . 5.1 m -61.49 -46.81 95.82 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.696 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.988 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.728 HD22 ' CD2' ' A' ' 103' ' ' LEU . 14.3 tp -66.38 -47.09 74.46 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.636 -0.256 . . . . 0.0 111.547 -179.858 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.5 m -61.06 -63.88 1.15 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.189 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . 0.728 ' HB3' HD21 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -47.39 -30.36 3.24 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 121.101 0.477 . . . . 0.0 110.607 -179.737 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 1.009 HG21 ' HB3' ' A' ' 116' ' ' LEU . 25.1 t -80.32 -69.75 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.753 179.034 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.406 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 40.19 26.1 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 178.678 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.498 ' H ' HG12 ' A' ' 63' ' ' VAL . 0.7 OUTLIER 163.78 -74.38 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.775 0.321 . . . . 0.0 110.688 -179.764 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.916 ' CG1' HG13 ' A' ' 63' ' ' VAL . 25.0 m 44.02 -165.9 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.727 179.821 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.602 ' HB ' ' HB3' ' A' ' 97' ' ' ASN . 26.9 m -149.6 60.54 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.435 -1.206 0 CA-C-O 120.906 0.384 . . . . 0.0 111.511 -178.539 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.981 HD22 HD11 ' A' ' 76' ' ' LEU . 1.1 mp -49.21 101.4 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.619 -179.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 22.6 p -60.99 -166.78 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.92 -33.79 67.32 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.11 0.481 . . . . 0.0 110.862 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.443 ' O ' ' HE3' ' A' ' 75' ' ' LYS . 1.6 tm-20 -70.72 -65.45 0.73 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.205 -179.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.739 ' HB3' HD23 ' A' ' 68' ' ' LEU . 3.1 m-20 -51.03 -26.25 5.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.021 -179.655 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.446 ' CG2' ' OG ' ' A' ' 98' ' ' SER . 1.1 p -72.7 -54.62 8.49 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 177.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.561 ' HA ' HD21 ' A' ' 77' ' ' LEU . . . -54.45 -29.38 49.46 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 176.6 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 1.043 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -58.75 -60.8 3.26 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 113.742 -1.572 . . . . 0.0 110.489 178.289 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 1.099 HD13 HD23 ' A' ' 90' ' ' LEU . 1.0 OUTLIER -52.83 -56.91 12.3 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.139 0.495 . . . . 0.0 110.483 179.41 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.561 HD21 ' HA ' ' A' ' 74' ' ' ALA . 3.3 pp -59.67 -31.13 69.27 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.119 -179.481 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.428 ' N ' HD12 ' A' ' 77' ' ' LEU . 20.0 mm-40 -70.59 -58.62 3.49 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.945 0.402 . . . . 0.0 110.351 179.321 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . 0.415 ' CB ' ' HG2' ' A' ' 111' ' ' GLN . 1.2 t -50.46 -35.78 30.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.813 179.632 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.495 HG21 ' CE1' ' A' ' 88' ' ' TYR . 2.7 m . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.986 -179.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . 0.436 ' O ' ' HB2' ' A' ' 104' ' ' ARG . 0.1 OUTLIER . . . . . 0 CA--C 1.533 0.313 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.904 ' CE2' HD11 ' A' ' 90' ' ' LEU . 8.8 p90 -87.24 146.3 26.03 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-O 121.109 0.481 . . . . 0.0 111.702 -179.08 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.779 ' O ' ' O ' ' A' ' 101' ' ' VAL . 1.3 t0 -129.01 154.08 46.97 Favored 'General case' 0 N--CA 1.431 -1.404 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 178.62 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 1.099 HD23 HD13 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -157.9 147.79 20.17 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 114.668 1.358 . . . . 0.0 114.668 -178.578 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.564 ' HB3' ' HB ' ' A' ' 99' ' ' VAL . 0.0 OUTLIER -107.71 165.2 11.61 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 105.127 -2.175 . . . . 0.0 105.127 174.876 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.6 ' HA ' ' HA ' ' A' ' 98' ' ' SER . 75.6 p -139.42 165.18 27.9 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 116.065 1.876 . . . . 0.0 116.065 -177.689 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.594 ' C ' ' O ' ' A' ' 97' ' ' ASN . 0.2 OUTLIER . . . . . 0 C--N 1.323 -0.557 0 CA-C-N 111.448 -2.614 . . . . 0.0 107.502 178.583 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.602 ' HB3' ' HB ' ' A' ' 67' ' ' VAL . 0.3 OUTLIER . . . . . 0 N--CA 1.442 -0.835 0 CA-C-O 121.535 0.683 . . . . 0.0 111.885 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.6 ' HA ' ' HA ' ' A' ' 92' ' ' SER . 2.1 m -149.94 145.02 26.24 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 179.052 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.564 ' HB ' ' HB3' ' A' ' 91' ' ' ARG . 73.7 t -103.48 152.69 6.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 120.887 0.375 . . . . 0.0 111.669 -177.033 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 1.078 HD21 HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -108.95 130.47 55.45 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 114.916 1.45 . . . . 0.0 114.916 -177.211 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.779 ' O ' ' O ' ' A' ' 89' ' ' ASP . 2.1 p -143.95 103.02 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 N-CA-C 104.581 -2.377 . . . . 0.0 104.581 174.315 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 0.583 ' O ' HD23 ' A' ' 103' ' ' LEU . 0.1 OUTLIER -146.42 164.49 32.29 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 119.065 -1.054 . . . . 0.0 113.17 -174.843 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.815 HD13 ' O ' ' A' ' 105' ' ' SER . 0.1 OUTLIER 156.17 -90.96 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 113.505 -1.679 . . . . 0.0 111.372 176.722 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.436 ' HB2' ' O ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER 60.04 18.16 7.4 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 -179.407 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.815 ' O ' HD13 ' A' ' 103' ' ' LEU . 1.1 p 153.18 170.95 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -178.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.426 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.4 OUTLIER -110.73 100.02 8.85 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 119.25 -0.98 . . . . 0.0 111.452 179.264 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.734 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 1.3 mt-30 -169.19 164.96 11.1 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.742 -1.117 . . . . 0.0 109.174 177.685 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.566 ' HB2' ' HB2' ' A' ' 56' ' ' ALA . 2.3 tpt -160.76 145.49 14.13 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.121 0.486 . . . . 0.0 111.495 178.668 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . 0.75 HG22 ' CZ ' ' A' ' 39' ' ' PHE . 0.6 OUTLIER -107.62 156.06 19.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.053 179.513 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.952 HD13 ' CB ' ' A' ' 20' ' ' SER . 0.6 OUTLIER -46.77 -53.48 11.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.746 0.308 . . . . 0.0 111.151 -179.51 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . 0.925 ' O ' HG23 ' A' ' 115' ' ' VAL . 0.2 OUTLIER -54.05 -61.95 1.97 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.212 179.324 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 0.504 ' HB2' HG23 ' A' ' 109' ' ' THR . 0.8 OUTLIER -46.54 -47.07 19.67 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.935 179.511 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 0.581 ' HB1' ' CZ ' ' A' ' 55' ' ' PHE . . . -53.01 -56.51 15.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.838 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.642 ' NZ ' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -66.11 -28.77 69.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.827 179.94 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 1.043 HG22 ' CG ' ' A' ' 75' ' ' LYS . 94.1 t -57.15 -65.27 0.42 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.729 0 CA-C-O 122.029 0.919 . . . . 0.0 110.588 179.235 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 1.009 ' HB3' HG21 ' A' ' 63' ' ' VAL . 9.5 mp -63.5 -40.63 97.58 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 114.437 -1.256 . . . . 0.0 111.003 -179.131 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.809 HD22 ' HB3' ' A' ' 8' ' ' LEU . 0.6 OUTLIER -73.62 -15.92 61.25 Favored 'General case' 0 CA--C 1.512 -0.507 0 C-N-CA 120.325 -0.55 . . . . 0.0 111.341 -179.809 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.488 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 20.5 tt0 -73.57 -47.84 37.48 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 105.928 -1.878 . . . . 0.0 105.928 176.143 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.431 ' CB ' ' HG ' ' A' ' 68' ' ' LEU . . . -71.77 -29.02 64.03 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 114.693 -1.139 . . . . 0.0 109.868 177.073 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.968 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -68.27 -64.82 0.79 Allowed 'General case' 0 CA--C 1.504 -0.808 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.612 179.614 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.696 HD23 ' O ' ' A' ' 117' ' ' LEU . 0.2 OUTLIER -57.52 -39.27 76.17 Favored 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 119.987 -0.685 . . . . 0.0 109.24 179.509 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.57 ' N ' ' HG ' ' A' ' 121' ' ' LEU . 19.8 ttm-85 -54.73 -45.16 74.05 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.94 179.153 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -86.21 -31.63 21.62 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -178.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -95.75 -66.52 0.9 Allowed 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 -178.197 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 47.8 t . . . . . 0 C--N 1.33 -0.276 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 -177.595 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 1.6 p30 . . . . . 0 CA--C 1.532 0.284 0 CA-C-O 120.7 0.286 . . . . 0.0 110.831 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 1.041 HD11 HD12 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -106.85 -81.83 0.55 Allowed 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.108 -179.632 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.521 ' O ' ' HB2' ' A' ' 8' ' ' LEU . 34.9 t -178.23 -162.27 0.06 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.719 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.709 HD21 ' HB3' ' A' ' 62' ' ' HIS . 4.3 mt -95.38 -65.2 0.99 Allowed 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 121.24 0.543 . . . . 0.0 111.283 179.726 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . 0.427 ' HA ' HD13 ' A' ' 121' ' ' LEU . 1.7 t -44.56 -39.32 4.83 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.636 -178.76 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.98 -62.8 1.58 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.266 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 1.069 HD11 HD11 ' A' ' 27' ' ' LEU . 2.7 tp -46.57 -41.69 14.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.357 0.598 . . . . 0.0 109.97 179.043 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.61 ' CG ' HD22 ' A' ' 121' ' ' LEU . 33.7 t-80 -69.34 -45.66 68.93 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.521 178.667 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.9 mtt-85 -54.87 -44.28 73.89 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.193 179.236 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.658 ' CB ' HG13 ' A' ' 31' ' ' VAL . 4.4 mp0 -64.63 -65.17 0.71 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.733 179.432 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 1.0 HG23 HD23 ' A' ' 110' ' ' LEU . 9.6 p -54.8 -47.81 74.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.082 -179.382 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.65 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 7.8 t -60.74 -50.22 74.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.404 -179.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.407 ' HG3' ' NE2' ' A' ' 18' ' ' GLN . 1.3 tpm_? -68.05 -22.47 64.94 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.374 -179.465 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.603 HD11 ' O ' ' A' ' 31' ' ' VAL . 12.4 mt -74.31 -60.14 2.41 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.402 -179.7 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.638 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 0.9 OUTLIER -70.81 -28.57 34.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.204 -179.384 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.442 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 5.7 mm-40 -85.46 -9.07 57.98 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.73 -0.388 . . . . 0.0 111.312 -179.681 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.442 ' HG2' ' O ' ' A' ' 17' ' ' GLN . 7.0 mt-30 -152.92 42.38 0.61 Allowed 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 179.759 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 177.56 -69.54 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 179.667 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.638 ' HB2' ' HA ' ' A' ' 16' ' ' VAL . 20.0 m -70.62 -81.5 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.973 -0.558 . . . . 0.0 112.126 -178.315 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . 0.637 ' H ' ' HA ' ' A' ' 16' ' ' VAL . . . 120.42 -33.43 4.5 Favored Glycine 0 N--CA 1.45 -0.376 0 N-CA-C 111.549 -0.62 . . . . 0.0 111.549 -179.22 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 169.64 28.18 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 120.764 0.316 . . . . 0.0 110.98 179.692 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.432 ' HB2' ' HB3' ' A' ' 20' ' ' SER . 0.8 OUTLIER -80.74 -156.34 0.13 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.467 -179.903 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.665 HG21 ' CD2' ' A' ' 39' ' ' PHE . 0.1 OUTLIER -104.02 163.05 12.64 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.813 0.339 . . . . 0.0 110.589 -179.944 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . 0.428 ' HA3' ' CE2' ' A' ' 55' ' ' PHE . . . -110.71 150.72 17.72 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.541 -0.837 . . . . 0.0 113.647 -178.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.73 ' HB3' ' HB3' ' A' ' 32' ' ' ALA . 0.3 OUTLIER -114.33 104.44 12.07 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.229 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 1.069 HD11 HD11 ' A' ' 8' ' ' LEU . 0.5 OUTLIER -107.31 152.66 23.84 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -178.108 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.483 ' CB ' ' O ' ' A' ' 27' ' ' LEU . 5.7 ptp180 143.34 55.84 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 114.281 -1.327 . . . . 0.0 109.574 179.007 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.539 ' C ' HD22 ' A' ' 3' ' ' LEU . . . 105.83 -12.8 45.98 Favored Glycine 0 C--N 1.333 0.407 0 N-CA-C 111.388 -0.685 . . . . 0.0 111.388 -178.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.442 ' O ' ' HA ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -166.38 165.23 17.28 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 179.849 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.677 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 1.4 m -121.8 117.29 51.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.244 0.545 . . . . 0.0 110.975 179.228 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.73 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . . . -107.99 166.27 10.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.874 -179.615 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.525 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -103.36 119.73 39.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.094 0.473 . . . . 0.0 111.316 -179.503 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.485 ' ND2' ' CE2' ' A' ' 39' ' ' PHE . 7.0 t30 -98.56 122.09 41.32 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.931 -179.741 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.2 mtmm -118.68 -22.51 7.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.131 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -68.86 -16.21 63.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.486 -179.754 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -134.82 -175.14 3.8 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.985 0.421 . . . . 0.0 111.261 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 72.3 p -147.86 106.84 3.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.872 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.737 ' O ' HG22 ' A' ' 109' ' ' THR . 21.8 m-85 -116.21 138.12 51.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.484 0.659 . . . . 0.0 112.57 -178.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -126.17 -45.99 1.67 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.065 179.419 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.469 ' HA2' ' HB2' ' A' ' 107' ' ' GLN . . . 177.04 76.43 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.278 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.112 179.231 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.608 ' H ' ' HB2' ' A' ' 107' ' ' GLN . 0.1 OUTLIER -113.2 -159.53 0.69 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 179.636 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.481 ' H ' HD12 ' A' ' 42' ' ' LEU . 0.2 OUTLIER -137.19 26.75 2.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.733 0.301 . . . . 0.0 111.793 179.963 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.831 ' HA ' ' HB3' ' A' ' 48' ' ' ALA . 1.1 mp 68.14 3.49 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 112.141 0.422 . . . . 0.0 112.141 179.536 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -93.89 -33.51 13.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.865 0.364 . . . . 0.0 110.874 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 3.2 t -98.83 -29.47 12.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.833 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 159.4 83.47 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.617 -0.801 . . . . 0.0 112.559 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.831 ' HB3' ' HA ' ' A' ' 44' ' ' ILE . . . -141.58 -177.48 5.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.044 0.45 . . . . 0.0 111.381 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.1 tpm_? -140.78 143.64 35.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.154 179.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.799 ' O ' HG23 ' A' ' 54' ' ' VAL . 2.5 mp0 -48.57 -35.16 12.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.216 0.532 . . . . 0.0 110.981 -179.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . 0.461 ' CB ' ' HG2' ' A' ' 26' ' ' LYS . 0.7 OUTLIER -63.4 -60.61 3.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.374 -179.817 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.542 ' HG3' ' CD2' ' A' ' 39' ' ' PHE . 0.5 OUTLIER -44.41 -65.74 0.48 Allowed 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.149 0.5 . . . . 0.0 110.568 -179.752 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.518 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -47.16 -50.03 21.32 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.796 179.366 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.799 HG23 ' O ' ' A' ' 50' ' ' GLU . 57.0 t -56.53 -39.19 60.56 Favored 'Isoleucine or valine' 0 C--O 1.231 0.112 0 CA-C-O 121.013 0.435 . . . . 0.0 109.906 179.085 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.935 ' CD1' HD13 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -56.66 -51.05 70.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.01 179.23 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.632 ' HB2' ' HB2' ' A' ' 108' ' ' MET . . . -62.34 -32.79 73.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.509 179.187 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.2 tp-100 -71.26 -52.29 19.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.012 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.443 ' OG1' HD23 ' A' ' 27' ' ' LEU . 2.2 m -60.15 -48.22 82.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.076 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.663 ' CG2' HD12 ' A' ' 117' ' ' LEU . 9.7 p -66.36 -44.79 90.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 C-N-CA 120.585 -0.446 . . . . 0.0 111.314 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.49 HD13 HD23 ' A' ' 103' ' ' LEU . 0.6 OUTLIER -54.21 -44.98 72.09 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 121.028 0.442 . . . . 0.0 110.208 179.774 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 42.3 m -63.11 -59.17 5.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.179 179.781 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . 0.709 ' HB3' HD21 ' A' ' 5' ' ' LEU . 0.1 OUTLIER -50.89 -49.45 59.36 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-O 120.861 0.362 . . . . 0.0 110.564 -179.951 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.961 HG22 ' HB2' ' A' ' 120' ' ' ALA . 73.5 t -58.13 -66.51 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.86 178.82 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.493 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 36.78 32.21 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.859 178.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.554 ' O ' HG22 ' A' ' 66' ' ' VAL . 9.8 t-20 155.29 -79.47 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 122.466 0.307 . . . . 0.0 110.759 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.957 ' CG1' HG13 ' A' ' 63' ' ' VAL . 15.9 m 46.68 -155.9 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 116.121 -0.491 . . . . 0.0 112.001 179.683 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.759 HG13 ' O ' ' A' ' 67' ' ' VAL . 8.1 p -172.93 60.96 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.112 0 CA-C-O 121.643 0.735 . . . . 0.0 111.017 -179.506 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.997 HD11 ' HB2' ' A' ' 100' ' ' LEU . 0.5 OUTLIER -42.62 99.05 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.101 -0.954 . . . . 0.0 112.465 -179.551 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 75.1 p -60.25 178.06 0.22 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.751 178.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.23 -31.96 1.72 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.996 0.427 . . . . 0.0 110.955 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.81 -64.34 0.88 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.502 179.667 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.641 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 69.0 m-20 -60.55 -27.85 67.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.363 179.611 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 20.3 m -62.62 -61.34 2.49 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.0 -26.14 61.99 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 177.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 1.076 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.4 OUTLIER -57.24 -64.06 1.01 Allowed 'General case' 0 C--O 1.235 0.306 0 CA-C-N 114.777 -1.101 . . . . 0.0 110.134 178.783 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 1.019 HD13 HD21 ' A' ' 90' ' ' LEU . 0.4 OUTLIER -57.96 -39.22 77.58 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.806 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -52.63 -43.73 65.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.798 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.46 -50.54 30.66 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.595 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . 0.452 ' HB3' ' CG ' ' A' ' 111' ' ' GLN . 35.6 p -62.24 -26.55 68.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.635 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.703 HG22 ' O ' ' A' ' 76' ' ' LEU . 13.1 t . . . . . 0 C--N 1.33 -0.278 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -179.124 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . 0.488 ' HB2' ' O ' ' A' ' 103' ' ' LEU . 29.4 p-10 . . . . . 0 CA--C 1.533 0.296 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.506 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 3.3 m-85 -102.83 131.87 49.41 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 120.958 0.408 . . . . 0.0 111.208 -179.194 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.768 ' CG ' HG13 ' A' ' 101' ' ' VAL . 1.0 OUTLIER -109.22 144.28 37.54 Favored 'General case' 0 N--CA 1.435 -1.206 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 -179.445 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 1.019 HD21 HD13 ' A' ' 76' ' ' LEU . 39.7 mt -135.28 158.84 43.34 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -177.261 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.674 ' O ' ' CB ' ' A' ' 98' ' ' SER . 0.1 OUTLIER -134.16 161.32 35.22 Favored 'General case' 0 C--O 1.216 -0.659 0 CA-C-N 114.63 -1.168 . . . . 0.0 108.355 178.101 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.788 ' O ' HG13 ' A' ' 93' ' ' VAL . 17.9 p -103.96 157.93 16.76 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.82 0.819 . . . . 0.0 112.74 -178.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.788 HG13 ' O ' ' A' ' 92' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.435 -1.197 0 CA-C-N 113.87 -1.514 . . . . 0.0 108.089 -179.171 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.593 ' O ' ' O ' ' A' ' 93' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.452 -0.354 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.674 ' CB ' ' O ' ' A' ' 91' ' ' ARG . 0.1 OUTLIER -140.41 165.34 27.68 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.184 0.516 . . . . 0.0 110.908 179.847 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.499 HG12 ' HB2' ' A' ' 91' ' ' ARG . 0.5 OUTLIER -104.14 150.68 7.13 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 115.361 -0.836 . . . . 0.0 108.869 179.562 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.997 ' HB2' HD11 ' A' ' 68' ' ' LEU . 3.2 tp -103.79 106.31 16.78 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 113.423 0.897 . . . . 0.0 113.423 -178.476 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.768 HG13 ' CG ' ' A' ' 89' ' ' ASP . 1.4 p -121.85 104.19 14.56 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.978 0 N-CA-C 104.007 -2.59 . . . . 0.0 104.007 174.623 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 0.581 ' O ' HD23 ' A' ' 103' ' ' LEU . 0.2 OUTLIER -149.87 161.31 42.53 Favored 'General case' 0 C--N 1.309 -1.194 0 C-N-CA 118.829 -1.148 . . . . 0.0 114.036 -173.841 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.581 HD23 ' O ' ' A' ' 102' ' ' SER . 0.1 OUTLIER 166.14 -69.48 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 113.478 -1.692 . . . . 0.0 112.278 175.343 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.552 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 35.14 56.18 0.79 Allowed 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.055 0.455 . . . . 0.0 110.228 179.6 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.552 ' CB ' ' O ' ' A' ' 104' ' ' ARG . 11.4 m 105.27 167.98 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.545 -177.579 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.426 ' HB3' ' CB ' ' A' ' 53' ' ' LYS . 0.5 OUTLIER -104.74 102.33 11.91 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.092 -0.643 . . . . 0.0 112.665 -178.545 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.822 ' OE1' ' HB2' ' A' ' 48' ' ' ALA . 0.9 OUTLIER -168.72 165.1 12.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.841 177.989 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.686 ' HB3' ' HB3' ' A' ' 55' ' ' PHE . 18.6 ttm -165.59 143.4 5.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.346 0.593 . . . . 0.0 112.286 178.668 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . 0.737 HG22 ' O ' ' A' ' 39' ' ' PHE . 0.1 OUTLIER -104.38 165.11 11.27 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.027 -0.988 . . . . 0.0 109.078 178.287 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 1.0 HD23 HG23 ' A' ' 12' ' ' VAL . 7.0 mt -56.03 -52.87 62.7 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.665 0.269 . . . . 0.0 111.395 -179.369 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . 0.849 ' O ' HG23 ' A' ' 115' ' ' VAL . 1.8 tp60 -50.45 -65.19 0.6 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.786 0.327 . . . . 0.0 110.642 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 0.893 ' O ' HD22 ' A' ' 116' ' ' LEU . 0.3 OUTLIER -47.71 -45.53 28.69 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.096 0.474 . . . . 0.0 110.895 179.898 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 0.845 ' HB1' ' CE1' ' A' ' 55' ' ' PHE . . . -49.42 -61.24 2.21 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.936 179.664 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.697 ' NZ ' HG22 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -66.36 -25.52 66.84 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.239 -179.982 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 1.076 HG22 ' CG ' ' A' ' 75' ' ' LYS . 76.6 t -58.36 -65.11 0.46 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.808 0 CA-C-O 121.991 0.9 . . . . 0.0 110.305 179.37 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.893 HD22 ' O ' ' A' ' 112' ' ' ASP . 0.0 OUTLIER -62.95 -40.98 99.3 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.645 -179.476 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.874 ' CD1' HD23 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -69.03 -22.41 64.05 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 120.792 0.33 . . . . 0.0 111.433 -179.763 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.594 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 30.8 tt0 -69.75 -49.51 52.4 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 106.008 -1.849 . . . . 0.0 106.008 177.324 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.657 ' O ' ' HB2' ' A' ' 123' ' ' GLN . . . -70.18 -28.27 65.18 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.081 177.384 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 0.961 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -72.05 -63.58 1.11 Allowed 'General case' 0 CA--C 1.511 -0.537 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.397 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.61 HD22 ' CG ' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -55.99 -42.35 76.23 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.314 -179.746 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.594 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.4 OUTLIER -67.37 -39.14 85.65 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.904 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.657 ' HB2' ' O ' ' A' ' 119' ' ' ALA . 1.7 mp0 -77.15 -36.73 54.99 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -178.711 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -96.17 -69.74 0.74 Allowed 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 -177.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 26.0 t . . . . . 0 N--CA 1.464 0.226 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -178.774 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.782 0.325 . . . . 0.0 110.815 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.898 HD11 ' HA ' ' A' ' 30' ' ' ASN . 1.2 mt -68.87 -81.56 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.062 0.458 . . . . 0.0 110.368 179.469 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.414 ' CB ' ' OD1' ' A' ' 7' ' ' ASP . 0.6 OUTLIER -170.12 -156.11 0.13 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.616 179.732 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 1.089 HD21 ' HB1' ' A' ' 120' ' ' ALA . 0.3 OUTLIER -95.71 -66.31 0.92 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.712 0.768 . . . . 0.0 112.429 -179.33 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.2 p -65.08 -41.14 95.31 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.549 -1.205 . . . . 0.0 112.87 -177.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . 0.414 ' OD1' ' CB ' ' A' ' 4' ' ' SER . 0.1 OUTLIER -67.53 -48.21 67.67 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.23 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.887 HD23 HD21 ' A' ' 117' ' ' LEU . 18.2 tp -51.74 -46.58 64.09 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.927 178.738 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.571 ' CG ' ' CD2' ' A' ' 121' ' ' LEU . 46.1 t-80 -65.06 -39.92 93.98 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.538 178.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.407 ' HB2' ' O ' ' A' ' 7' ' ' ASP . 0.1 OUTLIER -52.06 -53.14 45.79 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.258 -179.691 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.979 ' HG3' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -69.64 -55.38 10.2 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 120.885 -0.326 . . . . 0.0 111.566 -179.706 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.687 HG23 HG21 ' A' ' 31' ' ' VAL . 2.4 p -55.82 -46.82 80.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 CA-C-O 120.973 0.416 . . . . 0.0 111.244 -179.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.805 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 56.0 p -60.96 -53.32 58.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.309 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.48 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 0.6 OUTLIER -60.73 -21.09 62.59 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.823 0.344 . . . . 0.0 110.445 -179.916 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.61 HD12 ' O ' ' A' ' 11' ' ' GLN . 4.8 mt -78.11 -65.54 0.96 Allowed 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 112.74 0.645 . . . . 0.0 112.74 -179.247 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.655 HG23 HD13 ' A' ' 110' ' ' LEU . 0.9 OUTLIER -72.49 -26.75 24.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.526 -0.47 . . . . 0.0 111.662 -178.863 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.457 ' HB2' ' O ' ' A' ' 13' ' ' SER . 3.5 mm100 -70.54 -21.86 62.67 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.461 -0.495 . . . . 0.0 110.326 179.639 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.48 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 2.1 pt20 -165.99 63.33 0.11 Allowed 'General case' 0 CA--C 1.528 0.113 0 CA-C-O 120.75 0.31 . . . . 0.0 111.318 179.376 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 175.53 -57.72 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.537 179.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.591 ' CB ' HD13 ' A' ' 110' ' ' LEU . 63.5 m -85.51 -39.63 17.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.647 -179.179 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 59.53 69.23 1.34 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.45 -0.881 . . . . 0.0 111.969 -179.447 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.42 ' N ' HG22 ' A' ' 16' ' ' VAL . 0.0 OUTLIER 58.77 88.7 0.06 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.977 0.418 . . . . 0.0 110.7 -179.635 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . 0.449 ' HB2' ' HB3' ' A' ' 20' ' ' SER . 97.1 m -149.79 -162.91 1.66 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.962 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.774 ' CG2' HG22 ' A' ' 109' ' ' THR . 0.0 OUTLIER -104.46 147.96 26.99 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.713 -179.923 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -104.99 140.6 15.07 Favored Glycine 0 N--CA 1.443 -0.834 0 C-N-CA 120.282 -0.961 . . . . 0.0 113.386 -178.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.963 ' HB3' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -104.45 121.77 44.13 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 178.967 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.772 HD22 HG12 ' A' ' 54' ' ' VAL . 8.7 tt -104.6 149.04 25.86 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.327 0.584 . . . . 0.0 112.243 -178.762 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 162.33 55.76 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.383 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.716 ' O ' HD21 ' A' ' 3' ' ' LEU . . . 90.61 -8.1 80.32 Favored Glycine 0 C--N 1.332 0.336 0 N-CA-C 111.355 -0.698 . . . . 0.0 111.355 -178.153 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.898 ' HA ' HD11 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -165.92 162.97 18.54 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 179.815 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.979 HG12 ' HG3' ' A' ' 11' ' ' GLN . 7.4 p -104.7 133.58 48.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 121.482 0.658 . . . . 0.0 110.784 178.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.963 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . . . -113.22 166.38 11.51 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.657 -179.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.529 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -102.14 105.95 16.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.617 0.722 . . . . 0.0 110.573 -179.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.496 HD21 ' HE1' ' A' ' 39' ' ' PHE . 62.0 t30 -91.47 114.35 26.85 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.604 -1.18 . . . . 0.0 111.321 -179.015 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -131.08 40.22 3.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.558 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -110.93 -38.89 4.97 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.589 -179.383 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.809 ' O ' HG23 ' A' ' 38' ' ' THR . 89.5 m -122.51 -106.44 0.36 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.511 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.809 HG23 ' O ' ' A' ' 37' ' ' THR . 0.7 OUTLIER -174.44 -49.1 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 113.037 0.754 . . . . 0.0 113.037 179.933 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.639 ' O ' ' O ' ' A' ' 38' ' ' THR . 0.9 OUTLIER 45.1 122.38 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.879 0.847 . . . . 0.0 110.977 -177.72 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.631 HE22 HD12 ' A' ' 42' ' ' LEU . 1.1 pp0? -128.61 40.38 3.66 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.0 -178.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.622 ' C ' ' HB2' ' A' ' 107' ' ' GLN . . . 90.24 8.53 66.37 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 115.396 -0.82 . . . . 0.0 113.112 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.631 HD12 HE22 ' A' ' 40' ' ' GLN . 0.3 OUTLIER -49.41 -166.58 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 117.04 0.42 . . . . 0.0 111.364 179.311 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.674 ' C ' HD12 ' A' ' 44' ' ' ILE . 1.5 m -132.58 24.17 4.38 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -179.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.809 ' HA ' ' HB3' ' A' ' 48' ' ' ALA . 1.3 mp 67.4 2.89 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 179.627 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.74 -32.51 60.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.847 0.356 . . . . 0.0 111.011 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.551 ' CB ' HD21 ' A' ' 42' ' ' LEU . 7.8 t -82.06 -62.64 1.57 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.095 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -175.07 32.54 0.09 OUTLIER Glycine 0 C--N 1.331 0.281 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.997 -179.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.809 ' HB3' ' HA ' ' A' ' 44' ' ' ILE . . . -83.7 -163.95 0.84 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.073 0.463 . . . . 0.0 111.64 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -130.79 -178.31 4.74 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.134 179.528 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.647 ' O ' HG23 ' A' ' 54' ' ' VAL . 2.4 mp0 -83.03 -27.88 30.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.91 0.386 . . . . 0.0 110.842 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . 0.437 ' CB ' ' HG2' ' A' ' 26' ' ' LYS . 1.5 m -55.41 -65.14 0.64 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.743 -179.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.682 ' OE1' HG22 ' A' ' 24' ' ' THR . 31.2 mm-40 -49.39 -67.38 0.27 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.901 0.381 . . . . 0.0 111.641 -179.08 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.604 ' CB ' HD11 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -40.54 -54.38 2.52 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.917 179.147 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.772 HG12 HD22 ' A' ' 27' ' ' LEU . 77.3 t -58.09 -44.83 88.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.806 179.178 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.621 ' HA ' HD13 ' A' ' 27' ' ' LEU . 0.5 OUTLIER -55.31 -33.49 63.34 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.488 178.995 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.537 ' HB1' HD11 ' A' ' 60' ' ' LEU . . . -64.17 -65.2 0.71 Allowed 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 177.837 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . 0.437 ' HA ' HD12 ' A' ' 60' ' ' LEU . 3.7 mm-40 -37.46 -47.64 0.9 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.652 179.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.429 HG21 HD11 ' A' ' 27' ' ' LEU . 68.8 p -67.27 -46.56 73.29 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -179.208 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.996 HG23 HD12 ' A' ' 117' ' ' LEU . 11.9 p -72.23 -28.21 28.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -178.183 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 1.025 HD13 HD21 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -92.97 -21.38 19.81 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 120.201 -0.599 . . . . 0.0 110.525 179.486 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.407 ' CB ' ' O ' ' A' ' 57' ' ' GLN . 44.7 m -79.82 -42.9 23.42 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 178.259 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -61.96 -49.2 77.06 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.873 179.353 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 0.974 HG12 HG11 ' A' ' 66' ' ' VAL . 2.8 m -58.23 -60.64 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.035 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.599 ' H ' HG23 ' A' ' 63' ' ' VAL . . . 40.36 28.66 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.237 -0.438 . . . . 0.0 112.06 179.659 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.604 ' O ' HG22 ' A' ' 66' ' ' VAL . 0.9 OUTLIER 159.19 -80.26 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 120.724 0.297 . . . . 0.0 111.697 -179.679 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.974 HG11 HG12 ' A' ' 63' ' ' VAL . 23.0 m 49.98 -158.85 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.95 -179.142 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.923 HG22 ' HB3' ' A' ' 97' ' ' ASN . 4.5 p -163.92 87.28 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 121.597 0.713 . . . . 0.0 109.777 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.843 HD23 ' HB3' ' A' ' 72' ' ' ASP . 1.1 mp -80.87 112.73 18.52 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.66 -177.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.609 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 2.3 p -89.97 -177.18 5.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.52 179.033 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.449 ' HA ' ' OG1' ' A' ' 73' ' ' THR . 0.0 OUTLIER -34.67 -39.06 0.08 Allowed 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.018 -179.312 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -69.27 -65.35 0.72 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.406 -179.435 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.843 ' HB3' HD23 ' A' ' 68' ' ' LEU . 0.7 OUTLIER -60.57 -30.91 70.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.685 -179.902 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.547 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 1.5 p -61.86 -64.32 0.97 Allowed 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 178.247 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -53.23 -25.84 15.69 Favored 'General case' 0 N--CA 1.456 -0.163 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 1.077 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.1 OUTLIER -58.92 -56.33 23.66 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.187 178.765 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.871 HD13 HD11 ' A' ' 90' ' ' LEU . 1.3 mp -63.47 -47.91 79.85 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 178.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' A' ' 73' ' ' THR . 4.9 mt -58.61 -29.68 66.67 Favored 'General case' 0 N--CA 1.461 0.097 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.355 179.406 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -72.72 -47.66 45.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.533 179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 22.0 p -59.06 -38.76 80.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.697 179.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.432 HG22 ' HA ' ' A' ' 77' ' ' LEU . 15.3 t . . . . . 0 C--N 1.331 -0.23 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.281 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . 0.541 ' OD1' ' HA3' ' A' ' 41' ' ' GLY . 0.4 OUTLIER . . . . . 0 C--O 1.244 0.804 0 CA-C-O 121.703 0.763 . . . . 0.0 110.387 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.579 ' HA ' ' HB3' ' A' ' 102' ' ' SER . 4.7 m-85 -101.96 152.23 21.19 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.457 -179.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.721 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.2 OUTLIER -124.34 143.93 50.3 Favored 'General case' 0 N--CA 1.443 -0.813 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 -179.353 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.871 HD11 HD13 ' A' ' 76' ' ' LEU . 11.8 mt -133.02 151.96 52.01 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -177.232 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.636 ' O ' ' CB ' ' A' ' 98' ' ' SER . 0.0 OUTLIER -134.19 159.43 40.94 Favored 'General case' 0 C--O 1.218 -0.575 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.048 178.291 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.788 ' O ' HG13 ' A' ' 93' ' ' VAL . 0.7 OUTLIER -103.98 160.95 14.39 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.738 0.78 . . . . 0.0 112.56 -178.882 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.788 HG13 ' O ' ' A' ' 92' ' ' SER . 0.0 OUTLIER . . . . . 0 N--CA 1.441 -0.891 0 CA-C-N 113.992 -1.458 . . . . 0.0 108.5 -179.215 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.923 ' HB3' HG22 ' A' ' 67' ' ' VAL . 0.0 OUTLIER . . . . . 0 N--CA 1.451 -0.393 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.636 ' CB ' ' O ' ' A' ' 91' ' ' ARG . 0.1 OUTLIER -141.85 163.95 31.52 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.278 0.561 . . . . 0.0 110.941 -179.811 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.57 HG12 ' HB2' ' A' ' 91' ' ' ARG . 0.4 OUTLIER -104.72 151.65 7.04 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.825 179.782 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.838 HD21 HD11 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -104.13 105.85 16.16 Favored 'General case' 0 CA--C 1.509 -0.602 0 CA-C-O 121.68 0.752 . . . . 0.0 112.439 -179.684 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.721 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 43.6 t -122.15 105.67 16.65 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.978 0 N-CA-C 105.348 -2.093 . . . . 0.0 105.348 175.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 0.745 ' O ' HD23 ' A' ' 103' ' ' LEU . 73.7 m -146.37 153.3 40.34 Favored 'General case' 0 C--N 1.309 -1.157 0 C-N-CA 119.256 -0.978 . . . . 0.0 113.051 -175.427 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 1.025 HD21 HD13 ' A' ' 60' ' ' LEU . 1.2 mm? 144.19 67.21 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 114.612 -1.176 . . . . 0.0 112.643 176.7 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.526 ' CB ' ' HB2' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -101.85 21.31 14.82 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 114.686 -1.143 . . . . 0.0 108.012 177.023 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.581 ' CB ' ' O ' ' A' ' 41' ' ' GLY . 4.3 m 159.02 160.32 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 -179.003 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.436 ' C ' ' O ' ' A' ' 42' ' ' LEU . 0.4 OUTLIER -104.79 102.85 12.39 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 -177.168 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.631 ' NE2' ' HB3' ' A' ' 39' ' ' PHE . 1.0 OUTLIER -168.39 162.66 12.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.289 177.278 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.876 ' SD ' HG11 ' A' ' 59' ' ' VAL . 0.0 OUTLIER -165.38 126.06 1.9 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.27 0.557 . . . . 0.0 112.067 179.95 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . 0.774 HG22 ' CG2' ' A' ' 24' ' ' THR . 4.7 p -103.0 162.73 12.69 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.558 -179.638 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.655 HD13 HG23 ' A' ' 16' ' ' VAL . 1.0 OUTLIER -39.34 -64.85 0.43 Allowed 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.293 -179.576 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . 0.872 ' O ' HG23 ' A' ' 115' ' ' VAL . 1.5 tp60 -43.69 -64.35 0.67 Allowed 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.278 179.653 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -44.19 -41.75 5.98 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 121.232 0.539 . . . . 0.0 110.597 179.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 0.802 ' HB2' ' HE1' ' A' ' 108' ' ' MET . . . -60.07 -65.09 0.74 Allowed 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.494 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.805 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.2 OUTLIER -55.88 -25.56 43.07 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.967 179.611 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 1.077 HG22 ' CG ' ' A' ' 75' ' ' LYS . 72.7 t -65.36 -64.62 0.68 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.739 0 CA-C-O 121.657 0.741 . . . . 0.0 110.728 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.838 HD11 HD21 ' A' ' 100' ' ' LEU . 9.8 mp -63.86 -30.74 71.8 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.448 -179.591 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.996 HD12 HG23 ' A' ' 59' ' ' VAL . 2.1 mp -79.07 -26.4 43.04 Favored 'General case' 0 CA--C 1.511 -0.535 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.256 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.554 ' HB2' ' O ' ' A' ' 114' ' ' LYS . 0.8 OUTLIER -66.38 -48.35 70.43 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 177.278 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.44 ' HB2' ' OD2' ' A' ' 72' ' ' ASP . . . -74.6 -25.35 59.19 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 114.992 -1.004 . . . . 0.0 109.695 177.1 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 1.089 ' HB1' HD21 ' A' ' 5' ' ' LEU . . . -68.73 -60.17 2.59 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.469 179.496 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.822 HD23 ' O ' ' A' ' 117' ' ' LEU . 1.0 OUTLIER -65.51 -33.77 76.71 Favored 'General case' 0 N--CA 1.444 -0.748 0 C-N-CA 120.202 -0.599 . . . . 0.0 109.695 179.638 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.549 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.1 OUTLIER -58.45 -46.47 86.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.828 179.494 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.619 ' HB2' HG12 ' A' ' 67' ' ' VAL . 2.4 tt0 -94.53 -29.82 14.71 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 113.769 1.025 . . . . 0.0 113.769 -177.769 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . 0.425 ' HB2' HD13 ' A' ' 5' ' ' LEU . 0.8 OUTLIER -96.42 -68.38 0.8 Allowed 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -177.399 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 6.0 p . . . . . 0 C--N 1.329 -0.325 0 N-CA-C 113.005 0.742 . . . . 0.0 113.005 -177.503 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . 0.547 ' HB2' HD21 ' A' ' 27' ' ' LEU . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.869 0.366 . . . . 0.0 110.899 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . 0.989 HD11 ' HB2' ' A' ' 8' ' ' LEU . 4.1 pp -68.89 -172.84 0.42 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.447 179.691 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . 0.488 ' O ' HD12 ' A' ' 3' ' ' LEU . 0.1 OUTLIER -63.97 130.72 45.21 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.135 0.493 . . . . 0.0 112.03 -179.035 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 1.049 HD21 ' HB1' ' A' ' 120' ' ' ALA . 0.1 OUTLIER -51.08 -65.74 0.5 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.025 -179.939 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -48.96 -30.12 5.6 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.59 0.234 . . . . 0.0 111.418 -179.244 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . 0.536 ' O ' ' HB3' ' A' ' 11' ' ' GLN . 0.9 OUTLIER -73.39 -44.83 57.66 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.046 0.45 . . . . 0.0 109.973 179.385 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.989 ' HB2' HD11 ' A' ' 3' ' ' LEU . 1.5 tp -73.8 -30.57 62.8 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.964 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' HIS . . . . . 0.771 ' CG ' HD22 ' A' ' 121' ' ' LEU . 21.4 t60 -68.25 -54.3 18.59 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 121.677 0.751 . . . . 0.0 109.214 179.656 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.521 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 0.6 OUTLIER -63.57 -36.89 85.29 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 114.584 -1.189 . . . . 0.0 108.988 179.164 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.992 ' HG2' HG13 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -60.49 -65.47 0.68 Allowed 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.917 178.477 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' VAL . . . . . 0.978 HG12 ' O ' ' A' ' 8' ' ' LEU . 5.7 p -56.69 -51.99 59.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.809 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.515 ' O ' ' HB2' ' A' ' 17' ' ' GLN . 2.5 p -63.49 -27.3 69.18 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.224 -179.388 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.521 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -76.81 -41.03 45.94 Favored 'General case' 0 CA--C 1.514 -0.405 0 C-N-CA 120.281 -0.568 . . . . 0.0 111.344 -179.02 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.718 HD12 ' HA ' ' A' ' 12' ' ' VAL . 0.1 OUTLIER -68.67 -53.2 23.74 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 119.707 -0.797 . . . . 0.0 110.043 179.627 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . 0.725 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 10.4 p -65.47 -47.84 85.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.75 -178.483 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . 0.522 ' N ' HG13 ' A' ' 16' ' ' VAL . 1.0 OUTLIER -61.76 -18.65 60.64 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.169 -0.612 . . . . 0.0 110.964 -179.783 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.415 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 1.5 pt20 -158.84 61.65 0.42 Allowed 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 120.73 -0.388 . . . . 0.0 111.869 179.557 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.476 ' N ' ' O ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER 169.87 -44.59 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.331 179.339 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.773 ' CB ' HD13 ' A' ' 110' ' ' LEU . 14.7 m -105.69 -28.41 10.72 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.387 -179.39 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLY . . . . . 0.405 ' O ' HG22 ' A' ' 16' ' ' VAL . . . 79.41 -59.7 4.35 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.245 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -173.55 21.77 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 120.617 0.246 . . . . 0.0 111.227 179.712 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -61.09 -156.81 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.736 -179.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.74 HG21 ' CD2' ' A' ' 39' ' ' PHE . 0.3 OUTLIER -103.56 149.78 24.56 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 179.854 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -105.0 128.54 9.48 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.448 -0.882 . . . . 0.0 113.224 -179.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.885 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -104.6 129.19 52.73 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 178.884 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.638 HD12 ' CD2' ' A' ' 55' ' ' PHE . 0.3 OUTLIER -104.14 165.63 10.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.545 -179.024 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.564 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER 144.97 50.16 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.488 1.115 . . . . 0.0 109.949 179.891 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.583 ' C ' HD23 ' A' ' 3' ' ' LEU . . . 93.7 -9.61 73.38 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 120.912 -0.661 . . . . 0.0 111.67 -179.1 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.466 ' C ' ' ND2' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -165.58 156.17 13.44 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 179.713 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.992 HG13 ' HG2' ' A' ' 11' ' ' GLN . 0.6 OUTLIER -109.5 132.18 58.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 C-N-CA 119.785 -0.766 . . . . 0.0 111.237 179.727 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.885 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -117.41 166.96 11.71 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.869 -1.059 . . . . 0.0 110.859 -179.406 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.633 ' HB2' ' OG ' ' A' ' 20' ' ' SER . . . -103.28 119.49 38.97 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.16 0.505 . . . . 0.0 111.3 -179.393 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.636 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 8.3 t30 -100.0 137.02 39.03 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.73 -179.728 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.7 ttmp? -121.9 9.9 10.1 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.51 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.63 -61.02 2.58 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 120.963 0.411 . . . . 0.0 110.428 179.709 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.543 HG23 ' CE1' ' A' ' 39' ' ' PHE . 0.1 OUTLIER -137.04 -78.94 0.39 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.264 179.339 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.774 ' O ' HG22 ' A' ' 109' ' ' THR . 9.3 t 176.03 -41.95 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.059 0.457 . . . . 0.0 111.352 179.727 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.74 ' CD2' HG21 ' A' ' 24' ' ' THR . 9.0 m-85 59.52 135.68 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.798 0.809 . . . . 0.0 111.498 -178.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLN . . . . . 0.645 ' H ' ' NE2' ' A' ' 107' ' ' GLN . 0.3 OUTLIER -169.41 76.61 0.1 Allowed 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.586 -1.188 . . . . 0.0 108.835 179.645 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . 0.468 ' C ' ' HB2' ' A' ' 105' ' ' SER . . . 69.37 106.04 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.615 0 CA-C-N 115.353 -0.839 . . . . 0.0 112.696 -178.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.688 ' HB2' ' NE2' ' A' ' 107' ' ' GLN . 5.3 tp -159.01 -141.77 0.09 Allowed 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 178.798 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -162.72 25.62 0.1 Allowed 'General case' 0 C--N 1.33 -0.241 0 O-C-N 122.204 -0.31 . . . . 0.0 111.693 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.887 HG23 ' O ' ' A' ' 48' ' ' ALA . 29.4 mt 63.36 5.04 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 179.576 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -87.18 -55.55 3.76 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.801 0.334 . . . . 0.0 111.474 -179.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.74 -28.34 61.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.152 -179.627 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.14 80.19 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.196 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.887 ' O ' HG23 ' A' ' 44' ' ' ILE . . . -151.52 132.5 14.26 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.714 0.292 . . . . 0.0 111.21 -179.634 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.2 mtt-85 -68.14 -177.18 0.81 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.745 0.307 . . . . 0.0 110.398 179.232 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.886 ' O ' HG23 ' A' ' 54' ' ' VAL . 0.9 OUTLIER -87.8 -35.92 17.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.001 0.429 . . . . 0.0 110.766 179.821 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' SER . . . . . 0.607 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 18.2 p -56.05 -62.78 1.47 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.171 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.865 ' OE1' ' HB1' ' A' ' 48' ' ' ALA . 0.0 OUTLIER -34.72 -67.08 0.15 Allowed 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.882 -179.811 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.641 ' HD2' HD11 ' A' ' 44' ' ' ILE . 2.7 ptpt -56.87 -46.75 81.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.418 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.886 HG23 ' O ' ' A' ' 50' ' ' GLU . 97.8 t -54.7 -41.32 55.39 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-O 121.046 0.45 . . . . 0.0 110.038 179.439 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.851 ' CZ ' ' HB1' ' A' ' 113' ' ' ALA . 1.9 t80 -61.63 -49.75 75.34 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.872 178.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.525 ' HB2' ' HB2' ' A' ' 108' ' ' MET . . . -50.44 -48.06 56.49 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.108 179.805 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -62.25 -47.02 86.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.639 179.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . 0.564 HG21 HD22 ' A' ' 27' ' ' LEU . 24.0 p -63.7 -49.5 72.87 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.378 -179.696 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . 0.96 ' O ' HG23 ' A' ' 63' ' ' VAL . 14.0 p -65.67 -48.89 80.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.786 179.76 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.684 HD22 ' HG ' ' A' ' 103' ' ' LEU . 13.1 tp -50.25 -49.9 51.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.725 0.298 . . . . 0.0 110.774 179.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.6 m -63.93 -41.81 97.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.736 179.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' HIS . . . . . 0.587 ' HB3' HD22 ' A' ' 5' ' ' LEU . 0.1 OUTLIER -68.21 -20.86 64.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.961 179.756 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' VAL . . . . . 1.041 HG13 HG11 ' A' ' 66' ' ' VAL . 4.6 t -105.01 37.81 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.061 0.458 . . . . 0.0 111.121 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.484 ' O ' ' HB2' ' A' ' 65' ' ' ASN . . . -65.64 91.23 0.13 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.677 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.769 ' O ' HG22 ' A' ' 99' ' ' VAL . 10.0 m120 93.28 -61.11 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.679 -0.691 . . . . 0.0 112.22 179.514 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 1.041 HG11 HG13 ' A' ' 63' ' ' VAL . 33.7 m 39.03 -140.08 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -179.387 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' VAL . . . . . 0.851 HG22 ' CB ' ' A' ' 97' ' ' ASN . 4.6 p -175.62 67.42 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 CA-C-O 121.71 0.767 . . . . 0.0 111.215 179.63 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.791 HD23 ' HB3' ' A' ' 72' ' ' ASP . 2.4 mp -62.66 103.69 0.45 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.86 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.872 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 0.6 OUTLIER -78.42 -177.88 5.48 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.642 179.278 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -37.34 -37.42 0.19 Allowed 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.3 -179.257 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.526 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 2.5 tt0 -66.12 -65.43 0.68 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.987 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.791 ' HB3' HD23 ' A' ' 68' ' ' LEU . 82.3 m-20 -60.3 -28.09 67.83 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.087 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 36.5 m -64.0 -64.06 0.99 Allowed 'General case' 0 C--O 1.239 0.516 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 178.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.499 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . . . -56.68 -25.11 53.13 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 108.787 -0.819 . . . . 0.0 108.787 177.407 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 1.083 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.3 OUTLIER -59.35 -54.63 44.55 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 114.733 -1.121 . . . . 0.0 110.224 178.743 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.934 HD21 HD11 ' A' ' 116' ' ' LEU . 1.9 mt -64.49 -48.04 76.71 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.838 0.352 . . . . 0.0 110.181 179.272 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.641 HD12 ' C ' ' A' ' 77' ' ' LEU . 0.4 OUTLIER -63.83 -23.62 67.43 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.034 -179.765 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -78.37 -47.83 16.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.833 0.349 . . . . 0.0 110.883 179.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -64.6 -33.75 76.65 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.184 179.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' THR . . . . . 0.432 ' CG2' ' CD2' ' A' ' 88' ' ' TYR . 11.4 p . . . . . 0 C--N 1.327 -0.39 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.943 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . 0.518 ' HA ' ' HB2' ' A' ' 104' ' ' ARG . 7.0 p30 . . . . . 0 C--O 1.243 0.738 0 CA-C-O 120.871 0.367 . . . . 0.0 111.968 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' TYR . . . . . 0.533 ' HA ' ' CB ' ' A' ' 102' ' ' SER . 1.3 m-85 -99.79 135.62 40.94 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 120.435 -0.506 . . . . 0.0 110.447 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.763 ' CG ' HG13 ' A' ' 101' ' ' VAL . 0.7 OUTLIER -107.47 142.44 37.33 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 -179.93 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.592 HD21 HD13 ' A' ' 76' ' ' LEU . 11.1 mt -132.23 147.24 52.4 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 113.337 0.865 . . . . 0.0 113.337 -176.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.47 127.81 34.09 Favored 'General case' 0 C--O 1.224 -0.261 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 177.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . 0.715 ' O ' HG13 ' A' ' 93' ' ' VAL . 0.7 OUTLIER -104.39 145.95 29.53 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 113.955 1.094 . . . . 0.0 113.955 -177.428 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' VAL . . . . . 0.715 HG13 ' O ' ' A' ' 92' ' ' SER . 4.9 m . . . . . 0 CA--C 1.542 0.644 0 CA-C-N 113.691 -1.595 . . . . 0.0 108.558 179.09 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.872 ' HA ' ' HA ' ' A' ' 69' ' ' THR . 0.1 OUTLIER . . . . . 0 N--CA 1.448 -0.552 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' SER . . . . . 0.531 ' O ' ' N ' ' A' ' 68' ' ' LEU . 3.1 t -140.19 163.02 33.85 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.482 0.658 . . . . 0.0 111.32 -179.517 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' VAL . . . . . 0.769 HG22 ' O ' ' A' ' 65' ' ' ASN . 1.2 t -107.45 146.23 13.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-N 115.04 -0.982 . . . . 0.0 108.74 178.912 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.567 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.1 OUTLIER -103.87 114.36 28.56 Favored 'General case' 0 CA--C 1.513 -0.454 0 C-N-CA 119.766 -0.774 . . . . 0.0 112.136 -179.662 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' VAL . . . . . 0.763 HG13 ' CG ' ' A' ' 89' ' ' ASP . 0.9 OUTLIER -120.36 104.19 15.1 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.015 0 N-CA-C 104.288 -2.486 . . . . 0.0 104.288 175.453 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' SER . . . . . 0.628 ' O ' HD23 ' A' ' 103' ' ' LEU . 0.9 OUTLIER -141.39 152.51 44.39 Favored 'General case' 0 C--N 1.307 -1.263 0 C-N-CA 119.807 -0.757 . . . . 0.0 112.713 -174.907 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' LEU . . . . . 0.684 ' HG ' HD22 ' A' ' 60' ' ' LEU . 0.4 OUTLIER 147.7 59.66 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 114.506 -1.224 . . . . 0.0 112.441 176.529 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' ARG . . . . . 0.518 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -83.86 -6.38 59.41 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.308 -0.86 . . . . 0.0 108.739 177.434 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.643 ' HB3' ' N ' ' A' ' 42' ' ' LEU . 58.7 m -177.92 171.92 1.72 Allowed 'General case' 0 C--O 1.232 0.147 0 CA-C-N 114.553 -1.203 . . . . 0.0 108.105 179.258 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ASP . . . . . 0.555 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -104.74 101.88 11.48 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 119.693 -0.803 . . . . 0.0 112.754 -178.492 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' GLN . . . . . 0.688 ' NE2' ' HB2' ' A' ' 42' ' ' LEU . 0.7 OUTLIER -169.76 162.99 9.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.273 177.534 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' MET . . . . . 0.603 ' HE2' ' HB3' ' A' ' 112' ' ' ASP . 0.3 OUTLIER -165.77 144.15 5.94 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.426 -0.51 . . . . 0.0 112.142 179.005 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' THR . . . . . 0.774 HG22 ' O ' ' A' ' 38' ' ' THR . 30.2 p -110.11 165.29 11.86 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.719 179.362 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' LEU . . . . . 0.791 HD23 HG23 ' A' ' 12' ' ' VAL . 6.5 mt -52.46 -59.18 4.74 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.584 179.615 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' GLN . . . . . 0.835 ' O ' HG23 ' A' ' 115' ' ' VAL . 13.6 tp60 -47.67 -65.48 0.56 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.817 0.342 . . . . 0.0 110.634 179.577 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' ASP . . . . . 0.92 ' O ' HD22 ' A' ' 116' ' ' LEU . 16.5 m-20 -46.63 -45.98 19.49 Favored 'General case' 0 C--O 1.236 0.395 0 CA-C-O 121.477 0.656 . . . . 0.0 110.429 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' ALA . . . . . 0.851 ' HB1' ' CZ ' ' A' ' 55' ' ' PHE . . . -51.65 -63.32 1.17 Allowed 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.35 179.256 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . 0.572 ' HE3' ' CG1' ' A' ' 16' ' ' VAL . 0.0 OUTLIER -62.04 -20.05 63.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.281 179.902 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 1.083 HG22 ' CG ' ' A' ' 75' ' ' LYS . 74.2 t -65.06 -65.11 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.886 0 CA-C-O 122.013 0.911 . . . . 0.0 109.967 179.399 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' LEU . . . . . 0.955 ' HB3' HG21 ' A' ' 63' ' ' VAL . 0.1 OUTLIER -61.62 -35.58 78.29 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.399 179.693 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' LEU . . . . . 0.916 HD21 HD23 ' A' ' 8' ' ' LEU . 0.3 OUTLIER -70.51 -24.24 62.8 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.9 179.36 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' GLU . . . . . 0.524 ' HA ' ' CE1' ' A' ' 9' ' ' HIS . 1.7 tt0 -69.35 -46.85 66.02 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 106.741 -1.578 . . . . 0.0 106.741 177.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' ALA . . . . . 0.495 ' CB ' ' HG ' ' A' ' 68' ' ' LEU . . . -77.52 -22.18 51.57 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 114.695 -1.139 . . . . 0.0 110.236 177.651 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' ALA . . . . . 1.049 ' HB1' HD21 ' A' ' 5' ' ' LEU . . . -75.06 -56.71 4.46 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.78 179.471 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' LEU . . . . . 0.771 HD22 ' CG ' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -60.8 -37.43 81.93 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 178.208 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' ARG . . . . . 0.5 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.5 OUTLIER -60.99 -46.37 91.04 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.356 179.97 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.615 ' CG ' HG12 ' A' ' 67' ' ' VAL . 8.4 mm-40 -95.29 -19.5 19.93 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -177.762 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' GLU . . . . . 0.445 ' CG ' ' O ' ' A' ' 120' ' ' ALA . 2.9 mm-40 -95.32 -66.62 0.9 Allowed 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.867 0.691 . . . . 0.0 112.867 -178.393 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 1.2 p . . . . . 0 C--N 1.326 -0.425 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -178.172 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.5 mtm . . . . . 0 N--CA 1.486 1.37 0 CA-C-O 120.853 0.359 . . . . 0.0 111.182 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.572 ' ND2' HD21 ' A' ' 8' ' ' LEU . 7.1 p-10 -161.36 -163.71 1.04 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.918 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.798 HD11 ' N ' ' A' ' 30' ' ' ASN . 5.1 mp -73.1 172.89 10.21 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.909 0.385 . . . . 0.0 110.497 179.593 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 3.4 p -88.62 135.68 33.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.077 179.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.532 HD21 ' HB3' ' A' ' 62' ' ' HIS . 2.9 mt -37.4 -62.02 0.55 Allowed 'General case' 0 CA--C 1.504 -0.792 0 CA-C-O 121.434 0.635 . . . . 0.0 111.712 -179.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.411 ' HB3' ' HG2' ' A' ' 128' ' ' ARG . 0.2 OUTLIER -40.44 -65.01 0.45 Allowed 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 114.553 -1.203 . . . . 0.0 111.378 -179.192 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . 0.543 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 0.7 OUTLIER -61.63 -44.57 96.74 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.982 0.42 . . . . 0.0 109.95 178.873 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.867 ' HB3' HD22 ' A' ' 117' ' ' LEU . 0.0 OUTLIER -45.41 -65.0 0.6 Allowed 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 116.026 -0.534 . . . . 0.0 109.791 178.87 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.66 ' CB ' HD22 ' A' ' 121' ' ' LEU . 61.1 t60 -52.77 -39.87 62.64 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-N 115.415 -0.811 . . . . 0.0 109.603 178.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.543 ' HB2' ' O ' ' A' ' 7' ' ' ASP . 8.3 mmt180 -56.94 -62.48 1.71 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.846 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.757 ' HG3' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -64.75 -53.26 49.93 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 120.299 -0.561 . . . . 0.0 111.168 179.894 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.924 ' O ' HG23 ' A' ' 16' ' ' VAL . 8.1 p -53.96 -51.07 49.12 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 C-N-CA 120.63 -0.428 . . . . 0.0 111.343 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.584 ' HA ' ' CE ' ' A' ' 114' ' ' LYS . 21.6 t -63.68 -31.19 72.28 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 112.343 0.497 . . . . 0.0 112.343 -179.552 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 20.0 tpp180 -70.99 -35.3 72.05 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 120.236 -0.585 . . . . 0.0 110.966 -178.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.776 HD12 ' HA ' ' A' ' 12' ' ' VAL . 0.1 OUTLIER -75.35 -52.66 10.28 Favored 'General case' 0 C--N 1.326 -0.438 0 C-N-CA 119.974 -0.691 . . . . 0.0 110.593 179.841 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.924 HG23 ' O ' ' A' ' 12' ' ' VAL . 1.8 t -60.81 -55.14 26.6 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.96 -179.367 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -61.02 -17.83 54.37 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 -178.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 15.9 pt20 -170.39 71.44 0.06 Allowed 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.527 -0.469 . . . . 0.0 111.977 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.479 ' HB2' ' HA ' ' A' ' 15' ' ' LEU . 0.3 OUTLIER 170.3 -38.18 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.117 179.382 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.414 ' N ' ' O ' ' A' ' 15' ' ' LEU . 70.1 m -115.33 -24.03 8.62 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.54 -179.362 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 56.66 55.34 30.45 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.457 -0.877 . . . . 0.0 111.945 -179.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.417 ' HA ' ' CG1' ' A' ' 16' ' ' VAL . 0.3 OUTLIER 59.97 82.9 0.14 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.136 0.493 . . . . 0.0 110.768 -179.544 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.421 ' O ' ' HB ' ' A' ' 109' ' ' THR . 0.1 OUTLIER -133.97 -151.9 0.46 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.703 179.851 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.671 ' HB ' ' HB3' ' A' ' 34' ' ' ASN . 0.2 OUTLIER -103.9 134.37 47.31 Favored 'General case' 0 CA--C 1.52 -0.184 0 C-N-CA 120.265 -0.574 . . . . 0.0 110.179 179.609 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.406 ' CA ' ' HG ' ' A' ' 110' ' ' LEU . . . -104.5 141.01 15.19 Favored Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.399 -0.905 . . . . 0.0 112.619 -179.11 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.852 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -104.5 130.27 52.44 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 179.877 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.565 HD13 ' CD1' ' A' ' 55' ' ' PHE . 0.7 OUTLIER -111.12 153.17 26.09 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.296 0.57 . . . . 0.0 112.293 -178.468 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.403 ' HD2' ' NZ ' ' A' ' 26' ' ' LYS . 2.7 mtm180 161.2 61.35 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.188 179.559 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.769 ' C ' HD11 ' A' ' 3' ' ' LEU . . . 79.74 -0.34 82.31 Favored Glycine 0 N--CA 1.45 -0.379 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 -177.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.798 ' N ' HD11 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -165.93 165.84 17.87 Favored 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 108.936 -0.764 . . . . 0.0 108.936 -179.682 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.757 HG12 ' HG3' ' A' ' 11' ' ' GLN . 9.1 p -111.9 137.91 42.72 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.24 0.543 . . . . 0.0 111.074 178.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.852 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -125.39 165.72 17.89 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.783 179.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -103.93 127.89 51.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.295 0.569 . . . . 0.0 111.717 -179.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.671 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 50.3 t30 -116.3 115.93 26.81 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 115.265 -0.879 . . . . 0.0 110.628 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.68 -28.6 3.84 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.279 -179.779 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -48.6 -72.6 0.05 OUTLIER 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.207 -179.68 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.541 ' C ' HG22 ' A' ' 38' ' ' THR . 57.9 p -86.95 -103.43 0.07 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.423 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.585 ' O ' HG21 ' A' ' 24' ' ' THR . 0.2 OUTLIER 164.66 -111.69 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.997 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.626 ' HB3' HG21 ' A' ' 24' ' ' THR . 0.1 OUTLIER 172.54 -164.61 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 179.98 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.581 ' N ' ' CG ' ' A' ' 39' ' ' PHE . 0.2 OUTLIER 160.34 37.6 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.078 0.551 . . . . 0.0 110.494 179.501 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.556 ' C ' ' HB2' ' A' ' 107' ' ' GLN . . . 77.72 -26.24 2.03 Favored Glycine 0 CA--C 1.526 0.727 0 CA-C-N 115.755 -0.657 . . . . 0.0 113.091 -179.159 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.509 HD13 ' HG3' ' A' ' 40' ' ' GLN . 1.8 mp -32.62 135.03 0.09 Allowed 'General case' 0 N--CA 1.467 0.385 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.61 HG23 ' HB2' ' A' ' 106' ' ' ASP . 3.4 m -95.39 36.08 1.27 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.422 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.597 HG22 ' O ' ' A' ' 44' ' ' ILE . 5.1 mp 66.02 0.0 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-N 116.118 -0.492 . . . . 0.0 112.079 179.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -74.92 -25.56 59.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.927 0.394 . . . . 0.0 110.761 179.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.5 t -101.33 -66.01 0.94 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.144 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -170.59 52.25 0.19 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.68 -0.771 . . . . 0.0 112.602 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.525 ' HB1' ' OE1' ' A' ' 107' ' ' GLN . . . -113.34 -178.73 3.45 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.015 0.436 . . . . 0.0 111.11 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.72 126.28 51.97 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.791 -0.64 . . . . 0.0 109.786 179.268 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.809 ' O ' HG23 ' A' ' 54' ' ' VAL . 0.1 OUTLIER -46.97 -28.36 1.6 Allowed 'General case' 0 C--O 1.233 0.206 0 CA-C-O 120.98 0.419 . . . . 0.0 110.468 179.848 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.536 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 82.7 p -59.22 -62.49 1.84 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.935 179.502 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.51 ' CB ' ' HG2' ' A' ' 107' ' ' GLN . 0.4 OUTLIER -42.65 -57.6 2.65 Favored 'General case' 0 C--O 1.231 0.082 0 CA-C-O 121.188 0.518 . . . . 0.0 110.435 179.639 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.433 ' HB3' HD11 ' A' ' 44' ' ' ILE . 0.1 OUTLIER -46.85 -61.9 1.64 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.88 179.151 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.809 HG23 ' O ' ' A' ' 50' ' ' GLU . 30.9 t -50.07 -46.86 24.35 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.812 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.736 ' O ' HG13 ' A' ' 59' ' ' VAL . 0.4 OUTLIER -58.95 -33.42 70.59 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.329 179.263 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.497 ' HA ' HG22 ' A' ' 59' ' ' VAL . . . -67.76 -43.91 78.71 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.847 179.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 33.1 mm-40 -67.42 -33.87 76.06 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.057 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.423 ' CG2' ' HB3' ' A' ' 2' ' ' ASN . 11.8 p -77.46 -41.29 40.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.061 -179.507 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.894 ' O ' HG22 ' A' ' 63' ' ' VAL . 21.0 m -73.49 -31.28 32.42 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.844 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.538 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.659 HD13 ' O ' ' A' ' 102' ' ' SER . 10.1 tp -77.84 -37.89 47.42 Favored 'General case' 0 N--CA 1.456 -0.134 0 CA-C-O 120.906 0.384 . . . . 0.0 110.101 178.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 6.3 t -67.73 -53.06 30.52 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.793 179.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . 0.532 ' HB3' HD21 ' A' ' 5' ' ' LEU . 2.0 m-70 -47.82 -50.17 26.88 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-O 120.791 0.329 . . . . 0.0 110.199 179.471 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 1.036 HG12 HG11 ' A' ' 66' ' ' VAL . 0.9 OUTLIER -68.38 -74.48 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.225 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.35 179.48 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.712 ' H ' HG23 ' A' ' 63' ' ' VAL . . . 60.91 13.95 4.88 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.506 -179.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.457 ' CB ' ' O ' ' A' ' 64' ' ' ALA . 0.3 OUTLIER 159.72 -66.47 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.656 0 CA-C-O 120.849 0.357 . . . . 0.0 111.644 -179.663 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 1.036 HG11 HG12 ' A' ' 63' ' ' VAL . 14.8 m 48.11 -127.66 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 CA-C-N 115.79 -0.641 . . . . 0.0 112.248 -179.199 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.522 ' O ' ' O ' ' A' ' 98' ' ' SER . 5.9 p -174.54 -18.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 N-CA-C 113.107 0.781 . . . . 0.0 113.107 -179.303 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.822 HD23 ' HB3' ' A' ' 72' ' ' ASP . 3.5 mp 32.81 105.05 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 178.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 18.9 p -66.12 -153.42 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 177.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -68.64 -34.54 75.9 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.122 0.487 . . . . 0.0 110.114 179.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.44 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 0.8 OUTLIER -64.04 -65.77 0.63 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.362 -179.631 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.822 ' HB3' HD23 ' A' ' 68' ' ' LEU . 1.0 OUTLIER -50.92 -32.26 20.14 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-O 120.755 0.312 . . . . 0.0 110.936 -179.929 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 85.1 m -62.61 -63.51 1.2 Allowed 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.4 -24.43 59.99 Favored 'General case' 0 C--N 1.333 -0.116 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 177.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 1.087 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.2 OUTLIER -57.13 -65.42 0.62 Allowed 'General case' 0 C--O 1.236 0.36 0 CA-C-N 114.903 -1.044 . . . . 0.0 110.514 179.074 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.845 HD21 HD11 ' A' ' 116' ' ' LEU . 0.5 OUTLIER -60.48 -42.22 95.82 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 178.913 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -54.15 -36.45 63.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.801 179.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -75.66 -60.45 2.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.321 -179.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -59.58 -32.05 70.02 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.206 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 54.5 m -79.51 -59.59 2.69 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.346 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.474 HG12 ' O ' ' A' ' 81' ' ' VAL . 20.7 t -72.53 -6.92 8.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.772 -179.636 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -48.66 -74.49 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.165 0 CA-C-O 120.775 0.321 . . . . 0.0 111.376 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 76.1 t60 -93.29 -80.04 0.39 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.022 -179.822 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.749 ' HB3' HD22 ' A' ' 85' ' ' LEU . 1.1 t-20 -178.36 -161.11 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.908 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.749 HD22 ' HB3' ' A' ' 84' ' ' ASN . 2.7 mm? 61.91 87.4 0.1 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-O 120.845 0.355 . . . . 0.0 110.685 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 13.0 p-10 -63.18 113.16 2.99 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.308 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . 0.405 ' HA ' ' HB2' ' A' ' 104' ' ' ARG . 0.0 OUTLIER -122.43 -32.79 3.56 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.774 179.795 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.522 ' CZ ' ' CG ' ' A' ' 112' ' ' ASP . 2.5 m-85 -96.59 141.8 29.42 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-O 121.038 0.447 . . . . 0.0 110.757 179.304 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.732 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.5 OUTLIER -117.06 140.29 49.67 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 179.732 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.841 HD23 ' HA ' ' A' ' 100' ' ' LEU . 34.0 mt -143.31 154.55 43.89 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 113.417 0.895 . . . . 0.0 113.417 -177.018 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.421 ' CG ' HG12 ' A' ' 99' ' ' VAL . 0.0 OUTLIER -143.77 131.9 21.82 Favored 'General case' 0 C--O 1.223 -0.334 0 N-CA-C 107.455 -1.313 . . . . 0.0 107.455 177.176 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.665 ' O ' HG13 ' A' ' 93' ' ' VAL . 54.2 p -103.96 146.01 29.31 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 -176.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.665 HG13 ' O ' ' A' ' 92' ' ' SER . 10.4 m -164.8 -126.01 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 CA-C-N 113.616 -1.629 . . . . 0.0 108.683 179.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.504 ' O ' ' N ' ' A' ' 96' ' ' GLY . . . 36.95 30.73 0.04 OUTLIER Glycine 0 C--N 1.336 0.554 0 C-N-CA 121.155 -0.545 . . . . 0.0 114.088 178.447 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.415 ' CG ' ' N ' ' A' ' 96' ' ' GLY . 0.0 OUTLIER 66.22 -56.42 0.38 Allowed 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 -178.658 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.504 ' N ' ' O ' ' A' ' 94' ' ' GLY . . . -136.61 21.82 3.38 Favored Glycine 0 N--CA 1.444 -0.829 0 N-CA-C 110.379 -1.088 . . . . 0.0 110.379 177.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.448 ' CB ' HG22 ' A' ' 67' ' ' VAL . 0.0 OUTLIER -123.27 166.18 15.7 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-O 120.697 0.284 . . . . 0.0 110.385 -179.68 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.522 ' O ' ' O ' ' A' ' 67' ' ' VAL . 4.1 t -140.49 162.88 34.3 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.371 0.605 . . . . 0.0 110.834 -179.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.421 HG12 ' CG ' ' A' ' 91' ' ' ARG . 1.2 t -103.18 136.8 34.13 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.957 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 178.658 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.841 ' HA ' HD23 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -104.3 110.37 22.58 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-O 121.911 0.863 . . . . 0.0 113.032 -177.695 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.732 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -118.69 103.61 14.81 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.997 0 N-CA-C 103.878 -2.638 . . . . 0.0 103.878 175.023 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.659 ' O ' HD13 ' A' ' 60' ' ' LEU . 0.3 OUTLIER -139.75 154.59 47.46 Favored 'General case' 0 C--N 1.309 -1.192 0 C-N-CA 119.015 -1.074 . . . . 0.0 113.732 -174.756 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.548 HD23 ' O ' ' A' ' 102' ' ' SER . 0.0 OUTLIER 166.81 -91.38 0.0 OUTLIER 'General case' 0 N--CA 1.438 -1.063 0 CA-C-N 113.662 -1.608 . . . . 0.0 111.515 176.796 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.574 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 48.6 59.18 4.53 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 -179.532 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.574 ' CB ' ' O ' ' A' ' 104' ' ' ARG . 4.9 t 102.53 157.82 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 -176.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.61 ' HB2' HG23 ' A' ' 43' ' ' THR . 0.6 OUTLIER -104.95 100.87 10.47 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 119.211 -0.996 . . . . 0.0 112.799 -178.685 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.556 ' HB2' ' C ' ' A' ' 41' ' ' GLY . 1.5 tt0 -168.03 122.92 0.97 Allowed 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.838 -1.074 . . . . 0.0 109.874 177.325 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.491 ' HG2' HG21 ' A' ' 59' ' ' VAL . 0.0 OUTLIER -122.8 164.46 18.33 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.172 0.51 . . . . 0.0 111.531 179.967 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.524 HG22 HG23 ' A' ' 24' ' ' THR . 1.5 p -121.79 165.4 15.91 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.771 -179.63 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.815 ' HB3' HG22 ' A' ' 16' ' ' VAL . 5.5 mt -51.86 -49.87 62.06 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.778 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.902 ' O ' HG23 ' A' ' 115' ' ' VAL . 1.5 tp60 -59.82 -64.05 1.09 Allowed 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.119 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.722 ' O ' HD22 ' A' ' 116' ' ' LEU . 24.8 m-20 -48.02 -44.87 31.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.901 179.434 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.548 ' HB1' ' CZ ' ' A' ' 55' ' ' PHE . . . -56.4 -54.2 48.42 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.08 179.227 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.584 ' CE ' ' HA ' ' A' ' 13' ' ' SER . 0.3 OUTLIER -62.5 -34.68 77.34 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.505 179.413 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 1.087 HG22 ' CG ' ' A' ' 75' ' ' LYS . 84.4 t -55.84 -65.48 0.37 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.827 0 CA-C-O 121.931 0.872 . . . . 0.0 111.299 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.845 HD11 HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -59.93 -37.75 80.4 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 114.741 -1.118 . . . . 0.0 110.311 -179.106 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.867 HD22 ' HB3' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -73.66 -21.36 60.3 Favored 'General case' 0 CA--C 1.514 -0.442 0 C-N-CA 120.505 -0.478 . . . . 0.0 111.621 -179.994 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.486 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 0.1 OUTLIER -69.17 -47.4 65.04 Favored 'General case' 0 CA--C 1.503 -0.83 0 N-CA-C 106.442 -1.688 . . . . 0.0 106.442 177.479 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.436 ' CB ' ' HG ' ' A' ' 68' ' ' LEU . . . -76.12 -25.31 55.26 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-N 114.747 -1.115 . . . . 0.0 109.909 177.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.827 ' HB3' ' HA ' ' A' ' 117' ' ' LEU . . . -69.8 -60.64 2.18 Favored 'General case' 0 CA--C 1.508 -0.666 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.979 179.395 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.727 HD12 ' HA2' ' A' ' 126' ' ' GLY . 0.2 OUTLIER -62.4 -39.39 93.09 Favored 'General case' 0 N--CA 1.444 -0.768 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 179.193 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.58 ' N ' ' HG ' ' A' ' 121' ' ' LEU . 0.1 OUTLIER -52.37 -58.18 7.49 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.186 179.481 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 92.3 mm-40 -81.74 -26.37 34.59 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 112.858 0.688 . . . . 0.0 112.858 -178.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . 0.42 ' CG ' ' O ' ' A' ' 120' ' ' ALA . 3.6 mm-40 -96.06 -66.65 0.89 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 113.847 1.054 . . . . 0.0 113.847 -178.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -95.72 -65.86 0.95 Allowed 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -177.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . 0.727 ' HA2' HD12 ' A' ' 121' ' ' LEU . . . 64.72 82.42 0.1 Allowed Glycine 0 N--CA 1.448 -0.526 0 N-CA-C 110.825 -0.91 . . . . 0.0 110.825 -178.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.432 ' HB3' ' O ' ' A' ' 126' ' ' GLY . . . 68.38 38.9 2.34 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -178.001 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . 0.411 ' HG2' ' HB3' ' A' ' 6' ' ' SER . 0.0 OUTLIER 72.08 105.82 0.07 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 114.887 -1.051 . . . . 0.0 110.817 -179.223 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . -145.87 -39.2 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.332 0 CA-C-N 115.733 -0.667 . . . . 0.0 112.453 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 10.8 t . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.246 -0.883 . . . . 0.0 110.892 -179.942 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.071 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 65.6 m-20 -112.83 -176.38 2.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.817 0.341 . . . . 0.0 110.932 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -65.96 -162.62 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.764 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 204' ' ' PTR . . . . . 0.469 ' HD1' ' ND2' ' A' ' 30' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -78.03 -60.39 2.39 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.852 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 206' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -121.18 145.08 41.16 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.896 179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . 0.595 ' HB3' HD21 ' A' ' 3' ' ' LEU . 85.7 Cg_endo -78.43 -163.06 0.2 Allowed 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 122.826 2.351 . . . . 0.0 112.534 -179.842 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 208' ' ' PHE . . . . . 0.471 ' CZ ' ' HB3' ' A' ' 10' ' ' ARG . 0.6 OUTLIER 71.02 118.84 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.873 -179.967 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.466 -0.334 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.663 0.268 . . . . 0.0 111.339 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.518 ' C ' HD12 ' A' ' 3' ' ' LEU . 2.5 p30 -101.92 -72.3 0.69 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.915 0.388 . . . . 0.0 111.078 179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.714 ' HB2' HD13 ' A' ' 8' ' ' LEU . 2.6 mp -164.05 -75.23 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.278 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.411 ' O ' ' CB ' ' A' ' 8' ' ' LEU . 0.1 OUTLIER 171.07 -170.34 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.726 -179.842 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.725 HD21 ' HB3' ' A' ' 62' ' ' HIS . 6.5 mt -95.52 -63.26 1.18 Allowed 'General case' 0 CA--C 1.505 -0.765 0 CA-C-O 121.293 0.568 . . . . 0.0 111.558 179.729 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.437 ' HB3' ' CA ' ' A' ' 129' ' ' GLY . 0.0 OUTLIER -59.54 -47.19 86.48 Favored 'General case' 0 N--CA 1.438 -1.039 0 CA-C-N 115.195 -0.911 . . . . 0.0 112.075 -178.162 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -65.59 -55.1 19.49 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-O 121.33 0.586 . . . . 0.0 110.021 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.744 HD23 ' CD2' ' A' ' 117' ' ' LEU . 8.6 tp -55.2 -45.7 75.86 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.102 179.019 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.448 ' HA ' HG12 ' A' ' 12' ' ' VAL . 76.4 t60 -54.4 -45.66 72.96 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.227 179.154 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.544 ' HB3' ' CZ ' ' B' ' 208' ' ' PHE . 36.9 mtt180 -59.31 -52.88 63.74 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.594 179.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.522 ' HG3' HG13 ' A' ' 31' ' ' VAL . 3.3 tp-100 -57.31 -57.41 12.74 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-O 121.149 0.5 . . . . 0.0 110.706 179.461 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.967 HG23 HD13 ' A' ' 110' ' ' LEU . 7.4 p -58.83 -46.11 91.16 Favored 'Isoleucine or valine' 0 C--O 1.236 0.357 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.717 -179.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.76 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 35.9 t -55.34 -64.07 0.96 Allowed 'General case' 0 C--O 1.235 0.307 0 CA-C-N 115.954 -0.566 . . . . 0.0 112.002 -179.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.464 ' O ' ' CG ' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -60.16 -32.78 71.37 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.056 -179.115 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.522 HD11 ' O ' ' A' ' 31' ' ' VAL . 9.7 mt -59.57 -65.37 0.68 Allowed 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.925 -179.373 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.797 HG22 ' H ' ' A' ' 22' ' ' ASP . 0.5 OUTLIER -65.53 -24.99 35.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.144 -179.523 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.38 -4.88 47.65 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -178.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.464 ' CG ' ' O ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -140.38 23.9 2.31 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 120.392 -0.523 . . . . 0.0 112.382 179.558 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -177.69 -69.85 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.188 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.619 ' OG ' ' HB1' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -46.51 -53.06 12.02 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.606 -0.27 . . . . 0.0 111.703 -178.787 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 80.93 37.57 18.66 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.558 -0.83 . . . . 0.0 112.031 -179.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.797 ' H ' HG22 ' A' ' 16' ' ' VAL . 7.7 t70 78.13 21.87 0.84 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.823 0.344 . . . . 0.0 110.715 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.28 -151.97 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.708 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.635 HG23 ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -103.51 165.35 11.09 Favored 'General case' 0 CA--C 1.519 -0.243 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 -179.987 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.641 ' HA3' HD22 ' A' ' 110' ' ' LEU . . . -127.58 156.18 20.4 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.041 -1.076 . . . . 0.0 113.909 -178.721 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.988 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -125.75 123.88 39.8 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 114.998 -0.601 . . . . 0.0 109.96 179.488 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.839 HD13 HG21 ' A' ' 58' ' ' THR . 2.6 tt -113.15 144.34 42.82 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 121.419 0.628 . . . . 0.0 111.922 -179.376 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.409 ' HD3' ' HD3' ' A' ' 26' ' ' LYS . 0.0 OUTLIER 169.77 54.23 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.729 179.672 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.612 ' O ' HD21 ' A' ' 3' ' ' LEU . . . 109.17 -19.31 29.88 Favored Glycine 0 N--CA 1.45 -0.433 0 N-CA-C 110.468 -1.053 . . . . 0.0 110.468 -177.673 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.481 ' N ' HD11 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -166.14 165.45 17.67 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 179.481 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.555 HG23 ' CE2' ' A' ' 55' ' ' PHE . 2.1 p -106.74 133.38 51.48 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 CA-C-O 121.348 0.594 . . . . 0.0 110.836 178.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.988 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -123.52 166.27 15.7 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.219 -0.9 . . . . 0.0 109.404 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.619 ' HB1' ' OG ' ' A' ' 20' ' ' SER . . . -102.61 138.42 39.55 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.543 0.687 . . . . 0.0 112.381 -178.216 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.536 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 31.4 t30 -114.94 123.5 49.28 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 114.698 -1.137 . . . . 0.0 110.531 -179.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.1 mtmp? -135.86 21.96 3.31 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.068 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -119.02 -24.59 6.48 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.338 -179.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 4.9 p -118.09 177.55 4.75 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.988 0.423 . . . . 0.0 111.105 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.409 ' O ' ' NE2' ' A' ' 40' ' ' GLN . 12.3 p -128.63 115.04 17.45 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.312 179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.635 ' CD1' HG23 ' A' ' 24' ' ' THR . 4.2 p90 -68.45 -84.87 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.591 -179.138 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.553 ' N ' ' CG ' ' A' ' 39' ' ' PHE . 0.0 OUTLIER 63.96 54.45 1.72 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.382 0.673 . . . . 0.0 112.711 179.924 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.575 ' N ' HE21 ' A' ' 107' ' ' GLN . . . 69.2 -50.55 0.56 Allowed Glycine 0 CA--C 1.526 0.72 0 CA-C-N 116.088 -0.505 . . . . 0.0 113.095 179.618 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.821 HD11 ' CB ' ' A' ' 46' ' ' SER . 0.8 OUTLIER 3.94 125.75 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.454 1.101 . . . . 0.0 113.92 179.102 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.679 HG22 ' CG ' ' A' ' 106' ' ' ASP . 0.8 OUTLIER -91.2 56.98 3.28 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.976 -179.617 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.595 HG22 ' O ' ' A' ' 44' ' ' ILE . 1.8 mp 49.55 9.26 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 N-CA-C 113.262 0.838 . . . . 0.0 113.262 179.052 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -100.75 -56.78 2.25 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 112.482 0.549 . . . . 0.0 112.482 -178.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.821 ' CB ' HD11 ' A' ' 42' ' ' LEU . 0.3 OUTLIER -54.5 -26.79 33.65 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.741 -178.883 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 140.51 38.99 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.378 -0.915 . . . . 0.0 112.929 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.592 ' HB2' HD23 ' A' ' 42' ' ' LEU . . . -93.96 -167.04 1.61 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.799 0.333 . . . . 0.0 110.447 179.504 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.467 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 0.7 OUTLIER -128.94 146.86 50.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.574 179.664 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.814 ' O ' HG22 ' A' ' 54' ' ' VAL . 8.5 tt0 -53.14 -24.05 9.62 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.099 0.476 . . . . 0.0 110.706 179.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.585 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 0.1 OUTLIER -61.7 -65.25 0.72 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.454 -179.441 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.556 ' HB2' ' HG2' ' A' ' 107' ' ' GLN . 0.6 OUTLIER -53.23 -50.52 64.58 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 120.713 0.292 . . . . 0.0 111.783 -179.221 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.82 ' HD2' HG13 ' A' ' 54' ' ' VAL . 0.0 OUTLIER -55.22 -57.13 13.03 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 111.716 0.265 . . . . 0.0 111.716 -179.35 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.82 HG13 ' HD2' ' A' ' 53' ' ' LYS . 15.7 m -54.36 -47.55 69.42 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 C-N-CA 120.662 -0.415 . . . . 0.0 110.383 179.503 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.597 ' O ' HG23 ' A' ' 58' ' ' THR . 0.6 OUTLIER -48.37 -42.72 32.51 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.812 178.785 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.778 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -64.24 -44.95 90.23 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.316 178.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 50.6 mm-40 -56.73 -47.46 79.96 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.859 -0.609 . . . . 0.0 111.13 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.839 HG21 HD13 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -64.02 -64.08 0.98 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.309 -179.702 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.914 HG23 HD12 ' A' ' 117' ' ' LEU . 12.0 p -46.28 -51.73 3.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.971 -179.6 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.507 ' N ' HG13 ' A' ' 59' ' ' VAL . 0.4 OUTLIER -55.6 -49.17 73.49 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.815 0.341 . . . . 0.0 110.835 179.235 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 47.8 m -55.57 -60.6 3.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.239 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . 0.725 ' HB3' HD21 ' A' ' 5' ' ' LEU . 1.7 m170 -49.51 -37.36 26.31 Favored 'General case' 0 C--N 1.333 -0.124 0 CA-C-O 121.094 0.473 . . . . 0.0 110.123 179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.892 HG23 ' O ' ' A' ' 59' ' ' VAL . 40.8 t -75.64 -82.19 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-N 115.63 -0.713 . . . . 0.0 110.247 179.194 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.493 ' HB3' ' O ' ' A' ' 63' ' ' VAL . . . 72.62 -6.72 1.56 Allowed 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 178.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.538 ' OD1' HG13 ' A' ' 99' ' ' VAL . 6.5 m-20 153.46 -61.52 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.394 0.677 . . . . 0.0 109.365 -179.378 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.867 HG12 ' HB3' ' A' ' 123' ' ' GLN . 0.1 OUTLIER 44.23 -100.96 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.36 0 CA-C-N 115.243 -0.89 . . . . 0.0 112.842 178.903 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.743 HG22 ' HB3' ' A' ' 97' ' ' ASN . 0.3 OUTLIER 167.38 107.87 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.343 0.289 0 CA-C-O 121.594 0.711 . . . . 0.0 109.833 -179.519 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.842 HD11 ' HB2' ' A' ' 100' ' ' LEU . 0.1 OUTLIER -110.29 112.63 24.71 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 115.358 -0.837 . . . . 0.0 112.752 -178.071 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.563 HG22 HD22 ' A' ' 97' ' ' ASN . 11.0 p -83.37 178.7 7.93 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.608 -0.723 . . . . 0.0 110.788 179.291 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -41.0 -31.14 0.16 Allowed 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.558 -179.696 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -68.97 -57.8 4.98 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.943 0.401 . . . . 0.0 110.396 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.655 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 65.4 m-20 -69.3 -39.87 78.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.722 179.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 62.1 m -61.3 -41.23 96.63 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-O 121.296 0.569 . . . . 0.0 109.622 178.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.501 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . . . -71.24 -30.74 66.69 Favored 'General case' 0 CA--C 1.512 -0.506 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 177.744 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 1.074 ' CG ' HG12 ' A' ' 115' ' ' VAL . 0.3 OUTLIER -55.01 -50.36 69.22 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-N 114.322 -1.308 . . . . 0.0 109.426 177.92 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 1.087 HD13 HD11 ' A' ' 90' ' ' LEU . 1.4 mt -67.29 -56.75 8.49 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.466 179.205 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.752 ' O ' HG22 ' A' ' 81' ' ' VAL . 0.6 OUTLIER -54.57 -26.85 34.85 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.476 179.808 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.408 ' HA ' HG22 ' A' ' 81' ' ' VAL . 8.7 mt-30 -72.53 -54.81 8.18 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.232 179.213 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . 0.411 ' OG ' ' HG3' ' A' ' 111' ' ' GLN . 0.0 OUTLIER -52.65 -36.19 56.3 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.676 179.551 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 86.0 m -78.12 -62.96 1.51 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.969 -0.56 . . . . 0.0 111.788 -179.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.752 HG22 ' O ' ' A' ' 77' ' ' LEU . 32.7 m -50.6 -35.39 13.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 N-CA-C 111.841 0.312 . . . . 0.0 111.841 -179.275 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 3.8 mmtm -50.7 -70.02 0.1 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.118 -179.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -172.0 45.6 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.897 179.975 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 70.8 m-20 -137.3 169.58 17.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.893 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.41 HD13 ' HA ' ' A' ' 85' ' ' LEU . 4.1 mm? -88.33 173.68 8.6 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.74 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.446 ' O ' ' HB3' ' A' ' 87' ' ' ASN . 7.5 m120 -60.07 -89.21 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.343 -0.39 . . . . 0.0 110.587 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . 0.61 ' HA ' ' HB2' ' A' ' 104' ' ' ARG . 9.7 t-20 72.64 -42.65 0.54 Allowed 'General case' 0 C--O 1.238 0.47 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 179.507 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.758 ' CD2' HD22 ' A' ' 76' ' ' LEU . 6.9 p90 -96.73 160.57 14.3 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 121.232 0.539 . . . . 0.0 112.397 -178.587 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.697 ' HB3' ' O ' ' A' ' 101' ' ' VAL . 0.8 OUTLIER -131.9 140.7 49.14 Favored 'General case' 0 N--CA 1.443 -0.822 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 178.593 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 1.087 HD11 HD13 ' A' ' 76' ' ' LEU . 8.0 mt -133.94 155.27 50.23 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 -176.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.67 ' O ' ' HB3' ' A' ' 98' ' ' SER . 0.0 OUTLIER -139.96 150.25 44.27 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.293 178.439 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.79 ' O ' HG13 ' A' ' 93' ' ' VAL . 33.7 p -104.47 159.33 15.82 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 121.77 0.795 . . . . 0.0 112.648 -179.02 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.79 HG13 ' O ' ' A' ' 92' ' ' SER . 0.0 OUTLIER 165.38 150.63 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.146 0 CA-C-N 113.853 -1.521 . . . . 0.0 108.199 -179.389 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.615 ' HA3' ' OD1' ' A' ' 97' ' ' ASN . . . 97.43 30.39 7.34 Favored Glycine 0 C--N 1.293 -1.846 0 C-N-CA 120.076 -1.059 . . . . 0.0 113.337 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.407 ' O ' ' ND2' ' A' ' 95' ' ' ASN . 1.1 p-10 42.14 29.18 0.13 Allowed 'General case' 0 N--CA 1.454 -0.239 0 CA-C-O 121.37 0.605 . . . . 0.0 110.115 -179.04 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.466 ' O ' ' HB ' ' A' ' 69' ' ' THR . . . 141.46 23.1 0.24 Allowed Glycine 0 N--CA 1.442 -0.933 0 CA-C-N 115.261 -0.881 . . . . 0.0 112.729 -179.153 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.743 ' HB3' HG22 ' A' ' 67' ' ' VAL . 0.5 OUTLIER -128.01 167.64 16.42 Favored 'General case' 0 N--CA 1.438 -1.049 0 N-CA-C 106.86 -1.533 . . . . 0.0 106.86 177.999 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.717 ' O ' HD12 ' A' ' 68' ' ' LEU . 3.5 m -147.48 159.85 43.26 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 119.343 -0.943 . . . . 0.0 111.39 -178.274 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.538 HG13 ' OD1' ' A' ' 65' ' ' ASN . 1.2 t -103.56 140.42 21.78 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 179.56 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.924 HD22 HD21 ' A' ' 90' ' ' LEU . 0.1 OUTLIER -103.57 111.07 23.37 Favored 'General case' 0 CA--C 1.506 -0.735 0 CA-C-O 121.764 0.792 . . . . 0.0 112.899 -178.197 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.697 ' O ' ' HB3' ' A' ' 89' ' ' ASP . 0.1 OUTLIER -123.88 103.52 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.194 0 N-CA-C 104.202 -2.518 . . . . 0.0 104.202 175.003 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.607 ' O ' ' HB2' ' A' ' 103' ' ' LEU . 12.2 p -140.37 142.24 35.54 Favored 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 119.669 -0.813 . . . . 0.0 112.068 -175.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.814 HD13 ' O ' ' A' ' 105' ' ' SER . 0.2 OUTLIER 147.74 79.29 0.0 OUTLIER 'General case' 0 N--CA 1.443 -0.776 0 CA-C-N 114.681 -1.145 . . . . 0.0 111.784 177.531 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.61 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -98.31 28.43 4.1 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 177.487 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.814 ' O ' HD13 ' A' ' 103' ' ' LEU . 6.9 m 148.83 179.21 0.0 OUTLIER 'General case' 0 C--N 1.343 0.293 0 CA-C-N 113.749 -1.569 . . . . 0.0 107.047 -178.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.679 ' CG ' HG22 ' A' ' 43' ' ' THR . 0.0 OUTLIER -104.14 101.34 11.09 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 119.1 0.864 . . . . 0.0 111.908 -178.973 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.778 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 0.6 OUTLIER -169.46 165.05 10.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.308 178.434 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.549 ' HB2' ' HB2' ' A' ' 56' ' ' ALA . 1.8 tpt -165.21 142.46 5.88 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.3 0.572 . . . . 0.0 112.008 178.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.551 HG22 ' CE2' ' A' ' 39' ' ' PHE . 0.5 OUTLIER -104.83 159.55 15.7 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.248 -0.887 . . . . 0.0 109.709 179.112 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.967 HD13 HG23 ' A' ' 12' ' ' VAL . 0.9 OUTLIER -46.44 -55.75 6.96 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 121.357 0.599 . . . . 0.0 109.977 179.411 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.879 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 2.2 tp-100 -53.05 -66.7 0.34 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.791 -179.214 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.84 ' O ' HG22 ' A' ' 115' ' ' VAL . 7.5 m-20 -44.61 -37.57 3.7 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 121.525 0.679 . . . . 0.0 110.746 -179.699 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.554 ' HB3' HG21 ' A' ' 12' ' ' VAL . . . -62.63 -44.24 96.79 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.384 179.205 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.879 ' HD2' ' HA ' ' A' ' 111' ' ' GLN . 0.0 OUTLIER -79.28 -21.9 45.41 Favored 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.77 -179.578 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 1.074 HG12 ' CG ' ' A' ' 75' ' ' LYS . 13.2 m -69.55 -48.87 63.64 Favored 'Isoleucine or valine' 0 C--O 1.242 0.688 0 CA-C-O 122.165 0.984 . . . . 0.0 109.209 179.164 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.856 ' HB3' HG21 ' A' ' 63' ' ' VAL . 1.2 mp -71.5 -36.82 71.24 Favored 'General case' 0 N--CA 1.433 -1.3 0 CA-C-N 114.148 -1.387 . . . . 0.0 110.068 179.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.914 HD12 HG23 ' A' ' 59' ' ' VAL . 0.2 OUTLIER -75.83 -20.12 58.39 Favored 'General case' 0 CA--C 1.51 -0.578 0 C-N-CA 120.421 -0.512 . . . . 0.0 110.767 178.935 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.45 ' HA ' HD23 ' A' ' 121' ' ' LEU . 28.6 tp10 -71.66 -50.23 32.42 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 106.446 -1.687 . . . . 0.0 106.446 177.531 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.526 ' HA ' ' HB3' ' A' ' 122' ' ' ARG . . . -72.28 -33.27 67.31 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.863 177.287 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.813 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -60.82 -64.82 0.82 Allowed 'General case' 0 CA--C 1.513 -0.464 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.824 179.367 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.49 HD23 ' O ' ' A' ' 117' ' ' LEU . 0.0 OUTLIER -58.42 -31.5 67.78 Favored 'General case' 0 N--CA 1.448 -0.575 0 CA-C-N 115.636 -0.711 . . . . 0.0 109.716 179.077 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.526 ' HB3' ' HA ' ' A' ' 119' ' ' ALA . 0.0 OUTLIER -59.5 -65.15 0.72 Allowed 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.958 -179.798 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.867 ' HB3' HG12 ' A' ' 66' ' ' VAL . 1.4 tm0? -86.71 -4.7 59.21 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 113.376 0.88 . . . . 0.0 113.376 -177.486 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . 0.573 ' HG2' HG13 ' A' ' 66' ' ' VAL . 5.0 mm-40 -93.83 -67.34 0.86 Allowed 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 119.895 -0.722 . . . . 0.0 111.614 -179.675 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.425 ' CB ' ' HB2' ' A' ' 128' ' ' ARG . 9.8 p -96.93 -39.26 9.46 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.492 -179.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 85.43 68.08 1.38 Allowed Glycine 0 CA--C 1.5 -0.846 0 N-CA-C 110.992 -0.843 . . . . 0.0 110.992 -178.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . 49.65 27.46 2.19 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 -177.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . 0.425 ' HB2' ' CB ' ' A' ' 125' ' ' SER . 0.2 OUTLIER -95.64 -59.1 1.94 Allowed 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 115.018 -0.992 . . . . 0.0 111.343 -178.39 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . 0.437 ' CA ' ' HB3' ' A' ' 6' ' ' SER . . . 90.52 -79.47 1.43 Allowed Glycine 0 C--N 1.332 0.332 0 C-N-CA 120.648 -0.787 . . . . 0.0 112.55 -179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.249 -0.882 . . . . 0.0 110.907 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 201' ' ' ACE . . . . . 0.449 ' H2 ' ' CE2' ' B' ' 204' ' ' PTR . . . . . . . . 0 C--O 1.232 0.144 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -93.3 -56.23 3.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.754 0.311 . . . . 0.0 110.906 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -117.47 -7.15 11.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.446 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 204' ' ' PTR . . . . . 0.449 ' CE2' ' H2 ' ' B' ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 51.56 -102.68 0.13 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.593 -0.73 . . . . 0.0 112.433 179.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 206' ' ' ASP . . . . . 0.497 ' CB ' ' HD2' ' B' ' 207' ' ' PRO . 0.7 OUTLIER -136.76 173.96 4.97 Favored Pre-proline 0 CA--C 1.532 0.26 0 CA-C-O 120.569 0.224 . . . . 0.0 111.379 -178.649 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . 0.621 ' HB3' HD23 ' A' ' 3' ' ' LEU . 37.2 Cg_endo -66.93 58.84 0.56 Allowed 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.673 2.249 . . . . 0.0 113.315 -179.429 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 208' ' ' PHE . . . . . 0.575 ' C ' ' CD1' ' B' ' 208' ' ' PHE . 0.0 OUTLIER 64.9 -3.86 0.54 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.759 0.314 . . . . 0.0 111.373 179.079 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.681 -0.236 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.405 0 CA-C-O 120.752 0.31 . . . . 0.0 111.266 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.6 p30 44.58 -163.55 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.373 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.755 HD11 ' C ' ' A' ' 29' ' ' GLY . 5.7 mp -73.23 -72.5 0.25 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.341 0.591 . . . . 0.0 110.455 179.374 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 167.73 -159.21 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.109 -0.951 . . . . 0.0 109.087 -179.609 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.78 HD21 ' HB1' ' A' ' 120' ' ' ALA . 0.0 OUTLIER -95.25 -60.98 1.55 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.887 0.375 . . . . 0.0 111.413 179.567 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.424 ' CB ' ' HA2' ' A' ' 129' ' ' GLY . 27.8 p -53.74 -45.05 70.41 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.888 -0.597 . . . . 0.0 112.242 -179.238 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . 0.432 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -73.18 -62.47 1.46 Allowed 'General case' 0 CA--C 1.518 -0.254 0 CA-C-O 120.901 0.381 . . . . 0.0 110.192 -179.679 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 1.055 HD23 HD21 ' A' ' 117' ' ' LEU . 6.5 tp -45.05 -45.74 11.04 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.835 -0.621 . . . . 0.0 110.313 179.203 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.765 ' CG ' HD22 ' A' ' 121' ' ' LEU . 63.4 t60 -62.16 -48.78 78.58 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 115.604 -0.726 . . . . 0.0 109.581 178.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.46 ' HB3' ' CZ ' ' B' ' 208' ' ' PHE . 4.1 mmt180 -48.92 -54.92 13.46 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.755 -179.416 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.615 ' OE1' HD22 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -67.5 -54.89 16.24 Favored 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 111.965 0.357 . . . . 0.0 111.965 -179.353 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.783 HG23 HD23 ' A' ' 110' ' ' LEU . 8.6 p -55.98 -46.87 80.68 Favored 'Isoleucine or valine' 0 C--O 1.242 0.698 0 CA-C-O 121.292 0.568 . . . . 0.0 111.18 -179.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.549 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 9.2 t -58.99 -57.97 10.74 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.965 179.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.441 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -58.13 -25.73 61.77 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.697 -179.863 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.567 HD22 ' HB2' ' A' ' 33' ' ' ALA . 12.9 mt -67.97 -65.37 0.7 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.687 -179.519 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.599 HG23 HD13 ' A' ' 110' ' ' LEU . 1.4 t -73.43 -25.0 20.69 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 C-N-CA 120.148 -0.621 . . . . 0.0 110.977 -179.538 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.426 ' CG ' ' O ' ' A' ' 13' ' ' SER . 7.2 mm-40 -75.96 -23.42 55.37 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 120.845 -0.342 . . . . 0.0 110.253 179.384 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -154.3 57.87 0.71 Allowed 'General case' 0 CA--C 1.53 0.178 0 CA-C-O 120.73 0.3 . . . . 0.0 111.274 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 175.89 -61.8 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 112.065 0.394 . . . . 0.0 112.065 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.771 ' OG ' ' HB1' ' A' ' 33' ' ' ALA . 20.4 m -85.44 -77.85 0.28 Allowed 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.894 0.378 . . . . 0.0 111.97 -178.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.565 ' H ' ' HA ' ' A' ' 16' ' ' VAL . . . 118.57 -36.64 3.52 Favored Glycine 0 N--CA 1.449 -0.473 0 N-CA-C 111.553 -0.619 . . . . 0.0 111.553 -179.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.405 ' O ' ' O ' ' A' ' 23' ' ' CYS . 0.2 OUTLIER -177.08 5.24 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 120.719 0.295 . . . . 0.0 111.636 179.895 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.633 ' HB2' HD12 ' A' ' 110' ' ' LEU . 88.5 m -52.65 -165.96 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.495 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.617 ' CB ' ' HB3' ' A' ' 34' ' ' ASN . 0.2 OUTLIER -103.77 164.47 11.66 Favored 'General case' 0 C--N 1.332 -0.155 0 C-N-CA 120.796 -0.362 . . . . 0.0 110.142 179.758 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -109.21 136.26 13.44 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.301 -0.952 . . . . 0.0 113.716 -178.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.918 ' HB3' ' HB3' ' A' ' 32' ' ' ALA . 2.1 tmmm? -105.68 116.65 32.31 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.502 -0.555 . . . . 0.0 109.502 178.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.795 HD22 HG12 ' A' ' 54' ' ' VAL . 8.6 tt -104.11 146.77 28.26 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.033 0.444 . . . . 0.0 111.849 -179.05 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.512 ' NH2' HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER 153.81 64.59 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.271 -179.863 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.755 ' C ' HD11 ' A' ' 3' ' ' LEU . . . 89.94 -12.43 67.55 Favored Glycine 0 CA--C 1.519 0.289 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.764 -178.56 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.685 ' N ' HD11 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -165.9 165.16 18.39 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.66 HG21 ' HB ' ' A' ' 12' ' ' VAL . 0.1 OUTLIER -110.37 121.35 63.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 C-N-CA 120.439 -0.504 . . . . 0.0 109.939 177.781 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.918 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . . . -104.07 166.5 10.37 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.771 -179.217 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.778 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -103.15 104.76 14.94 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.26 0.553 . . . . 0.0 111.72 -178.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.617 ' HB3' ' CB ' ' A' ' 24' ' ' THR . 49.5 t30 -76.25 86.75 3.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.998 179.303 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.91 74.49 2.64 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.836 -179.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 179.62 -36.66 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.46 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.68 ' O ' HG23 ' A' ' 38' ' ' THR . 0.2 OUTLIER -100.72 -166.62 1.33 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.794 179.862 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.68 HG23 ' O ' ' A' ' 37' ' ' THR . 0.9 OUTLIER -168.83 102.22 0.39 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.118 -0.492 . . . . 0.0 109.682 179.882 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.66 ' CZ ' ' HA ' ' A' ' 48' ' ' ALA . 20.6 m-30 -114.92 145.03 42.65 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 113.229 0.826 . . . . 0.0 113.229 -178.209 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.477 ' O ' ' HG2' ' A' ' 40' ' ' GLN . 2.1 pm0 -153.75 65.23 0.73 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.408 -1.269 . . . . 0.0 110.229 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.468 ' H ' ' HB3' ' A' ' 107' ' ' GLN . . . 78.31 106.39 0.19 Allowed Glycine 0 CA--C 1.519 0.332 0 CA-C-N 115.352 -0.84 . . . . 0.0 113.084 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.68 ' N ' ' HB3' ' A' ' 105' ' ' SER . 0.0 OUTLIER -154.81 -135.23 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 110.071 -0.344 . . . . 0.0 110.071 178.86 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.503 ' H ' HD12 ' A' ' 42' ' ' LEU . 0.1 OUTLIER -170.52 35.28 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.185 0 O-C-N 121.859 -0.525 . . . . 0.0 111.493 -179.656 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.743 ' HA ' ' HB3' ' A' ' 48' ' ' ALA . 4.9 mt 63.29 3.49 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -88.63 -56.39 3.32 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.916 0.389 . . . . 0.0 110.752 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.447 ' HB2' HD11 ' A' ' 42' ' ' LEU . 1.4 t -60.39 -22.59 63.51 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.727 179.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 135.5 46.6 0.09 OUTLIER Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.903 -0.665 . . . . 0.0 112.295 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.872 ' HB2' ' OE1' ' A' ' 107' ' ' GLN . . . -102.68 -169.02 1.6 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.087 0.47 . . . . 0.0 111.457 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -145.8 142.08 28.54 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.977 179.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.607 ' O ' HG23 ' A' ' 54' ' ' VAL . 10.1 tt0 -44.52 -29.27 0.69 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.818 0.342 . . . . 0.0 111.654 -179.324 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.416 ' CB ' ' HG2' ' A' ' 26' ' ' LYS . 5.2 m -56.54 -65.18 0.65 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.742 -179.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.437 ' HG3' ' O ' ' A' ' 108' ' ' MET . 0.7 OUTLIER -53.77 -63.77 1.04 Allowed 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 111.911 0.338 . . . . 0.0 111.911 -179.164 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.649 ' CE ' HD11 ' A' ' 44' ' ' ILE . 0.7 OUTLIER -44.78 -51.89 8.98 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-O 120.686 0.279 . . . . 0.0 111.426 -179.802 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.795 HG12 HD22 ' A' ' 27' ' ' LEU . 74.9 t -58.81 -34.32 51.87 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.136 0 CA-C-O 121.055 0.455 . . . . 0.0 109.788 179.188 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.699 ' HA ' HD13 ' A' ' 27' ' ' LEU . 0.3 OUTLIER -63.67 -46.37 85.9 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.737 178.883 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.782 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -57.51 -46.61 83.58 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.455 179.195 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.436 ' OE1' HD11 ' A' ' 103' ' ' LEU . 13.8 mm-40 -62.91 -45.32 93.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.451 179.554 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.461 HG21 HD11 ' A' ' 27' ' ' LEU . 59.5 m -59.86 -57.76 11.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.917 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.96 HG23 HD12 ' A' ' 117' ' ' LEU . 7.7 p -59.04 -48.7 85.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.811 179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.81 HD22 ' CD2' ' A' ' 103' ' ' LEU . 12.9 tp -54.83 -34.28 62.62 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.906 0.384 . . . . 0.0 110.615 179.516 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 49.2 m -72.27 -50.8 24.39 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.156 -179.584 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . 0.605 ' ND1' HD23 ' A' ' 5' ' ' LEU . 0.4 OUTLIER -66.63 -25.09 66.42 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-O 120.928 0.394 . . . . 0.0 110.733 -179.54 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 1.089 HG13 HG11 ' A' ' 66' ' ' VAL . 7.0 t -98.66 31.2 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.489 179.188 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.57 ' O ' ' HB2' ' A' ' 65' ' ' ASN . . . -68.85 61.73 0.1 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.174 -0.467 . . . . 0.0 111.288 -179.299 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.685 ' O ' HG22 ' A' ' 99' ' ' VAL . 0.7 OUTLIER 142.19 -73.13 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.095 0.558 . . . . 0.0 111.407 179.722 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 1.089 HG11 HG13 ' A' ' 63' ' ' VAL . 29.2 m 39.55 -146.15 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.912 -179.092 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.484 ' O ' ' O ' ' A' ' 98' ' ' SER . 4.1 p -158.51 -24.02 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.367 0 N-CA-C 112.284 0.476 . . . . 0.0 112.284 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.737 HD12 ' O ' ' A' ' 98' ' ' SER . 0.7 OUTLIER 36.89 92.6 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 179.093 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 15.7 p -64.34 177.02 0.92 Allowed 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 178.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.421 ' HA ' ' O ' ' A' ' 96' ' ' GLY . 0.7 OUTLIER -42.21 -33.2 0.57 Allowed 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 120.807 0.337 . . . . 0.0 111.329 -179.934 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -65.27 -63.81 1.01 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.198 -0.456 . . . . 0.0 110.468 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.675 ' HB3' HD23 ' A' ' 68' ' ' LEU . 48.5 m-20 -59.85 -33.51 71.89 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.859 0.362 . . . . 0.0 110.472 179.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.582 HG23 ' HB3' ' A' ' 98' ' ' SER . 2.1 m -56.48 -62.81 1.47 Allowed 'General case' 0 C--O 1.233 0.21 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 178.596 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -57.78 -27.48 63.11 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.449 0.642 . . . . 0.0 109.28 177.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 1.085 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.1 OUTLIER -56.99 -65.15 0.67 Allowed 'General case' 0 C--O 1.238 0.469 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.302 178.956 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 1.043 HD21 HD11 ' A' ' 116' ' ' LEU . 0.5 OUTLIER -56.21 -39.06 71.87 Favored 'General case' 0 CA--C 1.516 -0.348 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.434 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.428 ' O ' HG23 ' A' ' 81' ' ' VAL . 0.1 OUTLIER -55.96 -49.18 74.29 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.398 179.522 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -60.69 -58.1 9.89 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.423 -179.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.65 -61.6 1.99 Allowed 'General case' 0 C--N 1.327 -0.41 0 C-N-CA 120.924 -0.31 . . . . 0.0 111.566 -179.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.533 HG22 ' O ' ' A' ' 76' ' ' LEU . 0.7 OUTLIER -49.39 -44.03 44.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.772 -179.265 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.428 HG23 ' O ' ' A' ' 77' ' ' LEU . 16.7 t -87.36 -12.85 10.61 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 N-CA-C 111.652 0.241 . . . . 0.0 111.652 -179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? -37.29 154.3 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.932 0.396 . . . . 0.0 111.603 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 6.6 p-80 -58.65 90.39 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.224 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.1 m-80 179.94 -76.79 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.051 179.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.642 HD23 ' H ' ' A' ' 86' ' ' ASN . 0.2 OUTLIER -173.99 172.96 3.29 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.023 -179.86 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.642 ' H ' HD23 ' A' ' 85' ' ' LEU . 4.6 m-80 -91.94 177.96 6.03 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.811 179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . 0.467 ' HA ' ' HB2' ' A' ' 104' ' ' ARG . 25.8 t30 178.52 -38.74 0.01 OUTLIER 'General case' 0 C--O 1.241 0.645 0 CA-C-O 121.311 0.577 . . . . 0.0 110.632 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.548 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 4.1 m-85 -106.94 142.26 36.85 Favored 'General case' 0 N--CA 1.444 -0.748 0 CA-C-N 115.935 -0.575 . . . . 0.0 111.914 -179.01 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.666 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.2 OUTLIER -110.4 150.76 28.35 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 115.299 -0.864 . . . . 0.0 108.982 -179.4 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.925 HD21 HD13 ' A' ' 76' ' ' LEU . 2.0 mt -138.74 156.17 47.61 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 113.741 1.015 . . . . 0.0 113.741 -177.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.602 ' O ' ' CB ' ' A' ' 98' ' ' SER . 56.2 mmm-85 -128.19 149.8 50.29 Favored 'General case' 0 C--O 1.218 -0.558 0 CA-C-N 114.695 -1.138 . . . . 0.0 108.536 177.866 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.79 ' O ' HG13 ' A' ' 93' ' ' VAL . 53.4 p -103.76 154.29 19.73 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 121.985 0.898 . . . . 0.0 113.065 -178.302 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.79 HG13 ' O ' ' A' ' 92' ' ' SER . 0.0 OUTLIER 167.29 157.17 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.433 -1.316 0 CA-C-N 113.594 -1.639 . . . . 0.0 107.531 -179.31 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.489 ' O ' ' HB3' ' A' ' 95' ' ' ASN . . . 88.72 35.52 8.39 Favored Glycine 0 C--N 1.291 -1.968 0 C-N-CA 120.068 -1.063 . . . . 0.0 112.667 -179.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.489 ' HB3' ' O ' ' A' ' 94' ' ' GLY . 13.6 t30 70.51 -56.13 0.61 Allowed 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 108.631 -0.877 . . . . 0.0 108.631 -178.151 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.455 ' N ' ' O ' ' A' ' 94' ' ' GLY . . . -145.56 26.1 1.82 Allowed Glycine 0 N--CA 1.439 -1.141 0 CA-C-N 115.168 -0.924 . . . . 0.0 111.378 178.513 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.558 ' O ' ' O ' ' A' ' 93' ' ' VAL . 0.2 OUTLIER -104.9 166.32 10.46 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 117.097 0.448 . . . . 0.0 109.907 179.676 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.737 ' O ' HD12 ' A' ' 68' ' ' LEU . 0.6 OUTLIER -146.78 161.86 39.76 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.528 0.68 . . . . 0.0 111.451 179.942 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.685 HG22 ' O ' ' A' ' 65' ' ' ASN . 0.5 OUTLIER -103.87 155.04 5.76 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.897 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.176 179.604 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.708 HD22 ' HG ' ' A' ' 116' ' ' LEU . 1.4 tp -103.05 108.89 20.24 Favored 'General case' 0 N--CA 1.443 -0.811 0 CA-C-O 121.937 0.875 . . . . 0.0 112.389 -179.319 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.666 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -122.12 105.19 15.89 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.027 0 N-CA-C 104.073 -2.566 . . . . 0.0 104.073 175.49 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.742 ' O ' ' HB2' ' A' ' 103' ' ' LEU . 0.1 OUTLIER -144.34 165.15 28.72 Favored 'General case' 0 C--N 1.307 -1.265 0 C-N-CA 119.01 -1.076 . . . . 0.0 113.734 -173.917 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.81 ' CD2' HD22 ' A' ' 60' ' ' LEU . 0.5 OUTLIER 132.57 70.85 0.0 OUTLIER 'General case' 0 N--CA 1.448 -0.537 0 CA-C-N 113.469 -1.696 . . . . 0.0 112.533 176.465 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.467 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -98.32 13.21 32.25 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 114.757 -1.11 . . . . 0.0 108.132 177.001 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.68 ' HB3' ' N ' ' A' ' 42' ' ' LEU . 5.0 m 160.15 172.07 0.01 OUTLIER 'General case' 0 C--O 1.231 0.099 0 CA-C-N 114.108 -1.406 . . . . 0.0 107.335 -179.151 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.505 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.4 OUTLIER -104.75 101.7 11.3 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 119.61 -0.836 . . . . 0.0 112.194 -178.965 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.872 ' OE1' ' HB2' ' A' ' 48' ' ' ALA . 1.6 mt-30 -169.6 165.23 10.25 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.776 178.024 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.476 ' HB3' ' HB3' ' A' ' 55' ' ' PHE . 0.0 OUTLIER -165.56 138.14 4.24 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.12 0.486 . . . . 0.0 111.799 178.48 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.549 ' CG2' HG23 ' A' ' 24' ' ' THR . 0.1 OUTLIER -103.91 159.58 15.53 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.38 178.759 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.783 HD23 HG23 ' A' ' 12' ' ' VAL . 6.8 mt -46.92 -55.55 7.87 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 121.174 -0.211 . . . . 0.0 110.908 -179.481 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.894 ' O ' HG23 ' A' ' 115' ' ' VAL . 2.1 tp60 -46.87 -65.52 0.55 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.691 0.281 . . . . 0.0 110.826 179.708 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.907 ' O ' HD22 ' A' ' 116' ' ' LEU . 58.9 m-20 -45.52 -54.14 7.94 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-O 121.158 0.504 . . . . 0.0 110.867 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.479 ' HB3' HG21 ' A' ' 12' ' ' VAL . . . -44.31 -64.94 0.58 Allowed 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.944 179.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.583 ' NZ ' ' HB ' ' A' ' 16' ' ' VAL . 0.0 OUTLIER -64.97 -22.08 66.94 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.473 -179.847 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 1.085 HG22 ' CG ' ' A' ' 75' ' ' LYS . 53.1 t -60.06 -64.94 0.51 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.815 0 CA-C-O 121.995 0.902 . . . . 0.0 109.786 179.535 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 1.043 HD11 HD21 ' A' ' 76' ' ' LEU . 0.2 OUTLIER -64.05 -35.83 82.02 Favored 'General case' 0 N--CA 1.444 -0.731 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.85 179.67 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 1.055 HD21 HD23 ' A' ' 8' ' ' LEU . 0.4 OUTLIER -70.86 -19.14 62.66 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-O 121.044 0.449 . . . . 0.0 110.812 179.437 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.578 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 6.9 tp10 -75.34 -47.5 27.43 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 106.598 -1.63 . . . . 0.0 106.598 177.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.552 ' HB1' ' H ' ' A' ' 68' ' ' LEU . . . -77.93 -18.19 56.37 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 114.606 -1.179 . . . . 0.0 111.08 178.303 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.891 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -82.44 -52.17 7.14 Favored 'General case' 0 N--CA 1.443 -0.818 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 179.186 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.765 HD22 ' CG ' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -63.85 -30.06 71.19 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 178.148 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.578 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 4.3 ttm-85 -71.91 -55.98 6.53 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.422 -179.479 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -92.7 -29.87 15.84 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 -177.024 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . 0.406 ' CB ' ' O ' ' A' ' 120' ' ' ALA . 4.4 mm-40 -75.73 -65.99 0.84 Allowed 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.514 -0.474 . . . . 0.0 112.038 -178.382 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -95.88 -48.26 5.8 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.97 -178.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . 0.42 ' N ' ' O ' ' A' ' 121' ' ' LEU . . . 87.22 71.51 1.29 Allowed Glycine 0 CA--C 1.502 -0.767 0 N-CA-C 110.8 -0.92 . . . . 0.0 110.8 -178.418 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . 51.14 27.17 3.24 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 -177.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.32 -70.24 0.7 Allowed 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 115.051 -0.977 . . . . 0.0 111.723 -178.299 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . 0.424 ' HA2' ' CB ' ' A' ' 6' ' ' SER . . . 117.26 -38.3 3.03 Favored Glycine 0 C--N 1.333 0.409 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.379 -179.548 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 8.0 t . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.228 -0.891 . . . . 0.0 110.977 179.919 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.122 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -95.26 -30.36 14.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.803 0.335 . . . . 0.0 110.94 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -127.47 144.41 51.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.008 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 204' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 54.65 -87.36 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.941 179.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 206' ' ' ASP . . . . . 0.446 ' HB2' ' HD2' ' B' ' 207' ' ' PRO . 0.1 OUTLIER -156.16 166.91 15.42 Favored Pre-proline 0 C--N 1.332 -0.165 0 CA-C-O 120.653 0.263 . . . . 0.0 111.059 -179.24 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . 0.514 ' HB3' HD23 ' A' ' 3' ' ' LEU . 5.7 Cg_exo -38.19 -71.27 0.06 OUTLIER 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 123.426 2.751 . . . . 0.0 112.726 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 208' ' ' PHE . . . . . 0.46 ' CZ ' ' HB3' ' A' ' 10' ' ' ARG . 0.1 OUTLIER -175.95 -171.77 0.47 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.416 -0.356 . . . . 0.0 111.029 179.84 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.326 0 CA-C-N 116.484 -0.326 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.1 ptp . . . . . 0 N--CA 1.488 1.444 0 CA-C-O 120.725 0.298 . . . . 0.0 111.398 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -103.91 -164.22 1.04 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.929 0.395 . . . . 0.0 111.278 -179.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.858 HD11 ' HB2' ' A' ' 7' ' ' ASP . 0.0 OUTLIER -91.38 -66.64 0.91 Allowed 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.405 -179.668 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.682 ' N ' HD13 ' A' ' 3' ' ' LEU . 39.9 t 172.81 -169.18 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.42 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 179.391 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 1.004 HD21 ' CB ' ' A' ' 120' ' ' ALA . 0.0 OUTLIER -96.7 -65.42 0.97 Allowed 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.661 -0.416 . . . . 0.0 111.406 179.049 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 24.4 p -51.18 -49.01 61.75 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.695 -179.078 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . 0.858 ' HB2' HD11 ' A' ' 3' ' ' LEU . 2.9 m-20 -67.9 -44.59 76.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.904 0.383 . . . . 0.0 110.19 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 1.101 HD23 HD21 ' A' ' 117' ' ' LEU . 18.6 tp -61.53 -64.75 0.84 Allowed 'General case' 0 C--O 1.221 -0.395 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.279 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.916 ' CD2' HD22 ' A' ' 121' ' ' LEU . 71.7 t60 -45.19 -50.53 11.43 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.392 0.615 . . . . 0.0 109.865 178.817 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.452 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 17.3 mmt85 -56.39 -51.43 68.37 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.298 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 1.139 ' HG3' HG12 ' A' ' 31' ' ' VAL . 4.6 pt20 -71.05 -53.31 15.14 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.728 -179.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.883 ' CA ' HG11 ' A' ' 31' ' ' VAL . 10.0 p -55.58 -50.04 69.5 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.212 0 CA-C-O 120.705 0.288 . . . . 0.0 111.455 179.331 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.47 ' N ' HG13 ' A' ' 12' ' ' VAL . 4.6 t -64.51 -43.66 93.35 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.354 179.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.452 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -53.79 -43.92 69.69 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.084 0.401 . . . . 0.0 112.084 -179.441 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.634 HD21 HG13 ' A' ' 31' ' ' VAL . 0.1 OUTLIER -75.36 -51.13 13.88 Favored 'General case' 0 CA--C 1.517 -0.29 0 C-N-CA 119.879 -0.728 . . . . 0.0 111.102 -179.692 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.819 HG13 ' NZ ' ' A' ' 114' ' ' LYS . 8.8 p -73.92 -4.83 5.89 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 113.569 0.951 . . . . 0.0 113.569 -178.293 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.433 ' HG2' ' CE ' ' A' ' 114' ' ' LYS . 5.9 mm-40 -93.38 -4.71 50.98 Favored 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.443 -0.503 . . . . 0.0 111.221 179.544 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -153.34 -40.53 0.1 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.694 0.283 . . . . 0.0 111.278 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -89.45 -66.7 0.9 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.751 0.31 . . . . 0.0 111.268 -179.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.767 ' CB ' HD13 ' A' ' 110' ' ' LEU . 0.7 OUTLIER -69.77 -32.74 71.4 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.853 -179.827 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 76.22 -56.23 3.21 Favored Glycine 0 CA--C 1.52 0.368 0 C-N-CA 120.954 -0.641 . . . . 0.0 113.67 179.118 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.471 ' HA ' ' CG2' ' A' ' 16' ' ' VAL . 0.1 OUTLIER -176.92 8.31 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.444 0 CA-C-N 116.701 0.25 . . . . 0.0 111.635 -179.158 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.418 ' O ' ' O ' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -56.49 -152.88 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.048 -179.599 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.676 HG21 ' HB2' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -103.62 153.16 20.92 Favored 'General case' 0 CA--C 1.52 -0.187 0 C-N-CA 120.542 -0.463 . . . . 0.0 110.34 -179.871 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.455 ' CA ' ' HG ' ' A' ' 110' ' ' LEU . . . -113.17 124.95 6.79 Favored Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.337 -0.935 . . . . 0.0 113.459 -178.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.698 ' HG3' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -109.01 127.78 54.38 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 178.483 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 1.02 ' HB3' ' HA ' ' A' ' 31' ' ' VAL . 0.4 OUTLIER -164.02 165.91 22.01 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 114.864 1.431 . . . . 0.0 114.864 -178.08 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 5.0 mpt_? -142.65 -48.03 0.33 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 113.226 -1.806 . . . . 0.0 108.526 177.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.415 ' O ' ' HB2' ' A' ' 3' ' ' LEU . . . -130.74 4.53 5.78 Favored Glycine 0 CA--C 1.524 0.621 0 CA-C-N 115.054 -0.976 . . . . 0.0 110.752 177.468 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.799 ' O ' ' CB ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -166.36 157.41 12.94 Favored 'General case' 0 C--O 1.222 -0.372 0 N-CA-C 107.291 -1.374 . . . . 0.0 107.291 -179.992 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 1.139 HG12 ' HG3' ' A' ' 11' ' ' GLN . 8.8 p -102.36 131.65 50.02 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 122.179 0.99 . . . . 0.0 113.22 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.698 ' HB3' ' HG3' ' A' ' 26' ' ' LYS . . . -113.38 166.0 11.91 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 113.407 -1.724 . . . . 0.0 109.411 178.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.578 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -103.3 135.5 44.81 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.306 0.574 . . . . 0.0 111.785 -178.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.486 ' ND2' ' CE2' ' A' ' 39' ' ' PHE . 28.9 t30 -116.02 117.82 31.19 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.679 -179.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -123.05 -31.26 3.64 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.743 179.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 10.0 tt0 -61.01 -54.45 44.82 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.523 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.419 ' HB ' ' CE1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -83.65 -166.13 1.31 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.96 -0.563 . . . . 0.0 110.355 179.596 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 35.8 p -154.54 101.05 2.31 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.887 0.375 . . . . 0.0 111.441 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.772 ' O ' HG22 ' A' ' 109' ' ' THR . 1.6 m-85 -113.98 127.96 56.18 Favored 'General case' 0 C--N 1.328 -0.37 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.833 179.191 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 1.3 pm0 -118.04 -35.01 3.97 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.265 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.58 ' HA3' ' HB3' ' A' ' 87' ' ' ASN . . . 171.54 -14.89 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.891 -0.671 . . . . 0.0 113.412 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.724 HD21 ' HB2' ' A' ' 48' ' ' ALA . 0.1 OUTLIER -44.75 174.0 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 117.332 0.566 . . . . 0.0 111.834 -179.799 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.521 HG22 ' O ' ' A' ' 43' ' ' THR . 20.8 m -109.72 46.61 1.0 Allowed 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -178.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.833 HD11 ' HE3' ' A' ' 53' ' ' LYS . 0.7 OUTLIER 59.94 -5.33 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 N-CA-C 112.939 0.718 . . . . 0.0 112.939 179.244 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.443 ' H ' ' C ' ' A' ' 43' ' ' THR . . . -63.76 -64.09 0.99 Allowed 'General case' 0 CA--C 1.522 -0.13 0 CA-C-O 120.969 0.414 . . . . 0.0 110.621 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.5 t -46.44 -41.64 14.15 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.962 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 151.55 37.16 0.03 OUTLIER Glycine 0 CA--C 1.519 0.314 0 C-N-CA 120.46 -0.876 . . . . 0.0 113.432 179.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.931 ' HB1' ' OE1' ' A' ' 52' ' ' GLU . . . -90.82 -171.27 2.97 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 117.151 0.476 . . . . 0.0 111.281 179.75 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.42 ' HG3' ' CZ ' ' A' ' 39' ' ' PHE . 12.4 mtp85 -115.94 -165.97 1.09 Allowed 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.523 -179.545 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.859 ' O ' HG22 ' A' ' 54' ' ' VAL . 0.6 OUTLIER -95.27 -52.45 4.17 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.311 -0.404 . . . . 0.0 112.012 -179.259 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.545 ' O ' HG23 ' A' ' 54' ' ' VAL . 1.4 p -39.96 -40.33 1.0 Allowed 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.098 0.475 . . . . 0.0 111.312 -179.592 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.931 ' OE1' ' HB1' ' A' ' 48' ' ' ALA . 0.0 OUTLIER -63.02 -66.21 0.57 Allowed 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.491 179.66 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.833 ' HE3' HD11 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -46.33 -55.62 7.03 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.881 179.936 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.859 HG22 ' O ' ' A' ' 50' ' ' GLU . 0.2 OUTLIER -54.07 -39.83 43.44 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.522 0 N-CA-C 109.745 -0.465 . . . . 0.0 109.745 179.184 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.928 ' CE1' HD21 ' A' ' 27' ' ' LEU . 1.3 t80 -52.78 -49.03 66.38 Favored 'General case' 0 C--O 1.231 0.132 0 CA-C-N 116.126 -0.488 . . . . 0.0 109.735 178.42 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.743 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -58.99 -42.81 90.93 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.305 179.119 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -58.69 -43.09 89.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.807 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.598 HG23 ' O ' ' A' ' 54' ' ' VAL . 27.2 p -64.54 -60.36 3.23 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.162 -179.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.947 HG23 HD12 ' A' ' 117' ' ' LEU . 8.9 p -60.72 -47.53 92.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.532 -179.523 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 1.04 HD13 HD23 ' A' ' 103' ' ' LEU . 6.0 tp -58.45 -43.0 88.66 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.67 0.271 . . . . 0.0 111.409 -179.569 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 9.9 t -75.3 -34.61 61.31 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.289 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . 0.614 ' HB3' HD22 ' A' ' 5' ' ' LEU . 0.1 OUTLIER -70.01 -25.22 63.48 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-O 120.727 0.298 . . . . 0.0 110.323 179.521 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 1.077 HG12 ' HB2' ' A' ' 120' ' ' ALA . 28.0 m -91.93 -55.55 6.06 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.233 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.179 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.551 ' N ' HG23 ' A' ' 63' ' ' VAL . . . 29.88 36.66 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 O-C-N 123.38 0.425 . . . . 0.0 112.009 179.78 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.62 ' O ' HG22 ' A' ' 66' ' ' VAL . 4.5 m-20 160.25 -84.45 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 112.262 0.468 . . . . 0.0 112.262 -179.031 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.62 HG22 ' O ' ' A' ' 65' ' ' ASN . 22.9 m 50.97 -160.56 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.382 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.59 -178.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.492 ' O ' ' O ' ' A' ' 98' ' ' SER . 7.3 p -147.34 -15.48 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.484 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 -178.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.899 HD22 HD11 ' A' ' 76' ' ' LEU . 0.4 OUTLIER 29.58 95.06 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.426 0.899 . . . . 0.0 113.426 178.81 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.408 HG21 ' CZ ' ' A' ' 122' ' ' ARG . 79.4 p -62.53 -161.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 178.619 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.4 ' HG3' ' O ' ' A' ' 96' ' ' GLY . 0.1 OUTLIER -60.08 -36.52 77.56 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.03 0.443 . . . . 0.0 110.393 179.744 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.474 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 13.7 tt0 -62.72 -65.34 0.7 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.242 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.686 ' O ' HD12 ' A' ' 76' ' ' LEU . 1.3 m-20 -53.26 -36.89 61.62 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.969 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.502 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 85.4 m -57.29 -65.25 0.66 Allowed 'General case' 0 C--O 1.238 0.455 0 N-CA-C 109.07 -0.715 . . . . 0.0 109.07 178.644 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.86 -25.97 57.67 Favored 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 109.206 -0.664 . . . . 0.0 109.206 177.642 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 1.069 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -59.06 -51.43 70.1 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 115.045 -0.98 . . . . 0.0 109.723 178.715 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.899 HD11 HD22 ' A' ' 68' ' ' LEU . 1.2 mp -64.44 -49.68 70.5 Favored 'General case' 0 C--O 1.232 0.166 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 178.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.72 ' O ' HG12 ' A' ' 81' ' ' VAL . 2.8 mt -57.08 -32.92 66.75 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.426 179.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.44 ' HA ' HG12 ' A' ' 81' ' ' VAL . 0.1 OUTLIER -69.16 -49.21 58.8 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.686 179.798 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . 0.423 ' O ' ' CG ' ' A' ' 83' ' ' HIS . 0.0 OUTLIER -61.17 -30.94 70.71 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.466 179.706 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.534 HG23 ' CZ ' ' A' ' 88' ' ' TYR . 0.6 OUTLIER -81.3 -61.19 2.02 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.207 179.953 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.72 HG12 ' O ' ' A' ' 77' ' ' LEU . 13.8 p -52.06 -33.56 16.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.767 -179.424 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.19 5.51 46.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.692 -179.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.423 ' CG ' ' O ' ' A' ' 79' ' ' SER . 6.4 m80 -121.92 -177.65 3.63 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.876 0.369 . . . . 0.0 110.991 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -64.77 -72.25 0.16 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.111 -179.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.486 HD12 ' C ' ' A' ' 85' ' ' LEU . 2.9 pp -125.0 -179.94 4.77 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.889 0.376 . . . . 0.0 110.961 -179.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.405 ' HB3' ' CG2' ' A' ' 80' ' ' THR . 19.7 p30 -114.22 129.51 56.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.78 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . 0.58 ' HB3' ' HA3' ' A' ' 41' ' ' GLY . 9.4 p-10 -107.42 -18.48 13.85 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.428 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.661 ' CD1' HD23 ' A' ' 76' ' ' LEU . 4.4 p90 -104.52 145.99 29.51 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 119.981 -0.687 . . . . 0.0 110.817 179.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.718 ' HB3' ' O ' ' A' ' 101' ' ' VAL . 0.5 OUTLIER -109.45 141.56 41.69 Favored 'General case' 0 N--CA 1.436 -1.145 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.184 -179.056 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.821 HD11 ' CB ' ' A' ' 76' ' ' LEU . 66.4 mt -126.36 165.07 19.7 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.916 0.865 . . . . 0.0 113.289 -177.438 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -153.53 130.15 10.74 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 113.997 -1.456 . . . . 0.0 107.223 178.447 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.704 ' O ' HG13 ' A' ' 93' ' ' VAL . 60.4 p -103.68 145.83 29.48 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 114.16 1.17 . . . . 0.0 114.16 -176.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.704 HG13 ' O ' ' A' ' 92' ' ' SER . 3.7 m -166.21 -122.83 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 CA-C-N 113.553 -1.658 . . . . 0.0 108.621 179.203 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.541 ' O ' ' N ' ' A' ' 96' ' ' GLY . . . 34.51 34.77 0.04 OUTLIER Glycine 0 C--N 1.34 0.758 0 C-N-CA 120.885 -0.674 . . . . 0.0 113.643 178.635 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.414 ' HB3' ' O ' ' A' ' 94' ' ' GLY . 3.2 t30 65.26 -68.66 0.11 Allowed 'General case' 0 C--O 1.231 0.081 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 -178.208 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.541 ' N ' ' O ' ' A' ' 94' ' ' GLY . . . -126.41 24.95 5.5 Favored Glycine 0 N--CA 1.443 -0.841 0 N-CA-C 110.677 -0.969 . . . . 0.0 110.677 177.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.425 ' HB2' HG22 ' A' ' 67' ' ' VAL . 0.0 OUTLIER -124.43 166.07 16.64 Favored 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 120.892 0.377 . . . . 0.0 110.551 -179.801 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.505 ' O ' HD12 ' A' ' 68' ' ' LEU . 11.2 t -142.23 154.18 44.57 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.209 0.528 . . . . 0.0 111.138 -179.656 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.416 HG13 ' N ' ' A' ' 100' ' ' LEU . 1.0 OUTLIER -103.74 159.91 4.79 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.881 0 N-CA-C 108.432 -0.951 . . . . 0.0 108.432 178.772 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.796 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 0.1 OUTLIER -126.47 113.74 17.23 Favored 'General case' 0 N--CA 1.448 -0.534 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -179.152 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.718 ' O ' ' HB3' ' A' ' 89' ' ' ASP . 0.2 OUTLIER -105.08 108.97 26.2 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.995 0 N-CA-C 103.213 -2.884 . . . . 0.0 103.213 174.481 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.781 ' O ' ' HB2' ' A' ' 103' ' ' LEU . 13.8 p -138.54 165.11 27.7 Favored 'General case' 0 C--N 1.31 -1.113 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -173.243 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 1.04 HD23 HD13 ' A' ' 60' ' ' LEU . 0.9 OUTLIER 126.74 82.55 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 112.508 -2.133 . . . . 0.0 112.658 176.61 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.447 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -104.65 19.14 20.94 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.619 -1.173 . . . . 0.0 108.284 177.441 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.691 ' O ' HD13 ' A' ' 103' ' ' LEU . 3.5 m 157.97 175.25 0.01 OUTLIER 'General case' 0 C--O 1.231 0.116 0 N-CA-C 107.14 -1.43 . . . . 0.0 107.14 -179.046 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.421 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.6 OUTLIER -106.69 101.95 11.36 Favored 'General case' 0 C--N 1.328 -0.333 0 C-N-CA 119.596 -0.842 . . . . 0.0 112.097 -178.988 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.743 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 1.1 mt-30 -169.04 163.47 11.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.612 178.147 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.597 ' HB2' ' HB2' ' A' ' 56' ' ' ALA . 1.0 OUTLIER -165.71 133.71 3.01 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.395 0.617 . . . . 0.0 112.347 178.76 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.772 HG22 ' O ' ' A' ' 39' ' ' PHE . 0.8 OUTLIER -103.24 159.8 15.23 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 114.983 -1.008 . . . . 0.0 109.316 178.823 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.767 HD13 ' CB ' ' A' ' 20' ' ' SER . 17.1 mt -46.91 -62.88 1.2 Allowed 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 121.222 -0.191 . . . . 0.0 110.92 -179.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.979 ' O ' HG23 ' A' ' 115' ' ' VAL . 6.5 tp60 -44.38 -62.07 1.3 Allowed 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 120.76 0.314 . . . . 0.0 110.499 179.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.452 ' O ' ' HB ' ' A' ' 115' ' ' VAL . 0.8 OUTLIER -45.42 -47.76 13.67 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-O 121.373 0.606 . . . . 0.0 110.436 179.529 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.591 ' CB ' ' CZ ' ' A' ' 55' ' ' PHE . . . -58.83 -65.74 0.61 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 115.468 -0.787 . . . . 0.0 110.923 179.772 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.819 ' NZ ' HG13 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -52.21 -25.72 9.88 Favored 'General case' 0 C--N 1.333 -0.113 0 C-N-CA 121.06 -0.256 . . . . 0.0 110.898 179.825 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 1.069 HG22 ' CG ' ' A' ' 75' ' ' LYS . 88.2 t -64.39 -65.03 0.58 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.767 0 CA-C-O 122.082 0.944 . . . . 0.0 109.636 178.616 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.878 ' HB3' HG11 ' A' ' 63' ' ' VAL . 1.7 mp -63.59 -34.06 76.98 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 114.572 -1.194 . . . . 0.0 109.678 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 1.101 HD21 HD23 ' A' ' 8' ' ' LEU . 0.2 OUTLIER -72.67 -23.08 60.84 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.97 179.691 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.48 ' HA ' ' CE1' ' A' ' 9' ' ' HIS . 5.7 tt0 -71.84 -44.17 64.29 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 106.521 -1.659 . . . . 0.0 106.521 177.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.546 ' HB1' ' H ' ' A' ' 68' ' ' LEU . . . -77.9 -19.11 55.32 Favored 'General case' 0 N--CA 1.446 -0.646 0 CA-C-N 114.151 -1.386 . . . . 0.0 110.11 177.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 1.077 ' HB2' HG12 ' A' ' 63' ' ' VAL . . . -81.19 -48.07 12.59 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.928 179.557 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.916 HD22 ' CD2' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -68.8 -30.52 69.11 Favored 'General case' 0 N--CA 1.445 -0.704 0 N-CA-C 108.948 -0.76 . . . . 0.0 108.948 178.697 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.451 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 1.0 OUTLIER -74.08 -50.4 19.78 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 115.615 -0.72 . . . . 0.0 112.29 -179.404 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.08 -31.98 13.32 Favored 'General case' 0 N--CA 1.465 0.282 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -177.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -92.1 -65.61 0.99 Allowed 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -178.759 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.46 ' CB ' ' HA ' ' A' ' 121' ' ' LEU . 3.9 t -60.61 -59.05 6.02 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.614 -178.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . 0.472 ' C ' ' N ' ' A' ' 128' ' ' ARG . . . 53.84 47.88 63.93 Favored Glycine 0 CA--C 1.495 -1.193 0 C-N-CA 120.301 -0.952 . . . . 0.0 111.645 -179.04 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . 45.92 26.23 0.37 Allowed 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 -177.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . 0.472 ' N ' ' C ' ' A' ' 126' ' ' GLY . 0.0 OUTLIER -114.88 -60.13 1.93 Allowed 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 114.739 -1.119 . . . . 0.0 111.208 -178.205 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . -86.16 52.32 4.51 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 120.639 -0.791 . . . . 0.0 112.739 -179.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 15.3 p . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.879 179.888 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.134 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 202' ' ' ASP . . . . . 0.438 ' O ' ' N ' ' B' ' 204' ' ' PTR . 15.5 m-20 -109.45 -84.62 0.55 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.542 0.21 . . . . 0.0 110.895 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 63.93 -73.01 0.05 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.03 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 204' ' ' PTR . . . . . 0.447 ' CD2' ' ND2' ' A' ' 30' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -43.47 -88.39 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.877 -179.207 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 206' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -110.89 156.93 39.96 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-O 120.745 0.307 . . . . 0.0 110.919 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . 0.411 ' HB3' ' OE1' ' A' ' 11' ' ' GLN . 19.3 Cg_endo -57.09 -177.32 0.07 OUTLIER 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.711 2.274 . . . . 0.0 112.273 179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 208' ' ' PHE . . . . . 0.452 ' CE2' ' HA ' ' A' ' 11' ' ' GLN . 68.9 m-85 61.02 154.93 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.927 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.362 0 CA-C-N 116.49 -0.323 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.765 0.317 . . . . 0.0 111.198 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -116.08 -162.78 0.86 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.846 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.708 ' HB2' HD13 ' A' ' 8' ' ' LEU . 10.5 mp -90.01 164.88 14.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.679 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 51.4 p -60.95 -162.77 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.271 179.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 1.017 HD21 ' HB1' ' A' ' 120' ' ' ALA . 0.0 OUTLIER -93.5 -61.25 1.59 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.619 0.247 . . . . 0.0 111.391 179.811 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.441 ' HB3' ' N ' ' A' ' 129' ' ' GLY . 1.9 p -47.33 -51.06 20.49 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -179.062 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -65.99 -55.72 15.31 Favored 'General case' 0 CA--C 1.517 -0.299 0 CA-C-O 121.164 0.507 . . . . 0.0 110.274 -179.346 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 1.06 HD23 HD21 ' A' ' 117' ' ' LEU . 11.6 tp -52.65 -60.06 3.71 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.425 179.309 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.762 ' ND1' HD13 ' A' ' 121' ' ' LEU . 1.7 t-80 -45.63 -56.43 5.2 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 115.729 -0.669 . . . . 0.0 110.111 178.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.5 -43.42 71.78 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.172 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.525 ' HA ' ' CE2' ' B' ' 208' ' ' PHE . 19.9 tp60 -58.86 -65.35 0.68 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.668 179.361 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.643 HG23 HD23 ' A' ' 110' ' ' LEU . 9.2 p -56.56 -45.8 82.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.422 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.965 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.707 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 8.8 t -60.49 -55.09 37.64 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.454 179.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.3 ttp180 -63.99 -22.73 67.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.091 -179.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.484 ' CD1' HG13 ' A' ' 31' ' ' VAL . 7.6 mt -73.16 -63.01 1.27 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.72 -179.535 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.706 HG23 ' HB2' ' A' ' 20' ' ' SER . 0.8 OUTLIER -70.3 -27.0 30.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.3 -179.538 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.403 ' HB2' ' O ' ' A' ' 13' ' ' SER . 8.1 mm-40 -78.14 -16.6 57.79 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.471 -0.332 . . . . 0.0 111.167 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -144.78 42.25 1.33 Allowed 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.66 -0.416 . . . . 0.0 111.84 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER 173.56 -69.01 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 179.561 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.721 ' CB ' HD13 ' A' ' 110' ' ' LEU . 14.9 m -70.8 -31.75 68.6 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.574 0.583 . . . . 0.0 112.574 -178.088 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.458 ' C ' HG22 ' A' ' 16' ' ' VAL . . . 78.04 -57.8 3.96 Favored Glycine 0 CA--C 1.521 0.462 0 C-N-CA 120.465 -0.874 . . . . 0.0 112.933 179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.638 ' N ' HG22 ' A' ' 16' ' ' VAL . 0.4 OUTLIER -177.3 30.42 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 120.831 0.348 . . . . 0.0 111.05 -179.879 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -74.81 -157.96 0.07 Allowed 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.938 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.548 ' HB ' ' HB3' ' A' ' 34' ' ' ASN . 4.2 m -103.53 145.17 30.43 Favored 'General case' 0 C--O 1.231 0.108 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 179.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.432 ' HA2' ' O ' ' A' ' 32' ' ' ALA . . . -104.62 134.01 11.8 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.332 -0.937 . . . . 0.0 113.706 -178.46 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 1.0 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -104.96 128.87 53.42 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.443 -0.577 . . . . 0.0 109.443 178.932 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.875 HD22 HG21 ' A' ' 58' ' ' THR . 0.9 OUTLIER -104.82 146.55 28.83 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.378 0.608 . . . . 0.0 112.139 -178.863 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.496 HH21 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER 169.22 55.47 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 114.924 -1.035 . . . . 0.0 108.965 179.839 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.509 ' O ' HD11 ' A' ' 3' ' ' LEU . . . 87.52 -5.48 84.95 Favored Glycine 0 CA--C 1.52 0.348 0 N-CA-C 111.231 -0.747 . . . . 0.0 111.231 -177.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.4 ' ND2' ' C ' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -165.46 165.07 19.42 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 179.838 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.484 HG13 ' CD1' ' A' ' 15' ' ' LEU . 0.7 OUTLIER -112.76 120.96 64.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 121.432 0.634 . . . . 0.0 111.213 179.411 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 1.0 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -110.51 166.34 11.07 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.866 -1.061 . . . . 0.0 110.273 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.671 ' HB2' ' OG ' ' A' ' 20' ' ' SER . . . -103.58 137.43 41.65 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.221 0.534 . . . . 0.0 111.952 -178.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.58 HD21 HG23 ' A' ' 37' ' ' THR . 5.8 t30 -119.04 121.33 39.61 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.452 -0.794 . . . . 0.0 110.302 179.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 14.3 ttpp -121.78 -28.72 4.45 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.146 -179.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -51.17 -77.19 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.458 -0.337 . . . . 0.0 110.961 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.58 HG23 HD21 ' A' ' 34' ' ' ASN . 7.9 t -77.45 -176.51 4.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.465 179.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 78.2 p -136.42 107.69 6.83 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.85 0.357 . . . . 0.0 111.235 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.635 ' CD1' HG23 ' A' ' 109' ' ' THR . 0.0 OUTLIER -61.18 -178.77 0.12 Allowed 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.19 179.62 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.472 ' N ' ' CG ' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -171.64 22.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.772 0.32 . . . . 0.0 111.568 179.6 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.52 ' O ' ' CB ' ' A' ' 105' ' ' SER . . . 79.16 -17.0 8.03 Favored Glycine 0 C--O 1.228 -0.255 0 CA-C-O 119.754 -0.47 . . . . 0.0 113.176 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.642 HD12 ' H ' ' A' ' 43' ' ' THR . 0.1 OUTLIER -48.08 178.15 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 117.235 0.517 . . . . 0.0 111.361 -179.935 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.678 ' C ' HD12 ' A' ' 44' ' ' ILE . 29.3 m -118.21 57.49 0.84 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.753 0.311 . . . . 0.0 111.67 -179.043 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.678 HD12 ' C ' ' A' ' 43' ' ' THR . 3.3 mp 69.93 -58.76 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.714 179.592 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.489 ' C ' ' O ' ' A' ' 44' ' ' ILE . . . -18.54 -77.27 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 112.68 0.622 . . . . 0.0 112.68 -179.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.61 ' HB2' HD13 ' A' ' 42' ' ' LEU . 58.8 m -43.86 -59.36 2.29 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.429 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 168.8 51.6 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.427 -0.892 . . . . 0.0 113.061 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.531 ' HB2' ' CD2' ' A' ' 42' ' ' LEU . . . -110.99 172.7 6.72 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.893 0.377 . . . . 0.0 111.053 179.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.476 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 2.2 tpm_? -91.49 158.5 16.44 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.978 -0.555 . . . . 0.0 110.713 179.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.707 ' O ' HG23 ' A' ' 54' ' ' VAL . 0.8 OUTLIER -71.92 -22.96 61.41 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.046 0.451 . . . . 0.0 110.494 179.507 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.536 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 59.9 p -63.3 -62.81 1.44 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.256 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.585 ' HB2' ' HG2' ' A' ' 107' ' ' GLN . 1.5 pm0 -44.86 -60.69 1.92 Allowed 'General case' 0 N--CA 1.463 0.189 0 CA-C-O 120.592 0.234 . . . . 0.0 111.414 -179.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.579 ' HG2' HD11 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -52.35 -50.71 61.79 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.702 -0.226 . . . . 0.0 110.997 179.931 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.941 ' O ' HG23 ' A' ' 58' ' ' THR . 73.5 t -57.55 -39.43 69.32 Favored 'Isoleucine or valine' 0 C--O 1.231 0.105 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 178.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.518 ' O ' HG12 ' A' ' 59' ' ' VAL . 0.3 OUTLIER -61.48 -45.15 95.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.19 -0.914 . . . . 0.0 109.581 178.756 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.641 ' HB2' ' C ' ' A' ' 107' ' ' GLN . . . -55.11 -45.82 75.52 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.577 179.337 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 3.7 mm100 -64.3 -41.96 96.59 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.045 179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.941 HG23 ' O ' ' A' ' 54' ' ' VAL . 9.9 p -61.56 -57.78 10.72 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.882 -179.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 1.044 HG23 HD12 ' A' ' 117' ' ' LEU . 8.7 p -65.24 -49.72 77.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.08 -179.888 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.819 HD13 HD23 ' A' ' 103' ' ' LEU . 6.2 tp -50.79 -40.2 54.63 Favored 'General case' 0 C--O 1.231 0.125 0 C-N-CA 120.793 -0.363 . . . . 0.0 110.394 179.497 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 70.2 m -67.83 -53.49 26.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.331 179.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . 0.482 ' HB3' ' CD2' ' A' ' 5' ' ' LEU . 0.3 OUTLIER -60.83 -20.63 62.04 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 121.079 0.466 . . . . 0.0 110.299 179.598 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 1.086 HG13 HG11 ' A' ' 66' ' ' VAL . 3.4 t -109.61 55.07 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.491 179.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.493 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . -81.04 39.6 0.51 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.44 -179.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.621 ' HA ' HG13 ' A' ' 99' ' ' VAL . 3.9 m-20 153.63 -65.38 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 122.652 0.381 . . . . 0.0 111.123 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 1.086 HG11 HG13 ' A' ' 63' ' ' VAL . 35.5 m 42.36 -171.09 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.5 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -179.699 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.748 HG13 ' HG3' ' A' ' 123' ' ' GLN . 16.8 m -145.2 67.64 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.973 0 CA-C-O 121.133 0.492 . . . . 0.0 110.877 -178.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.713 ' N ' ' O ' ' A' ' 98' ' ' SER . 0.7 OUTLIER -60.24 107.73 0.69 Allowed 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 115.853 -0.612 . . . . 0.0 111.995 -179.391 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.651 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 7.2 p -80.17 177.62 8.82 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.244 179.197 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -35.42 -37.05 0.08 Allowed 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.952 0.406 . . . . 0.0 111.401 -179.645 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.467 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 4.8 tp10 -68.38 -65.11 0.74 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.023 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.699 ' HB3' HD23 ' A' ' 68' ' ' LEU . 65.0 m-20 -58.75 -32.26 69.1 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.414 -179.622 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -64.46 -57.82 8.17 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.626 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.528 ' HA ' ' CG ' ' A' ' 77' ' ' LEU . . . -56.24 -27.88 56.54 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 177.019 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 1.073 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.4 OUTLIER -61.78 -49.08 77.81 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 114.334 -1.303 . . . . 0.0 110.976 179.184 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.765 HD13 HD23 ' A' ' 90' ' ' LEU . 0.3 OUTLIER -68.27 -52.63 31.63 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 120.775 0.322 . . . . 0.0 110.729 179.572 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.57 ' O ' HG12 ' A' ' 81' ' ' VAL . 3.8 pp -60.61 -26.86 67.31 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.095 -179.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.582 ' HA ' HG12 ' A' ' 81' ' ' VAL . 34.0 tt0 -75.87 -47.96 23.33 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.16 0.505 . . . . 0.0 110.4 179.311 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 3.1 t -61.1 -33.24 73.04 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.94 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.5 HG22 ' HA ' ' A' ' 77' ' ' LEU . 14.2 t -84.36 -46.82 11.34 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.614 -179.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.582 HG12 ' HA ' ' A' ' 78' ' ' GLN . 7.4 p -63.32 -30.53 49.99 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-O 120.72 0.295 . . . . 0.0 111.581 -179.48 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.91 -60.89 2.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.05 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 2.8 t60 -162.55 87.73 0.61 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.684 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.461 ' ND2' ' CZ ' ' A' ' 39' ' ' PHE . 8.9 t-20 -164.53 178.17 7.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.116 -179.781 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 19.2 tp -111.08 31.32 6.14 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.964 -0.562 . . . . 0.0 110.764 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 36.4 m120 55.38 88.12 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.594 -179.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . 0.403 ' ND2' ' HA3' ' A' ' 41' ' ' GLY . 2.3 p-10 -120.56 -10.36 9.25 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.894 -179.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.642 ' CE1' ' HE3' ' A' ' 108' ' ' MET . 25.8 m-85 -100.64 139.94 35.61 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 120.399 -0.52 . . . . 0.0 110.924 -179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.761 ' CG ' HG13 ' A' ' 101' ' ' VAL . 1.0 OUTLIER -117.3 149.77 39.9 Favored 'General case' 0 N--CA 1.428 -1.529 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 -179.267 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.767 HD12 ' N ' ' A' ' 90' ' ' LEU . 0.0 OUTLIER -149.36 161.72 41.5 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-O 121.693 0.758 . . . . 0.0 112.696 -178.883 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.42 ' O ' ' HB3' ' A' ' 98' ' ' SER . 2.6 ptm180 -140.95 135.29 31.05 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 114.501 -1.227 . . . . 0.0 108.062 178.301 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.561 ' O ' HG13 ' A' ' 93' ' ' VAL . 26.4 p -104.9 146.49 28.94 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 113.85 1.055 . . . . 0.0 113.85 -177.604 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.561 HG13 ' O ' ' A' ' 92' ' ' SER . 6.7 m -161.91 -131.33 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.643 0 CA-C-N 113.889 -1.505 . . . . 0.0 108.536 178.633 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.506 ' O ' ' O ' ' A' ' 93' ' ' VAL . . . 47.89 176.25 0.01 OUTLIER Glycine 0 N--CA 1.445 -0.731 0 C-N-CA 120.468 -0.872 . . . . 0.0 112.683 179.135 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -84.81 45.23 1.13 Allowed 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 176.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.455 ' O ' ' HB ' ' A' ' 69' ' ' THR . . . 114.38 43.71 0.75 Allowed Glycine 0 N--CA 1.441 -0.968 0 N-CA-C 109.141 -1.583 . . . . 0.0 109.141 -176.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.651 ' HA ' ' HA ' ' A' ' 69' ' ' THR . 0.1 OUTLIER -142.2 167.15 22.8 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 109.417 -0.586 . . . . 0.0 109.417 -178.703 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.713 ' O ' ' N ' ' A' ' 68' ' ' LEU . 3.0 m -148.42 157.16 43.3 Favored 'General case' 0 N--CA 1.433 -1.283 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.914 -178.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.621 HG13 ' HA ' ' A' ' 65' ' ' ASN . 2.5 t -104.08 150.17 7.41 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.043 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -179.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.714 HD13 ' CG ' ' A' ' 116' ' ' LEU . 0.1 OUTLIER -103.91 127.77 51.43 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-O 122.059 0.933 . . . . 0.0 113.198 -178.505 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.761 HG13 ' CG ' ' A' ' 89' ' ' ASP . 1.5 p -131.7 104.12 8.04 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.018 0 N-CA-C 104.295 -2.483 . . . . 0.0 104.295 174.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.688 ' O ' HD23 ' A' ' 103' ' ' LEU . 32.8 p -148.22 165.28 31.42 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 118.785 -1.166 . . . . 0.0 113.653 -174.621 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.872 HD13 ' O ' ' A' ' 105' ' ' SER . 0.2 OUTLIER 157.2 -83.34 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 113.661 -1.609 . . . . 0.0 111.73 176.509 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.501 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 52.4 28.12 5.53 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -179.162 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.872 ' O ' HD13 ' A' ' 103' ' ' LEU . 13.3 m 140.04 165.96 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 -178.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.421 ' HB3' ' HB2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -104.85 101.92 11.49 Favored 'General case' 0 C--N 1.329 -0.302 0 C-N-CA 119.677 -0.809 . . . . 0.0 112.853 -178.093 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.641 ' C ' ' HB2' ' A' ' 56' ' ' ALA . 0.2 OUTLIER -168.61 164.73 12.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.41 177.694 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.642 ' HE3' ' CE1' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -165.58 141.91 5.35 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 121.118 0.485 . . . . 0.0 111.885 179.293 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.635 HG23 ' CD1' ' A' ' 39' ' ' PHE . 0.8 OUTLIER -104.32 165.22 11.2 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.258 179.47 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.721 HD13 ' CB ' ' A' ' 20' ' ' SER . 3.4 mt -49.19 -58.04 5.69 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.692 0.282 . . . . 0.0 110.502 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.953 ' O ' HG23 ' A' ' 115' ' ' VAL . 2.6 tp60 -50.42 -64.77 0.71 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.849 0.357 . . . . 0.0 110.839 179.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.475 ' O ' ' HB ' ' A' ' 115' ' ' VAL . 0.8 OUTLIER -44.34 -46.67 9.41 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-O 121.17 0.51 . . . . 0.0 110.95 179.847 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.603 ' HB3' HG21 ' A' ' 12' ' ' VAL . . . -55.6 -62.45 1.68 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.424 179.416 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.707 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 3.8 ptpp? -57.83 -27.01 62.8 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.037 179.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 1.073 HG22 ' CG ' ' A' ' 75' ' ' LYS . 99.4 t -61.05 -62.66 1.01 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.728 0 CA-C-O 122.149 0.976 . . . . 0.0 110.25 179.569 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.936 ' HB3' HG21 ' A' ' 63' ' ' VAL . 0.1 OUTLIER -68.64 -32.7 72.75 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.156 -179.199 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 1.06 HD21 HD23 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -73.37 -22.9 60.17 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 120.901 0.382 . . . . 0.0 110.49 179.359 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.565 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 2.2 tp10 -72.49 -43.44 63.66 Favored 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 106.243 -1.762 . . . . 0.0 106.243 177.09 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.467 ' HB1' ' HB ' ' A' ' 66' ' ' VAL . . . -75.46 -22.55 57.19 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 114.309 -1.314 . . . . 0.0 109.881 177.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 1.017 ' HB1' HD21 ' A' ' 5' ' ' LEU . . . -79.45 -49.93 11.57 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.503 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.762 HD13 ' ND1' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -63.91 -38.32 90.64 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.86 179.806 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.565 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -79.72 -33.93 40.47 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 112.571 0.582 . . . . 0.0 112.571 -179.285 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.748 ' HG3' HG13 ' A' ' 67' ' ' VAL . 12.1 tm0? -95.12 -19.43 20.12 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -177.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -93.6 -68.76 0.78 Allowed 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 119.743 -0.783 . . . . 0.0 111.976 -178.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.482 ' HB2' ' HA2' ' A' ' 129' ' ' GLY . 2.0 t -98.63 -65.43 0.96 Allowed 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.649 0.737 . . . . 0.0 111.31 179.271 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 102.43 94.16 2.25 Favored Glycine 0 CA--C 1.494 -1.272 0 CA-C-N 114.594 -1.185 . . . . 0.0 111.747 -179.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . 52.27 21.84 1.79 Allowed 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 -177.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -150.33 17.06 0.83 Allowed 'General case' 0 N--CA 1.441 -0.906 0 CA-C-N 115.478 -0.783 . . . . 0.0 112.616 -179.285 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . 0.482 ' HA2' ' HB2' ' A' ' 125' ' ' SER . . . -65.33 75.55 0.09 OUTLIER Glycine 0 N--CA 1.452 -0.239 0 C-N-CA 120.787 -0.72 . . . . 0.0 112.615 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 35.3 m . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.224 -0.893 . . . . 0.0 110.848 179.814 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.155 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -129.9 31.53 4.69 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.866 0.365 . . . . 0.0 110.925 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 62.62 122.25 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.891 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 204' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 57.6 38.15 27.72 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.825 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 206' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -127.05 58.26 28.51 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.986 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -53.53 149.54 30.64 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.541 2.161 . . . . 0.0 111.721 179.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 208' ' ' PHE . . . . . 0.525 ' CE2' ' HA ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -61.89 -116.51 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.988 -179.907 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 209' ' ' NH2 . . . . . 0.464 ' N ' ' CD1' ' B' ' 208' ' ' PHE . . . . . . . . 0 C--N 1.33 -0.279 0 O-C-N 122.416 -0.177 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.6 mmt . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.824 0.345 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.421 ' ND2' HG23 ' A' ' 58' ' ' THR . 6.0 p-10 -148.37 -165.39 2.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.868 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.833 ' HB2' HD13 ' A' ' 8' ' ' LEU . 4.7 mp -78.18 -175.29 4.06 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.623 179.674 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -103.04 153.13 20.57 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.01 179.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.756 ' HA ' HD23 ' A' ' 117' ' ' LEU . 75.4 mt -47.02 -61.83 1.69 Allowed 'General case' 0 CA--C 1.509 -0.607 0 CA-C-O 121.499 0.666 . . . . 0.0 110.993 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.546 ' HA ' HD13 ' A' ' 121' ' ' LEU . 5.2 t -42.77 -61.6 1.22 Allowed 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.278 -179.282 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -69.57 -56.74 6.48 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-O 120.971 0.415 . . . . 0.0 110.867 -179.42 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 1.056 HD23 HD21 ' A' ' 117' ' ' LEU . 23.5 tp -45.54 -45.84 13.66 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.747 -0.661 . . . . 0.0 110.751 179.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.748 ' CG ' HD22 ' A' ' 121' ' ' LEU . 56.4 t-80 -66.06 -40.27 90.77 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.424 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.4 -53.74 41.06 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 114.776 -1.102 . . . . 0.0 111.198 179.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.98 ' HG3' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -69.16 -55.39 10.79 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-O 120.791 0.329 . . . . 0.0 111.235 -179.795 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.875 HG22 HD13 ' A' ' 110' ' ' LEU . 3.8 p -51.9 -49.63 36.59 Favored 'Isoleucine or valine' 0 C--O 1.242 0.694 0 CA-C-O 121.22 0.533 . . . . 0.0 110.659 179.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.785 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 52.9 m -62.73 -41.89 99.4 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.564 -0.743 . . . . 0.0 110.557 179.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.475 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 0.0 OUTLIER -67.25 -17.7 64.91 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.385 179.629 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.841 HD12 ' HA ' ' A' ' 12' ' ' VAL . 6.1 mt -83.14 -61.43 1.86 Allowed 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -179.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.566 ' CG2' ' HB3' ' A' ' 110' ' ' LEU . 0.9 OUTLIER -69.38 -34.27 61.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 C-N-CA 120.015 -0.674 . . . . 0.0 111.34 -179.068 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.45 ' HB2' ' O ' ' A' ' 13' ' ' SER . 3.5 mm-40 -69.62 -16.16 63.33 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.176 -179.507 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.475 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 2.8 pt20 -163.57 56.86 0.17 Allowed 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 120.854 -0.338 . . . . 0.0 111.44 179.301 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 176.52 -63.1 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.454 179.631 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.609 ' OG ' ' HB1' ' A' ' 33' ' ' ALA . 0.5 OUTLIER -79.08 -80.47 0.12 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.442 -0.344 . . . . 0.0 111.374 -179.324 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.556 ' H ' HG22 ' A' ' 16' ' ' VAL . . . 113.28 -18.7 20.69 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.481 -179.599 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.63 ' O ' ' O ' ' A' ' 23' ' ' CYS . 21.9 p-10 166.46 -14.98 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.395 0 C-N-CA 122.355 0.262 . . . . 0.0 111.388 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.63 ' O ' ' O ' ' A' ' 22' ' ' ASP . 58.0 m -42.13 -164.75 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 123.368 0.667 . . . . 0.0 112.718 -179.386 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.562 ' HA ' ' HA ' ' A' ' 109' ' ' THR . 20.4 m -103.75 162.15 13.33 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.781 -179.387 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.678 ' HA2' HD23 ' A' ' 110' ' ' LEU . . . -105.12 135.7 12.71 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.495 -0.86 . . . . 0.0 113.912 -178.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.945 ' HB3' ' HB3' ' A' ' 32' ' ' ALA . 1.3 tmmm? -104.92 119.52 39.21 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 178.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.65 HD23 ' N ' ' A' ' 28' ' ' ARG . 1.6 tt -104.63 165.25 11.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.629 -0.26 . . . . 0.0 111.665 -178.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.65 ' N ' HD23 ' A' ' 27' ' ' LEU . 0.0 OUTLIER 140.1 56.2 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 124.618 1.167 . . . . 0.0 109.492 -179.862 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.729 ' C ' HD11 ' A' ' 3' ' ' LEU . . . 88.53 -4.94 85.15 Favored Glycine 0 CA--C 1.518 0.274 0 C-N-CA 120.877 -0.678 . . . . 0.0 111.764 -178.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.599 ' HB2' ' HA ' ' B' ' 207' ' ' PRO . 0.0 OUTLIER -165.7 165.46 18.6 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 109.222 -0.659 . . . . 0.0 109.222 -179.95 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.98 HG12 ' HG3' ' A' ' 11' ' ' GLN . 3.7 p -112.58 136.65 48.16 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 121.251 0.548 . . . . 0.0 110.911 178.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.945 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . . . -129.3 167.43 17.72 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.234 -0.894 . . . . 0.0 110.629 -179.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.609 ' HB1' ' OG ' ' A' ' 20' ' ' SER . . . -102.77 121.3 42.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.235 0.541 . . . . 0.0 111.588 -178.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.526 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 2.4 t30 -105.05 115.7 30.72 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.327 -0.851 . . . . 0.0 110.542 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.02 -25.78 15.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.391 -179.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.54 ' O ' ' HB ' ' A' ' 37' ' ' THR . 14.0 mm-40 -42.93 -82.21 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.717 -179.314 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.865 HG23 HG23 ' A' ' 38' ' ' THR . 7.5 t 172.0 -168.79 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 CA-C-O 120.879 0.371 . . . . 0.0 110.945 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.865 HG23 HG23 ' A' ' 37' ' ' THR . 2.8 p 62.77 121.04 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.96 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.713 ' O ' ' HB3' ' A' ' 107' ' ' GLN . 11.3 p90 169.15 -31.67 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.688 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.472 ' N ' ' CD1' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -54.78 67.99 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.602 -0.727 . . . . 0.0 112.478 -178.704 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.605 ' N ' ' O ' ' A' ' 39' ' ' PHE . . . 36.01 87.15 0.01 OUTLIER Glycine 0 C--N 1.332 0.31 0 CA-C-N 116.018 -0.537 . . . . 0.0 113.621 179.032 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.627 HD23 ' HB2' ' A' ' 48' ' ' ALA . 0.1 OUTLIER -141.8 169.99 16.55 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 179.168 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.596 ' C ' HD12 ' A' ' 44' ' ' ILE . 0.7 OUTLIER -103.28 41.31 1.28 Allowed 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 113.127 0.788 . . . . 0.0 113.127 -177.698 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.921 HG23 ' O ' ' A' ' 48' ' ' ALA . 3.4 mp 53.54 5.14 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 179.012 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.433 ' H ' ' C ' ' A' ' 43' ' ' THR . . . -74.41 -41.29 61.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.928 0.394 . . . . 0.0 110.846 -179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.583 ' H ' HD11 ' A' ' 42' ' ' LEU . 0.5 OUTLIER -72.31 -32.18 66.34 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.477 179.664 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.447 ' O ' HG21 ' A' ' 38' ' ' THR . . . 142.62 34.33 0.1 OUTLIER Glycine 0 CA--C 1.519 0.339 0 C-N-CA 120.618 -0.801 . . . . 0.0 113.381 179.57 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.921 ' O ' HG23 ' A' ' 44' ' ' ILE . . . -85.89 149.78 24.98 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 117.118 0.459 . . . . 0.0 111.049 179.624 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 7.4 mtm180 -81.45 159.89 24.14 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.738 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.609 ' O ' HG23 ' A' ' 54' ' ' VAL . 0.2 OUTLIER -67.32 -21.38 65.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.952 179.873 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.469 ' HB2' ' HA ' ' A' ' 26' ' ' LYS . 1.0 OUTLIER -61.0 -65.1 0.75 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.379 -179.585 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.462 ' N ' ' OG ' ' A' ' 51' ' ' SER . 0.0 OUTLIER -49.08 -65.84 0.5 Allowed 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.977 0.417 . . . . 0.0 110.809 -179.824 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.643 ' HA ' ' HA ' ' A' ' 107' ' ' GLN . 0.0 OUTLIER -43.82 -51.25 7.51 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 115.862 -0.608 . . . . 0.0 112.094 179.872 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.609 HG23 ' O ' ' A' ' 50' ' ' GLU . 53.4 t -61.13 -31.14 49.28 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-O 121.083 0.468 . . . . 0.0 110.244 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.734 ' HB3' ' HB3' ' A' ' 108' ' ' MET . 0.3 OUTLIER -66.61 -48.0 70.9 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.615 179.649 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.798 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -60.45 -45.87 92.11 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-O 120.966 0.412 . . . . 0.0 110.201 179.33 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 21.1 mm-40 -55.26 -55.55 30.09 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.604 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.421 HG23 ' ND2' ' A' ' 2' ' ' ASN . 0.7 OUTLIER -67.38 -30.54 70.35 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.9 -0.591 . . . . 0.0 111.005 -179.992 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.768 HG11 HD23 ' A' ' 116' ' ' LEU . 0.9 OUTLIER -60.56 -57.09 13.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.258 -179.556 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 1.009 HD21 ' CE2' ' A' ' 88' ' ' TYR . 42.3 mt -75.49 -34.71 60.89 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 121.339 0.59 . . . . 0.0 111.335 -179.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 45.5 m -57.83 -42.12 83.71 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.18 179.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . 0.486 ' HB3' HD21 ' A' ' 5' ' ' LEU . 0.2 OUTLIER -75.62 -50.27 16.02 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-O 120.751 0.31 . . . . 0.0 110.611 179.94 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.922 HG12 ' CB ' ' A' ' 120' ' ' ALA . 11.6 m -60.06 -50.37 80.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-O 120.943 0.401 . . . . 0.0 110.55 179.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.522 ' N ' HG23 ' A' ' 63' ' ' VAL . . . 34.92 34.71 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.56 -0.745 . . . . 0.0 112.148 179.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.72 ' O ' HG22 ' A' ' 66' ' ' VAL . 0.5 OUTLIER 163.47 -81.12 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 113.24 0.83 . . . . 0.0 113.24 -179.679 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.834 HG13 ' HB ' ' A' ' 63' ' ' VAL . 11.3 m 54.63 -160.15 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 122.725 0.41 . . . . 0.0 110.911 -177.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.573 HG22 ' CB ' ' A' ' 97' ' ' ASN . 9.9 p -151.72 -28.02 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 N-CA-C 112.269 0.47 . . . . 0.0 112.269 -179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.72 HD22 ' CD1' ' A' ' 76' ' ' LEU . 0.3 OUTLIER 32.27 95.24 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.976 -0.556 . . . . 0.0 112.407 179.193 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.668 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 14.5 p -66.11 -117.67 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.69 179.701 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.455 ' N ' ' OG1' ' A' ' 69' ' ' THR . 0.0 OUTLIER -95.06 -38.94 10.4 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-O 121.062 0.458 . . . . 0.0 110.963 179.974 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 10.9 tt0 -64.0 -61.12 2.48 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.089 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.717 ' HB3' HD23 ' A' ' 68' ' ' LEU . 0.8 OUTLIER -59.27 -30.26 68.16 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.21 -179.646 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.455 HG22 ' HB3' ' A' ' 98' ' ' SER . 0.9 OUTLIER -63.39 -59.05 5.2 Favored 'General case' 0 N--CA 1.464 0.246 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 178.323 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -57.52 -24.75 57.78 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 177.292 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 1.006 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.1 OUTLIER -62.25 -56.88 14.2 Favored 'General case' 0 N--CA 1.454 -0.227 0 CA-C-N 114.742 -1.117 . . . . 0.0 110.066 178.773 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.727 HD21 HD13 ' A' ' 100' ' ' LEU . 0.4 OUTLIER -59.23 -38.58 80.32 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 121.33 0.586 . . . . 0.0 109.438 178.613 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.416 ' O ' HG23 ' A' ' 81' ' ' VAL . 0.1 OUTLIER -57.9 -48.7 79.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.078 -0.965 . . . . 0.0 111.35 -179.817 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 8.8 mm-40 -72.42 -42.42 65.11 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.311 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 4.7 p -68.91 -27.63 65.95 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.272 -179.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.492 HG22 ' HA ' ' A' ' 86' ' ' ASN . 81.2 m -95.39 -38.66 10.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.573 -179.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.518 HG12 ' O ' ' A' ' 81' ' ' VAL . 17.6 t -95.06 -4.38 10.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -179.092 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -34.81 -57.87 0.53 Allowed 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 111.975 0.361 . . . . 0.0 111.975 -179.426 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 2.9 p-80 -176.95 44.58 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.869 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 65.9 m-80 -158.27 171.2 20.63 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.189 -0.46 . . . . 0.0 110.998 179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -59.95 130.12 45.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.072 -179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.492 ' HA ' HG22 ' A' ' 80' ' ' THR . 7.1 p30 -60.7 110.0 1.19 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.169 179.396 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . 0.414 HD22 ' N ' ' A' ' 41' ' ' GLY . 14.2 p30 -103.91 -19.4 14.25 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 116.078 -0.51 . . . . 0.0 112.062 -178.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 1.009 ' CE2' HD21 ' A' ' 60' ' ' LEU . 2.4 m-85 -99.62 148.95 23.78 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 120.329 -0.548 . . . . 0.0 111.485 -179.331 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.686 ' O ' ' O ' ' A' ' 101' ' ' VAL . 0.0 OUTLIER -119.68 148.64 43.14 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.509 -179.116 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.689 HD12 ' N ' ' A' ' 90' ' ' LEU . 0.0 OUTLIER -148.9 150.61 33.25 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-O 121.307 0.575 . . . . 0.0 112.18 -179.335 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 18.0 tpt180 -121.94 141.65 51.1 Favored 'General case' 0 C--O 1.221 -0.435 0 N-CA-C 108.198 -1.038 . . . . 0.0 108.198 178.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.805 ' O ' HG13 ' A' ' 93' ' ' VAL . 55.4 p -104.71 145.85 29.78 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 113.879 1.066 . . . . 0.0 113.879 -177.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.805 HG13 ' O ' ' A' ' 92' ' ' SER . 3.6 m -171.12 -125.76 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.553 0 CA-C-N 113.297 -1.774 . . . . 0.0 107.908 179.204 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.449 ' HA3' ' OD1' ' A' ' 97' ' ' ASN . . . 31.47 39.19 0.04 OUTLIER Glycine 0 CA--C 1.522 0.528 0 N-CA-C 114.583 0.593 . . . . 0.0 114.583 178.079 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 41.44 31.18 0.16 Allowed 'General case' 0 CA--C 1.529 0.159 0 CA-C-N 117.314 0.557 . . . . 0.0 111.203 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 139.69 0.18 2.07 Favored Glycine 0 N--CA 1.447 -0.577 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.919 -179.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.668 ' HA ' ' HA ' ' A' ' 69' ' ' THR . 0.1 OUTLIER -108.87 166.22 10.98 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 110.182 -0.303 . . . . 0.0 110.182 179.847 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.526 ' O ' ' O ' ' A' ' 67' ' ' VAL . 1.5 t -137.39 165.4 26.32 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.431 0.634 . . . . 0.0 111.165 -179.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -103.68 147.63 9.67 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 179.225 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.733 HD23 HG21 ' A' ' 63' ' ' VAL . 7.6 tp -103.77 105.76 16.06 Favored 'General case' 0 N--CA 1.45 -0.474 0 CA-C-O 121.909 0.862 . . . . 0.0 113.302 -177.646 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.686 ' O ' ' O ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -123.14 120.57 60.77 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 N-CA-C 103.743 -2.688 . . . . 0.0 103.743 175.467 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.716 ' OG ' HD11 ' A' ' 60' ' ' LEU . 0.0 OUTLIER -157.96 166.17 33.27 Favored 'General case' 0 C--N 1.305 -1.341 0 C-N-CA 117.529 -1.669 . . . . 0.0 114.395 -173.895 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.984 HD23 HD12 ' A' ' 60' ' ' LEU . 0.1 OUTLIER 161.9 -90.16 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.105 0 CA-C-N 113.502 -1.681 . . . . 0.0 111.835 175.59 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.555 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 53.75 27.61 7.2 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 -179.416 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.555 ' CB ' ' O ' ' A' ' 104' ' ' ARG . 17.6 m 133.99 160.5 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.552 1.141 . . . . 0.0 108.1 -178.543 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.569 ' O ' ' HG3' ' A' ' 107' ' ' GLN . 1.0 OUTLIER -104.82 101.0 10.62 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 120.038 -0.665 . . . . 0.0 112.243 -178.703 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.798 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 5.5 mt-30 -169.85 159.82 8.16 Favored 'General case' 0 N--CA 1.461 0.114 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.415 177.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.734 ' HB3' ' HB3' ' A' ' 55' ' ' PHE . 2.4 tpt -158.56 153.73 25.47 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 112.629 0.604 . . . . 0.0 112.629 179.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.7 HG22 ' CD1' ' A' ' 39' ' ' PHE . 0.1 OUTLIER -115.47 165.29 13.15 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.857 178.662 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.875 HD13 HG22 ' A' ' 12' ' ' VAL . 0.2 OUTLIER -50.94 -55.78 15.58 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.696 0.284 . . . . 0.0 111.288 -179.933 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.743 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 0.9 OUTLIER -49.17 -65.96 0.48 Allowed 'General case' 0 N--CA 1.466 0.329 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.355 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.782 ' O ' HD22 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -49.57 -56.94 8.14 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.025 0.44 . . . . 0.0 110.83 -179.224 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.622 ' HB1' ' CZ ' ' A' ' 55' ' ' PHE . . . -40.44 -54.57 2.44 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.843 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.785 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -67.31 -33.34 75.07 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.099 179.708 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 1.006 HG22 ' CG ' ' A' ' 75' ' ' LYS . 54.9 t -54.36 -61.69 0.91 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.746 0 CA-C-O 121.756 0.788 . . . . 0.0 110.72 179.697 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.782 HD22 ' O ' ' A' ' 112' ' ' ASP . 0.1 OUTLIER -62.26 -43.2 99.37 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.177 -179.534 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 1.056 HD21 HD23 ' A' ' 8' ' ' LEU . 0.7 OUTLIER -66.99 -19.08 65.66 Favored 'General case' 0 CA--C 1.51 -0.565 0 C-N-CA 120.764 -0.375 . . . . 0.0 111.156 179.624 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.744 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 10.1 tt0 -70.7 -54.18 12.81 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 106.095 -1.817 . . . . 0.0 106.095 176.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.511 ' O ' ' HB2' ' A' ' 123' ' ' GLN . . . -69.83 -18.86 63.47 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.478 -1.237 . . . . 0.0 110.675 177.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.922 ' CB ' HG12 ' A' ' 63' ' ' VAL . . . -79.88 -62.72 1.6 Allowed 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 121.151 0.5 . . . . 0.0 110.432 179.543 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.748 HD22 ' CG ' ' A' ' 9' ' ' HIS . 0.1 OUTLIER -60.01 -24.78 64.76 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.525 -179.619 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.744 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -87.01 -41.69 13.68 Favored 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 -179.903 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.511 ' HB2' ' O ' ' A' ' 119' ' ' ALA . 1.1 tm0? -84.8 -29.76 25.14 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.465 0.543 . . . . 0.0 112.465 -178.463 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -95.24 -65.97 0.94 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 112.543 0.571 . . . . 0.0 112.543 -178.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -95.35 -4.71 44.93 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.82 -0.627 . . . . 0.0 112.423 -178.17 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . 0.579 ' N ' ' O ' ' A' ' 121' ' ' LEU . . . 42.53 74.49 0.18 Allowed Glycine 0 C--N 1.331 0.289 0 C-N-CA 120.518 -0.848 . . . . 0.0 111.788 -178.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.571 ' HB3' ' O ' ' A' ' 126' ' ' GLY . . . 80.18 -48.87 0.34 Allowed 'General case' 0 CA--C 1.52 -0.176 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 -177.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . 0.428 ' HG2' ' CB ' ' A' ' 6' ' ' SER . 0.0 OUTLIER 172.38 106.75 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.646 178.229 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 44.03 25.7 0.72 Allowed Glycine 0 CA--C 1.519 0.306 0 CA-C-N 115.62 -0.718 . . . . 0.0 113.042 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.187 -0.911 . . . . 0.0 110.82 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.097 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -149.4 -177.39 5.82 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.789 0.328 . . . . 0.0 110.862 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -149.37 -172.02 4.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.886 -179.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 204' ' ' PTR . . . . . 0.456 ' HE1' ' CE ' ' A' ' 26' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 53.41 -91.19 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.997 -0.547 . . . . 0.0 112.331 178.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 206' ' ' ASP . . . . . 0.42 ' HA ' ' HD2' ' B' ' 207' ' ' PRO . 17.9 m-20 -45.53 105.88 0.5 Allowed Pre-proline 0 N--CA 1.463 0.186 0 N-CA-C 111.926 0.343 . . . . 0.0 111.926 -178.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . 0.599 ' HA ' ' HB2' ' A' ' 30' ' ' ASN . 12.3 Cg_endo -55.77 -177.35 0.05 OUTLIER 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 122.438 2.092 . . . . 0.0 112.026 179.566 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 208' ' ' PHE . . . . . 0.445 ' HA ' ' HB3' ' A' ' 11' ' ' GLN . 25.6 m-85 61.9 -82.11 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.956 179.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.657 -0.247 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.9 ptt? . . . . . 0 N--CA 1.488 1.446 0 CA-C-O 120.658 0.266 . . . . 0.0 111.412 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.626 ' CG ' HD21 ' A' ' 27' ' ' LEU . 30.4 t30 -125.8 168.04 14.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.874 0.369 . . . . 0.0 110.679 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.719 HD11 ' C ' ' A' ' 29' ' ' GLY . 0.3 OUTLIER -66.57 172.28 4.3 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.374 -179.487 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 53.5 p -74.0 -151.34 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.969 -0.56 . . . . 0.0 109.877 179.165 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.838 HD23 ' CE1' ' A' ' 9' ' ' HIS . 1.1 mt -95.27 -66.56 0.9 Allowed 'General case' 0 CA--C 1.504 -0.826 0 CA-C-O 121.531 0.681 . . . . 0.0 111.757 179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.524 ' HB2' ' CG ' ' A' ' 128' ' ' ARG . 0.0 OUTLIER -35.73 -46.78 0.46 Allowed 'General case' 0 N--CA 1.435 -1.223 0 CA-C-N 115.205 -0.907 . . . . 0.0 112.914 -178.422 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . 0.421 ' HB2' ' CG ' ' B' ' 207' ' ' PRO . 0.7 OUTLIER -78.97 -42.49 26.68 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -179.584 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.858 HD23 HD21 ' A' ' 117' ' ' LEU . 11.2 tp -64.23 -35.47 80.93 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.545 0.688 . . . . 0.0 110.868 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 1.006 ' CD2' HD23 ' A' ' 117' ' ' LEU . 3.4 m170 -79.62 -43.1 23.52 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.727 -1.124 . . . . 0.0 110.873 -178.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.492 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 5.2 mmt85 -60.2 -37.57 80.66 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 108.766 -0.827 . . . . 0.0 108.766 178.375 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.836 ' HG2' HG13 ' A' ' 31' ' ' VAL . 5.9 tt0 -65.59 -65.91 0.61 Allowed 'General case' 0 C--O 1.236 0.363 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.455 178.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.757 ' O ' HG12 ' A' ' 16' ' ' VAL . 7.4 p -55.08 -48.11 76.39 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.145 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.517 -179.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.504 ' N ' HG13 ' A' ' 12' ' ' VAL . 83.9 p -54.81 -60.05 3.9 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.383 -179.454 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.492 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -53.97 -48.19 70.58 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -178.698 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.942 ' CD1' HD22 ' A' ' 110' ' ' LEU . 0.2 OUTLIER -60.28 -57.75 11.43 Favored 'General case' 0 N--CA 1.465 0.316 0 C-N-CA 119.61 -0.836 . . . . 0.0 111.084 -179.267 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.828 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 9.9 p -69.28 -11.67 15.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -178.627 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.729 ' HG2' ' HE3' ' A' ' 114' ' ' LYS . 3.8 mm-40 -95.6 -4.36 44.68 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 9.8 mt-30 -148.83 -47.17 0.15 Allowed 'General case' 0 C--N 1.333 -0.143 0 N-CA-C 112.027 0.38 . . . . 0.0 112.027 -179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -87.81 -61.33 1.74 Allowed 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 112.197 0.443 . . . . 0.0 112.197 -178.888 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.828 ' HB2' ' HA ' ' A' ' 16' ' ' VAL . 4.6 m -73.76 -47.24 40.5 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.037 -0.529 . . . . 0.0 112.318 -178.479 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 85.07 -39.85 2.99 Favored Glycine 0 CA--C 1.519 0.308 0 C-N-CA 120.519 -0.848 . . . . 0.0 111.782 -178.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.754 ' O ' HD12 ' A' ' 110' ' ' LEU . 7.5 t70 -170.59 -66.44 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 109.943 -0.392 . . . . 0.0 109.943 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.569 ' O ' ' O ' ' A' ' 22' ' ' ASP . 0.1 OUTLIER 28.46 -159.22 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.624 0.769 . . . . 0.0 112.506 178.945 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.746 ' HA ' HG22 ' A' ' 109' ' ' THR . 0.1 OUTLIER -104.03 156.08 18.15 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 109.063 -0.718 . . . . 0.0 109.063 179.005 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.444 ' H ' ' HA ' ' A' ' 109' ' ' THR . . . -104.68 119.69 6.33 Favored Glycine 0 N--CA 1.443 -0.85 0 C-N-CA 120.172 -1.013 . . . . 0.0 113.184 -178.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.99 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -104.58 115.5 30.46 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 178.67 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.626 HD21 ' CG ' ' A' ' 2' ' ' ASN . 2.8 tt -110.09 151.8 26.77 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-O 121.574 0.702 . . . . 0.0 112.605 -177.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.462 ' HG2' ' C ' ' A' ' 27' ' ' LEU . 4.9 ptp180 160.78 52.49 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 114.63 -1.168 . . . . 0.0 108.888 179.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.719 ' C ' HD11 ' A' ' 3' ' ' LEU . . . 100.76 -6.81 57.27 Favored Glycine 0 N--CA 1.451 -0.363 0 CA-C-N 115.39 -0.823 . . . . 0.0 111.137 -178.24 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.472 ' ND2' ' HD2' ' B' ' 204' ' ' PTR . 0.0 OUTLIER -166.36 165.55 17.14 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 179.868 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.836 HG13 ' HG2' ' A' ' 11' ' ' GLN . 0.2 OUTLIER -116.77 122.53 70.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.227 0.537 . . . . 0.0 110.432 178.709 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.99 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -120.22 167.1 12.6 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.008 -179.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.753 ' HB2' ' OG ' ' A' ' 20' ' ' SER . . . -102.2 127.72 49.02 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.274 0.559 . . . . 0.0 111.542 -179.024 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.518 HD21 HG23 ' A' ' 37' ' ' THR . 6.3 t30 -111.89 132.53 54.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.643 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.1 -22.04 3.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.228 -179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -57.72 -23.52 52.29 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.427 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.518 HG23 HD21 ' A' ' 34' ' ' ASN . 4.6 t -154.97 155.04 33.5 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.062 0.458 . . . . 0.0 110.626 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 23.2 p -81.84 -122.63 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.609 -179.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.551 ' CZ ' HG23 ' A' ' 109' ' ' THR . 0.2 OUTLIER -176.32 -85.48 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 121.351 -0.14 . . . . 0.0 111.131 179.962 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.537 ' O ' ' C ' ' A' ' 41' ' ' GLY . 0.0 OUTLIER 56.06 88.68 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.507 0 C-N-CA 122.45 0.3 . . . . 0.0 111.141 179.667 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.537 ' C ' ' O ' ' A' ' 40' ' ' GLN . . . 14.4 98.41 0.0 OUTLIER Glycine 0 C--N 1.346 1.108 0 O-C-N 123.498 0.499 . . . . 0.0 112.738 -179.193 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.819 HD11 ' HB2' ' A' ' 46' ' ' SER . 6.2 tp -151.08 159.9 44.22 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.481 -0.192 . . . . 0.0 110.481 -178.157 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.447 ' C ' ' H ' ' A' ' 45' ' ' ALA . 0.0 OUTLIER -107.37 33.1 4.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.942 0.401 . . . . 0.0 111.282 -179.457 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.747 HD12 ' HB3' ' A' ' 48' ' ' ALA . 0.9 OUTLIER 59.13 -0.54 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.439 0 CA-C-N 116.083 -0.508 . . . . 0.0 112.13 179.777 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.447 ' H ' ' C ' ' A' ' 43' ' ' THR . . . -77.97 -40.94 37.74 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.914 0.388 . . . . 0.0 110.719 179.527 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.819 ' HB2' HD11 ' A' ' 42' ' ' LEU . 0.5 OUTLIER -71.25 -31.16 67.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.712 179.81 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 143.92 52.92 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.557 -0.83 . . . . 0.0 112.989 179.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.747 ' HB3' HD12 ' A' ' 44' ' ' ILE . . . -121.09 -173.72 2.67 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.739 0.304 . . . . 0.0 111.256 179.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 14.7 ttm180 -109.74 139.4 44.84 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.091 -179.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.71 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 12.2 mt-10 -56.66 -18.1 11.08 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.412 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.658 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 0.8 OUTLIER -71.97 -56.98 4.71 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.316 -179.91 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.424 ' HB3' ' HG2' ' A' ' 107' ' ' GLN . 41.4 mt-10 -48.25 -44.23 33.19 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.033 0.444 . . . . 0.0 110.796 179.641 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.71 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -65.59 -58.69 5.15 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.507 -179.971 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.568 HG22 ' O ' ' A' ' 50' ' ' GLU . 14.1 m -49.27 -45.2 18.03 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-O 121.051 0.453 . . . . 0.0 110.352 179.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.783 ' CE1' ' HB1' ' A' ' 113' ' ' ALA . 0.2 OUTLIER -55.38 -53.62 53.86 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.827 178.649 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.696 ' HB2' ' C ' ' A' ' 107' ' ' GLN . . . -48.28 -45.85 35.16 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.577 179.176 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -64.07 -45.82 87.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.887 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.423 ' OG1' ' HA ' ' A' ' 55' ' ' PHE . 0.6 OUTLIER -64.35 -53.68 44.88 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.289 -179.528 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.857 HG23 HD12 ' A' ' 117' ' ' LEU . 4.6 p -60.66 -38.28 78.08 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 C-N-CA 120.397 -0.521 . . . . 0.0 110.064 179.544 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.559 HD13 ' O ' ' A' ' 102' ' ' SER . 7.2 tp -61.23 -39.14 89.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.845 0.355 . . . . 0.0 110.268 178.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 33.8 m -69.53 -60.42 2.34 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.905 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . 0.541 ' HB3' HD21 ' A' ' 5' ' ' LEU . 14.2 m-70 -52.94 -27.67 19.97 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.837 0.351 . . . . 0.0 111.226 -179.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 1.103 HG21 ' HB3' ' A' ' 116' ' ' LEU . 3.8 t -102.41 46.78 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.045 -179.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.629 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . -76.56 57.77 1.27 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.412 -179.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.629 ' CB ' ' O ' ' A' ' 64' ' ' ALA . 26.0 t-20 132.31 -63.68 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.21 0.604 . . . . 0.0 111.381 179.632 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 1.089 HG11 HG13 ' A' ' 63' ' ' VAL . 35.4 m 42.47 -137.28 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.602 -179.455 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.51 ' O ' ' O ' ' A' ' 98' ' ' SER . 2.8 p -158.89 -31.95 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-O 121.027 0.441 . . . . 0.0 111.926 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.719 HD12 ' O ' ' A' ' 98' ' ' SER . 0.7 OUTLIER 40.85 95.67 0.01 OUTLIER 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.647 179.226 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 22.0 p -66.78 -165.38 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.758 -0.46 . . . . 0.0 109.758 178.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.91 -34.15 71.36 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.017 0.437 . . . . 0.0 110.697 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 11.3 tt0 -68.19 -51.33 46.83 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.63 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.692 ' O ' HD12 ' A' ' 76' ' ' LEU . 3.3 m-20 -60.46 -42.12 95.54 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.779 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 70.6 m -61.89 -44.64 96.39 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-O 121.103 0.478 . . . . 0.0 110.122 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.516 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . . . -68.81 -28.98 67.24 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 178.055 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 1.024 ' CG ' HG12 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -56.4 -57.52 11.95 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 114.061 -1.427 . . . . 0.0 109.834 178.354 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 1.014 HD22 HD21 ' A' ' 90' ' ' LEU . 5.9 mp -62.64 -53.43 54.66 Favored 'General case' 0 CA--C 1.521 -0.143 0 CA-C-N 116.299 -0.409 . . . . 0.0 110.164 179.244 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.834 ' O ' HG22 ' A' ' 81' ' ' VAL . 0.3 OUTLIER -54.52 -32.12 57.54 Favored 'General case' 0 C--O 1.231 0.117 0 CA-C-N 116.38 -0.373 . . . . 0.0 110.72 -179.763 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.405 ' HB2' ' O ' ' A' ' 74' ' ' ALA . 1.0 OUTLIER -67.87 -65.03 0.74 Allowed 'General case' 0 C--O 1.233 0.218 0 CA-C-O 120.917 0.389 . . . . 0.0 109.994 179.115 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.03 -22.46 60.73 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.743 179.282 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.733 HG23 ' O ' ' A' ' 85' ' ' LEU . 31.4 m -72.56 -64.98 0.85 Allowed 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.967 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.834 HG22 ' O ' ' A' ' 77' ' ' LEU . 27.4 m -68.76 -14.78 18.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.728 -179.678 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -46.21 -68.55 0.18 Allowed 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 120.668 0.271 . . . . 0.0 111.556 -179.804 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 10.6 t-80 -136.04 68.64 1.44 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.852 0.358 . . . . 0.0 111.251 -179.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 47.27 70.26 0.43 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.431 179.669 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.733 ' O ' HG23 ' A' ' 80' ' ' THR . 2.1 tm? -130.76 75.37 1.65 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.708 179.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 19.2 p30 -103.35 25.22 9.84 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.611 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 37.3 p-10 -74.61 -14.56 60.79 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.176 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.632 ' CG ' ' HB2' ' A' ' 102' ' ' SER . 2.8 m-85 -103.13 139.69 38.32 Favored 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.835 -179.91 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.763 ' CG ' HG13 ' A' ' 101' ' ' VAL . 0.7 OUTLIER -109.63 146.24 35.11 Favored 'General case' 0 N--CA 1.436 -1.134 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -178.985 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 1.014 HD21 HD22 ' A' ' 76' ' ' LEU . 36.7 mt -136.01 153.58 51.33 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 113.364 0.875 . . . . 0.0 113.364 -177.449 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.444 ' O ' ' CB ' ' A' ' 98' ' ' SER . 25.2 ttp180 -130.71 142.65 50.43 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 114.69 -1.141 . . . . 0.0 108.193 178.031 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.455 ' O ' HG13 ' A' ' 93' ' ' VAL . 3.8 p -104.66 140.64 37.74 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 113.796 1.036 . . . . 0.0 113.796 -178.084 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.456 HG23 ' N ' ' A' ' 94' ' ' GLY . 27.8 m -159.78 -137.49 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.443 -0.82 0 CA-C-N 113.833 -1.53 . . . . 0.0 107.769 178.376 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.531 ' O ' ' N ' ' A' ' 96' ' ' GLY . . . 31.49 36.97 0.03 OUTLIER Glycine 0 N--CA 1.46 0.265 0 C-N-CA 121.563 -0.351 . . . . 0.0 113.631 178.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.425 ' N ' ' O ' ' A' ' 93' ' ' VAL . 44.6 t30 64.32 -69.83 0.08 Allowed 'General case' 0 C--O 1.231 0.111 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 -178.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.531 ' N ' ' O ' ' A' ' 94' ' ' GLY . . . -121.1 22.89 7.86 Favored Glycine 0 N--CA 1.445 -0.749 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 177.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.414 ' ND2' ' HA3' ' A' ' 94' ' ' GLY . 0.3 OUTLIER -114.95 166.12 12.13 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 110.221 -0.289 . . . . 0.0 110.221 -179.817 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.719 ' O ' HD12 ' A' ' 68' ' ' LEU . 0.9 OUTLIER -140.73 164.01 31.37 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.485 0.659 . . . . 0.0 111.308 -179.927 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.533 HG22 ' O ' ' A' ' 65' ' ' ASN . 0.5 OUTLIER -104.19 151.21 6.89 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.782 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 178.954 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.93 HD13 ' CD1' ' A' ' 116' ' ' LEU . 1.0 OUTLIER -103.94 111.54 24.13 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -178.995 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.763 HG13 ' CG ' ' A' ' 89' ' ' ASP . 1.4 p -124.27 104.68 14.26 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 104.352 -2.462 . . . . 0.0 104.352 175.143 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.632 ' HB2' ' CG ' ' A' ' 88' ' ' TYR . 9.0 p -148.92 165.35 31.84 Favored 'General case' 0 C--N 1.311 -1.106 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -173.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.541 HD13 ' O ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 158.62 -91.08 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.077 0 CA-C-N 113.07 -1.877 . . . . 0.0 111.864 176.03 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.512 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 56.87 23.07 7.72 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 -178.641 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.541 ' O ' HD13 ' A' ' 103' ' ' LEU . 5.1 m 138.9 168.22 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.859 1.264 . . . . 0.0 108.154 -178.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.428 ' O ' ' O ' ' A' ' 42' ' ' LEU . 1.3 m-20 -104.89 102.59 12.11 Favored 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 120.082 -0.647 . . . . 0.0 112.348 -179.076 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.696 ' C ' ' HB2' ' A' ' 56' ' ' ALA . 0.6 OUTLIER -168.1 157.47 9.58 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.699 177.991 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.492 ' HG2' ' HB2' ' A' ' 113' ' ' ALA . 0.0 OUTLIER -165.64 145.03 6.4 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.21 0.529 . . . . 0.0 112.293 179.268 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.746 HG22 ' HA ' ' A' ' 24' ' ' THR . 0.7 OUTLIER -104.26 163.47 12.39 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 178.256 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.942 HD22 ' CD1' ' A' ' 15' ' ' LEU . 5.2 mt -52.8 -61.39 2.32 Favored 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 120.165 -0.614 . . . . 0.0 109.838 179.892 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.799 ' O ' HG13 ' A' ' 115' ' ' VAL . 2.5 tp60 -40.15 -63.38 0.62 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 120.713 0.292 . . . . 0.0 110.603 179.145 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 1.023 ' O ' HG22 ' A' ' 115' ' ' VAL . 8.0 m-20 -51.5 -58.51 6.1 Favored 'General case' 0 C--O 1.232 0.143 0 CA-C-O 121.265 0.555 . . . . 0.0 110.154 179.384 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.805 ' O ' HD13 ' A' ' 117' ' ' LEU . . . -48.4 -39.87 23.93 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.12 0.486 . . . . 0.0 110.108 178.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.729 ' HE3' ' HG2' ' A' ' 17' ' ' GLN . 0.0 OUTLIER -72.22 -26.97 62.24 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.877 179.729 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 1.024 HG12 ' CG ' ' A' ' 75' ' ' LYS . 10.8 m -70.48 -51.82 34.44 Favored 'Isoleucine or valine' 0 C--O 1.249 1.038 0 CA-C-O 121.406 0.622 . . . . 0.0 111.892 -179.079 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 1.103 ' HB3' HG21 ' A' ' 63' ' ' VAL . 0.5 OUTLIER -70.0 -37.84 75.82 Favored 'General case' 0 N--CA 1.439 -1.017 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 179.433 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 1.006 HD23 ' CD2' ' A' ' 9' ' ' HIS . 5.1 mp -65.6 -32.28 73.77 Favored 'General case' 0 CA--C 1.508 -0.644 0 CA-C-N 115.833 -0.621 . . . . 0.0 109.905 178.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 26.4 tp10 -62.17 -53.24 58.14 Favored 'General case' 0 C--N 1.31 -1.112 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 178.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.579 ' HB1' ' H ' ' A' ' 68' ' ' LEU . . . -74.47 -16.56 60.85 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 119.382 -0.927 . . . . 0.0 110.741 177.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.985 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -77.99 -61.51 1.98 Allowed 'General case' 0 N--CA 1.428 -1.536 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.409 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.847 HD12 ' N ' ' A' ' 129' ' ' GLY . 0.4 OUTLIER -56.55 -34.71 67.36 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 118.736 -1.186 . . . . 0.0 108.785 178.111 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.532 ' HA ' ' HA3' ' A' ' 129' ' ' GLY . 0.1 OUTLIER -55.03 -65.28 0.61 Allowed 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 114.918 -1.037 . . . . 0.0 112.223 179.797 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.77 -13.25 24.27 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 113.68 0.993 . . . . 0.0 113.68 -177.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . 0.596 ' HB2' ' O ' ' A' ' 120' ' ' ALA . 5.0 mm-40 -97.68 -67.06 0.86 Allowed 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 -177.449 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.677 ' HB2' ' HA ' ' A' ' 121' ' ' LEU . 10.1 t -47.78 -59.93 2.95 Favored 'General case' 0 CA--C 1.5 -0.981 0 CA-C-N 114.293 -1.321 . . . . 0.0 112.496 -176.458 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 65.32 3.7 13.92 Favored Glycine 0 N--CA 1.433 -1.566 0 N-CA-C 108.792 -1.723 . . . . 0.0 108.792 -175.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.566 ' HB3' ' OG ' ' A' ' 125' ' ' SER . . . -94.04 -33.43 13.4 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 178.551 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . 0.524 ' CG ' ' HB2' ' A' ' 6' ' ' SER . 24.9 mmt180 -142.53 -33.39 0.47 Allowed 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 114.708 -1.133 . . . . 0.0 111.06 178.969 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . 0.847 ' N ' HD12 ' A' ' 121' ' ' LEU . . . -86.58 5.88 83.68 Favored Glycine 0 C--N 1.349 1.252 0 C-N-CA 118.798 -1.668 . . . . 0.0 112.64 179.436 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.221 -0.895 . . . . 0.0 111.022 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 201' ' ' ACE . . . . . 0.787 ' H2 ' ' O ' ' B' ' 204' ' ' PTR . . . . . . . . 0 C--O 1.231 0.095 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 59.99 147.72 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.813 0.34 . . . . 0.0 110.834 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 62.22 -80.65 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.938 -179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 204' ' ' PTR . . . . . 0.787 ' O ' ' H2 ' ' B' ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -108.21 -87.79 0.49 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.513 -0.312 . . . . 0.0 111.323 -179.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 206' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -58.44 108.05 1.17 Allowed Pre-proline 0 C--N 1.332 -0.194 0 CA-C-O 120.502 0.192 . . . . 0.0 110.9 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . 0.498 ' HB3' HD22 ' A' ' 3' ' ' LEU . 33.6 Cg_endo -64.09 90.14 0.16 Allowed 'Trans proline' 0 C--N 1.347 0.457 0 C-N-CA 122.284 1.989 . . . . 0.0 112.532 -179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 208' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 178.65 85.01 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.903 179.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 116.533 -0.303 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.444 ' N ' ' H1 ' ' B' ' 201' ' ' ACE . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.893 0.378 . . . . 0.0 111.177 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.728 ' ND2' HD12 ' A' ' 3' ' ' LEU . 11.2 t-20 -57.89 164.26 2.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.885 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.728 HD12 ' ND2' ' A' ' 2' ' ' ASN . 0.0 OUTLIER -79.88 -76.02 0.23 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.098 179.579 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.503 ' O ' ' CB ' ' A' ' 8' ' ' LEU . 36.1 t -178.48 -151.72 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.766 179.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.567 ' HA ' ' CD2' ' A' ' 117' ' ' LEU . 23.1 mt -96.04 -64.7 1.03 Allowed 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 121.365 0.602 . . . . 0.0 111.453 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.448 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 0.9 OUTLIER -36.19 -59.16 0.64 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 114.766 -1.106 . . . . 0.0 112.958 -178.288 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . 0.408 ' O ' ' HB3' ' A' ' 10' ' ' ARG . 0.7 OUTLIER -73.32 -54.32 8.66 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 120.757 0.313 . . . . 0.0 110.733 -179.387 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.983 HD23 HD21 ' A' ' 117' ' ' LEU . 46.0 tp -42.5 -51.19 5.14 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.254 0.549 . . . . 0.0 110.166 179.458 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.74 ' CG ' HD22 ' A' ' 121' ' ' LEU . 9.6 t60 -64.34 -46.53 83.07 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 177.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.448 ' HB2' ' O ' ' A' ' 6' ' ' SER . 0.0 OUTLIER -50.84 -57.15 9.15 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 114.21 -1.359 . . . . 0.0 111.741 -179.545 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.663 ' HG3' HG22 ' A' ' 31' ' ' VAL . 2.3 pt20 -65.41 -51.37 60.78 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -179.145 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.876 HG23 HD23 ' A' ' 110' ' ' LEU . 8.9 p -58.75 -46.22 90.82 Favored 'Isoleucine or valine' 0 C--O 1.235 0.332 0 CA-C-O 121.206 0.527 . . . . 0.0 110.614 179.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.845 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 24.5 t -56.56 -49.2 75.53 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.329 179.649 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.8 ttt85 -63.82 -30.5 71.59 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.952 0.405 . . . . 0.0 110.533 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.721 HD12 ' HA ' ' A' ' 12' ' ' VAL . 6.4 mt -67.56 -65.47 0.68 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.908 -0.587 . . . . 0.0 112.353 -179.422 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.499 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 0.9 OUTLIER -68.04 -27.7 38.43 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.188 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -178.566 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.401 ' HB2' ' O ' ' A' ' 13' ' ' SER . 1.8 mm-40 -87.09 -9.95 54.12 Favored 'General case' 0 C--N 1.324 -0.51 0 C-N-CA 120.666 -0.414 . . . . 0.0 111.672 -179.523 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.0 mt-30 -151.94 38.44 0.59 Allowed 'General case' 0 C--N 1.333 -0.124 0 C-N-CA 120.821 -0.351 . . . . 0.0 111.925 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 179.35 -67.69 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.21 0 N-CA-C 112.607 0.595 . . . . 0.0 112.607 179.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.565 ' CB ' HD13 ' A' ' 110' ' ' LEU . 15.3 m -72.33 -40.34 67.5 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.415 0.524 . . . . 0.0 112.415 -178.219 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.432 ' H ' ' HA ' ' A' ' 16' ' ' VAL . . . 82.3 -50.42 4.32 Favored Glycine 0 CA--C 1.519 0.343 0 C-N-CA 120.374 -0.917 . . . . 0.0 112.192 -179.06 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -175.93 30.69 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 120.74 0.305 . . . . 0.0 111.412 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.46 ' HB2' ' HB3' ' A' ' 20' ' ' SER . 1.0 OUTLIER -79.22 -163.14 0.46 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.503 179.734 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.626 ' HA ' HG22 ' A' ' 109' ' ' THR . 40.5 m -104.13 149.44 25.23 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.413 ' CA ' ' HG ' ' A' ' 110' ' ' LEU . . . -107.21 145.29 16.0 Favored Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.2 -1.0 . . . . 0.0 113.639 -178.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.657 ' O ' ' HA ' ' A' ' 31' ' ' VAL . 0.0 OUTLIER -108.86 123.6 49.31 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 178.939 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.759 HD23 ' N ' ' A' ' 28' ' ' ARG . 6.6 tt -104.27 163.52 12.36 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 112.413 0.523 . . . . 0.0 112.413 -178.304 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.759 ' N ' HD23 ' A' ' 27' ' ' LEU . 0.1 OUTLIER 145.86 58.67 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.425 1.09 . . . . 0.0 109.368 179.966 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.477 ' HA2' ' HG ' ' A' ' 3' ' ' LEU . . . 75.91 6.7 82.84 Favored Glycine 0 C--N 1.335 0.524 0 C-N-CA 120.109 -1.043 . . . . 0.0 110.727 -177.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.471 ' C ' ' ND2' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -166.12 165.9 17.43 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 -179.52 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.765 ' CG1' HD12 ' A' ' 8' ' ' LEU . 0.7 OUTLIER -131.89 118.09 36.46 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 CA-C-O 121.522 0.677 . . . . 0.0 111.215 178.763 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.647 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -104.92 166.07 10.63 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.901 -179.38 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.547 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -103.9 116.36 32.13 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.239 0.542 . . . . 0.0 111.344 -179.528 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.404 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 5.9 t30 -97.74 120.59 38.4 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.718 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 3.0 ttpp -114.15 -25.47 8.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.986 179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -60.01 -55.0 39.45 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.818 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.57 -169.44 2.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.548 179.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.492 ' O ' ' HB3' ' A' ' 39' ' ' PHE . 29.7 p -132.67 -43.17 0.91 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.465 -179.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.649 ' CD1' HG23 ' A' ' 109' ' ' THR . 0.0 OUTLIER 91.2 175.02 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.269 0.628 . . . . 0.0 110.746 -179.545 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.602 ' HB2' HD22 ' A' ' 85' ' ' LEU . 0.1 OUTLIER 150.08 62.82 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 123.878 0.871 . . . . 0.0 109.803 -179.667 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.772 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . 67.27 -88.78 0.16 Allowed Glycine 0 CA--C 1.522 0.511 0 C-N-CA 120.912 -0.661 . . . . 0.0 112.072 -178.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.75 HD23 ' HB2' ' A' ' 48' ' ' ALA . 13.6 tp 42.86 172.07 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 117.41 0.605 . . . . 0.0 111.915 179.257 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -127.85 34.79 4.57 Favored 'General case' 0 C--N 1.329 -0.285 0 O-C-N 121.81 -0.556 . . . . 0.0 111.655 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.972 HD13 ' HB3' ' A' ' 48' ' ' ALA . 30.2 mm 56.61 7.34 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 N-CA-C 112.576 0.584 . . . . 0.0 112.576 179.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -91.6 -31.23 15.97 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.723 0.297 . . . . 0.0 111.456 -179.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.62 ' HB2' HD11 ' A' ' 42' ' ' LEU . 0.3 OUTLIER -91.78 -53.26 4.36 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.22 -179.828 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.74 ' H ' HD21 ' A' ' 42' ' ' LEU . . . 177.52 71.36 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.585 -0.816 . . . . 0.0 112.799 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.972 ' HB3' HD13 ' A' ' 44' ' ' ILE . . . -135.31 161.67 34.74 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.674 0.273 . . . . 0.0 110.775 179.731 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 29.4 mtt180 -93.83 134.22 36.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.115 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.619 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 7.0 mt-10 -51.29 -27.0 8.27 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 121.164 0.507 . . . . 0.0 110.732 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.507 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 31.1 p -69.82 -57.87 4.57 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.346 179.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.412 ' H ' ' HG3' ' A' ' 52' ' ' GLU . 40.3 mt-10 -44.28 -50.69 8.85 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.183 179.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.619 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -65.04 -51.73 59.92 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.425 -179.815 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 50' ' ' GLU . 53.7 t -56.6 -37.48 52.51 Favored 'Isoleucine or valine' 0 C--O 1.234 0.253 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.84 ' CE1' ' HB1' ' A' ' 113' ' ' ALA . 0.2 OUTLIER -59.96 -47.61 85.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.179 -0.918 . . . . 0.0 109.429 178.746 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.752 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -54.79 -64.55 0.8 Allowed 'General case' 0 CA--C 1.517 -0.298 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.83 178.75 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.4 ' O ' ' CB ' ' A' ' 61' ' ' SER . 2.6 mm-40 -39.87 -48.73 2.35 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.989 -0.551 . . . . 0.0 110.814 179.25 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.485 ' HA ' ' HB2' ' A' ' 61' ' ' SER . 0.9 OUTLIER -65.19 -54.05 35.53 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.557 179.787 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.872 HG23 HD12 ' A' ' 117' ' ' LEU . 0.6 OUTLIER -48.42 -41.15 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.203 0 N-CA-C 112.562 0.579 . . . . 0.0 112.562 -178.74 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.739 ' CD1' HD21 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -93.36 -17.06 23.98 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 120.414 -0.515 . . . . 0.0 110.674 179.875 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.485 ' HB2' ' HA ' ' A' ' 58' ' ' THR . 1.8 m -66.57 -63.21 1.12 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.702 178.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . 0.503 ' CE1' ' HA ' ' A' ' 59' ' ' VAL . 4.7 p-80 -64.19 -43.34 95.38 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-O 121.159 0.504 . . . . 0.0 109.674 179.572 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.855 HG22 ' HB2' ' A' ' 120' ' ' ALA . 4.8 t -54.77 -60.03 1.85 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-N 115.407 -0.815 . . . . 0.0 109.555 178.35 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.532 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 40.45 26.06 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 115.374 -0.83 . . . . 0.0 113.152 178.673 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.681 ' H ' HG12 ' A' ' 63' ' ' VAL . 7.3 t30 149.92 -68.89 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 122.788 0.435 . . . . 0.0 110.848 179.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.769 ' CG2' HG13 ' A' ' 63' ' ' VAL . 23.4 m 45.24 -162.5 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.346 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.723 ' HB ' ' HB3' ' A' ' 97' ' ' ASN . 10.7 m -142.16 77.05 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.437 -1.099 0 CA-C-O 121.012 0.434 . . . . 0.0 110.432 -178.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 1.094 HD22 HD11 ' A' ' 76' ' ' LEU . 0.2 OUTLIER -70.93 80.73 0.65 Allowed 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.971 -179.026 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.694 HG22 ' O ' ' A' ' 96' ' ' GLY . 69.0 p -48.11 166.61 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.665 -0.494 . . . . 0.0 109.665 178.363 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -39.81 -35.02 0.3 Allowed 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.043 0.449 . . . . 0.0 111.753 -179.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.444 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 3.2 tp10 -64.19 -48.2 76.85 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.189 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.682 ' O ' HD12 ' A' ' 76' ' ' LEU . 81.0 m-20 -70.96 -52.13 21.64 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.447 179.612 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.668 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 89.9 m -45.68 -39.41 7.91 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 121.136 0.493 . . . . 0.0 110.207 178.69 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.461 ' HA ' ' HG ' ' A' ' 77' ' ' LEU . . . -73.65 -41.85 62.17 Favored 'General case' 0 CA--C 1.51 -0.591 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 178.203 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.951 ' HB3' ' CG2' ' A' ' 115' ' ' VAL . 0.1 OUTLIER -50.29 -44.97 54.14 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 113.684 -1.598 . . . . 0.0 108.636 176.971 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 1.094 HD11 HD22 ' A' ' 68' ' ' LEU . 2.1 mp -64.24 -54.14 38.13 Favored 'General case' 0 C--N 1.341 0.223 0 CA-C-N 115.485 -0.779 . . . . 0.0 109.561 178.282 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.694 ' O ' HG12 ' A' ' 81' ' ' VAL . 5.1 mt -49.18 -39.87 31.05 Favored 'General case' 0 C--N 1.34 0.192 0 N-CA-C 109.735 -0.469 . . . . 0.0 109.735 179.273 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.503 ' HA ' HG12 ' A' ' 81' ' ' VAL . 16.1 mt-30 -59.96 -53.33 59.1 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.75 178.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . 0.542 ' CB ' ' HG3' ' A' ' 111' ' ' GLN . 0.0 OUTLIER -49.26 -49.25 44.24 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.297 179.337 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.85 -59.54 2.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.063 -0.517 . . . . 0.0 111.808 -179.144 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.694 HG12 ' O ' ' A' ' 77' ' ' LEU . 9.0 p -51.28 -23.06 2.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.481 -0.327 . . . . 0.0 111.794 -179.465 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -43.25 -42.29 4.27 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.469 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.42 ' CE1' ' OD1' ' A' ' 84' ' ' ASN . 1.9 t60 -117.9 -91.48 0.55 Allowed 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.031 179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.42 ' OD1' ' CE1' ' A' ' 83' ' ' HIS . 43.0 p-10 178.05 93.2 0.01 OUTLIER 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 120.801 0.334 . . . . 0.0 110.947 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.602 HD22 ' HB2' ' A' ' 40' ' ' GLN . 0.6 OUTLIER -179.05 -170.35 0.18 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.874 179.811 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -147.98 69.3 1.12 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.017 -179.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . 0.473 ' O ' ' HB2' ' A' ' 104' ' ' ARG . 5.6 p-10 -79.24 -45.08 20.49 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.565 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.636 ' HE2' HD12 ' A' ' 90' ' ' LEU . 0.3 OUTLIER -80.64 132.57 35.62 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-O 121.216 0.531 . . . . 0.0 112.053 -179.474 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.792 ' O ' ' O ' ' A' ' 101' ' ' VAL . 0.5 OUTLIER -105.96 125.83 51.46 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 104.891 -2.263 . . . . 0.0 104.891 176.611 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.636 HD12 ' HE2' ' A' ' 88' ' ' TYR . 3.1 mt -122.17 134.49 54.72 Favored 'General case' 0 C--N 1.299 -1.594 0 N-CA-C 115.45 1.648 . . . . 0.0 115.45 -174.276 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 7.8 ttt-85 -129.04 104.49 7.6 Favored 'General case' 0 N--CA 1.451 -0.378 0 N-CA-C 104.628 -2.36 . . . . 0.0 104.628 175.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.434 ' CB ' ' HB3' ' A' ' 98' ' ' SER . 2.7 m -104.21 165.35 11.11 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 115.842 1.793 . . . . 0.0 115.842 -174.119 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.704 HG23 ' HA ' ' A' ' 98' ' ' SER . 0.2 OUTLIER -126.68 27.29 2.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 111.733 -2.485 . . . . 0.0 107.023 178.23 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.539 ' O ' ' N ' ' A' ' 96' ' ' GLY . . . -2.48 -59.02 0.0 OUTLIER Glycine 0 CA--C 1.509 -0.29 0 CA-C-N 112.027 -2.352 . . . . 0.0 115.615 -177.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.475 ' N ' ' O ' ' A' ' 93' ' ' VAL . 1.9 m120 -62.99 61.88 0.01 OUTLIER 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.781 0.324 . . . . 0.0 111.271 -179.005 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.694 ' O ' HG22 ' A' ' 69' ' ' THR . . . 119.46 -23.9 8.3 Favored Glycine 0 N--CA 1.445 -0.735 0 C-N-CA 120.585 -0.817 . . . . 0.0 114.625 178.756 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.723 ' HB3' ' HB ' ' A' ' 67' ' ' VAL . 0.2 OUTLIER -165.36 168.75 16.5 Favored 'General case' 0 C--O 1.216 -0.704 0 CA-C-N 118.876 1.338 . . . . 0.0 112.34 -178.329 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.704 ' HA ' HG23 ' A' ' 93' ' ' VAL . 3.9 m -155.25 142.34 19.25 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.239 178.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.433 HG13 ' HA ' ' A' ' 65' ' ' ASN . 84.1 t -104.12 133.45 48.12 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.801 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.835 -177.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 1.053 HD11 ' HB3' ' A' ' 102' ' ' SER . 3.3 tm? -104.42 120.9 42.29 Favored 'General case' 0 CA--C 1.516 -0.357 0 N-CA-C 113.848 1.055 . . . . 0.0 113.848 -178.205 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.792 ' O ' ' O ' ' A' ' 89' ' ' ASP . 1.5 p -124.07 103.91 13.29 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.805 0 N-CA-C 103.686 -2.709 . . . . 0.0 103.686 174.299 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 1.053 ' HB3' HD11 ' A' ' 100' ' ' LEU . 1.2 t -144.2 165.58 27.44 Favored 'General case' 0 CA--C 1.492 -1.255 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -173.934 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.739 HD21 ' CD1' ' A' ' 60' ' ' LEU . 0.0 OUTLIER 161.86 -81.71 0.0 OUTLIER 'General case' 0 N--CA 1.428 -1.549 0 CA-C-N 112.669 -2.059 . . . . 0.0 110.744 175.78 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.574 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 46.66 31.46 1.4 Allowed 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 179.341 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.584 ' HB3' ' N ' ' A' ' 42' ' ' LEU . 58.3 m 129.68 164.82 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 124.597 1.159 . . . . 0.0 108.453 -178.219 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.553 ' HB3' ' HB2' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -104.96 102.19 11.72 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 113.224 0.824 . . . . 0.0 113.224 -177.737 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.772 ' HB2' ' O ' ' A' ' 41' ' ' GLY . 2.1 mt-30 -169.43 162.59 10.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.49 -0.777 . . . . 0.0 109.84 177.26 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.556 ' HB2' ' HB2' ' A' ' 56' ' ' ALA . 1.2 tpt -164.76 147.34 8.47 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 120.363 -0.535 . . . . 0.0 112.002 178.495 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.649 HG23 ' CD1' ' A' ' 39' ' ' PHE . 0.3 OUTLIER -109.25 164.84 12.09 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.348 179.474 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.876 HD23 HG23 ' A' ' 12' ' ' VAL . 1.0 OUTLIER -50.44 -53.9 26.1 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.199 0.523 . . . . 0.0 110.17 179.316 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.832 ' HA ' ' HD2' ' A' ' 114' ' ' LYS . 1.9 tp-100 -51.22 -65.94 0.47 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.516 -0.765 . . . . 0.0 111.281 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.6 ' HA ' HG12 ' A' ' 115' ' ' VAL . 1.2 t0 -50.14 -47.48 54.19 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-O 121.542 0.687 . . . . 0.0 110.782 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.862 ' HA ' HG21 ' A' ' 59' ' ' VAL . . . -53.47 -50.16 65.93 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.86 179.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.845 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -70.67 -33.58 71.09 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.797 -178.648 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.951 ' CG2' ' HB3' ' A' ' 75' ' ' LYS . 4.0 p -62.45 -52.18 63.08 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.104 0 C-N-CA 119.082 -1.047 . . . . 0.0 110.229 179.524 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.731 HD22 HG13 ' A' ' 59' ' ' VAL . 3.1 mp -64.2 -39.77 94.69 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-N 114.44 -1.255 . . . . 0.0 110.182 -178.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.983 HD21 HD23 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -74.26 -16.67 60.94 Favored 'General case' 0 CA--C 1.511 -0.52 0 C-N-CA 120.369 -0.532 . . . . 0.0 111.161 178.99 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.715 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 0.0 OUTLIER -72.17 -47.96 46.94 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 106.152 -1.795 . . . . 0.0 106.152 176.77 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.423 ' O ' ' HB2' ' A' ' 123' ' ' GLN . . . -72.46 -28.19 62.77 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.846 177.102 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.855 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -68.89 -62.35 1.42 Allowed 'General case' 0 CA--C 1.511 -0.555 0 CA-C-N 115.681 -0.691 . . . . 0.0 110.948 179.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.74 HD22 ' CG ' ' A' ' 9' ' ' HIS . 0.1 OUTLIER -60.47 -37.57 81.44 Favored 'General case' 0 N--CA 1.444 -0.763 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.718 -179.502 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.715 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.1 OUTLIER -70.17 -34.46 73.02 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 112.192 0.442 . . . . 0.0 112.192 -179.836 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.606 ' HB2' HG22 ' A' ' 67' ' ' VAL . 0.0 OUTLIER -90.95 -26.63 19.17 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.554 0.575 . . . . 0.0 112.554 -178.542 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -95.68 -66.26 0.92 Allowed 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.875 0.694 . . . . 0.0 112.875 -178.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -95.85 -65.5 0.97 Allowed 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -178.081 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . 0.642 ' N ' ' O ' ' A' ' 121' ' ' LEU . . . 86.62 75.84 1.26 Allowed Glycine 0 N--CA 1.448 -0.534 0 N-CA-C 111.076 -0.81 . . . . 0.0 111.076 -178.702 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.601 ' HB3' ' O ' ' A' ' 126' ' ' GLY . . . 84.42 -33.57 0.06 Allowed 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 -177.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 166.34 108.98 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.625 178.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . -153.49 23.4 0.75 Allowed Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.681 -0.771 . . . . 0.0 112.623 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 26.0 p . . . . . 0 C--O 1.249 1.042 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.926 179.969 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 201' ' ' ACE . . . . . 0.444 ' H1 ' ' N ' ' A' ' 1' ' ' MET . . . . . . . . 0 C--O 1.232 0.132 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -152.69 121.02 6.29 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.791 0.329 . . . . 0.0 110.93 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -151.97 131.38 12.93 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.906 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 204' ' ' PTR . . . . . 0.599 ' HD2' ' N ' ' B' ' 204' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -86.76 53.47 2.83 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.378 -0.374 . . . . 0.0 110.952 -179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 206' ' ' ASP . . . . . . . . . . . . . 11.3 p30 175.65 97.72 0.09 OUTLIER Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.93 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -45.04 168.78 0.03 OUTLIER 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 122.832 2.355 . . . . 0.0 112.431 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 208' ' ' PHE . . . . . 0.46 ' CZ ' ' HA ' ' A' ' 11' ' ' GLN . 88.6 m-85 62.0 159.59 0.06 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.839 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.336 0 CA-C-N 116.465 -0.334 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.431 0 CA-C-O 120.791 0.329 . . . . 0.0 111.112 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 5.4 p30 47.29 -166.81 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.137 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 1.008 HD11 HD13 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -95.48 -94.98 0.18 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.383 179.048 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.433 ' O ' ' HB2' ' A' ' 8' ' ' LEU . 40.6 t -141.96 -168.74 2.76 Favored 'General case' 0 C--N 1.335 -0.062 0 CA-C-O 120.742 0.306 . . . . 0.0 110.592 179.459 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.884 HD23 HD23 ' A' ' 117' ' ' LEU . 0.8 OUTLIER -95.51 -66.18 0.93 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.457 0.646 . . . . 0.0 111.397 -179.914 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.415 ' OG ' ' HA3' ' A' ' 129' ' ' GLY . 0.9 OUTLIER -64.58 -37.55 87.95 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.093 -0.958 . . . . 0.0 111.492 -178.698 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . 0.512 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 0.5 OUTLIER -66.12 -52.25 50.3 Favored 'General case' 0 CA--C 1.516 -0.362 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 178.469 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 1.008 HD13 HD11 ' A' ' 3' ' ' LEU . 42.5 tp -49.24 -54.22 17.82 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.113 178.328 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.598 ' CG ' HD22 ' A' ' 121' ' ' LEU . 42.7 t-80 -53.45 -41.44 66.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.883 178.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.512 ' HB2' ' O ' ' A' ' 7' ' ' ASP . 3.1 mmt85 -56.47 -57.76 10.93 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.31 -0.859 . . . . 0.0 111.691 -179.506 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.814 ' HG3' HG12 ' A' ' 31' ' ' VAL . 0.6 OUTLIER -64.81 -49.95 68.65 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 120.444 -0.502 . . . . 0.0 111.624 -179.313 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.957 HG23 HD23 ' A' ' 110' ' ' LEU . 9.8 p -60.08 -47.9 90.06 Favored 'Isoleucine or valine' 0 C--O 1.24 0.578 0 CA-C-O 121.119 0.485 . . . . 0.0 110.803 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.658 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 53.0 m -63.59 -49.35 73.7 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.28 179.305 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.443 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 13.3 mtp180 -61.76 -23.5 66.21 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.026 -0.533 . . . . 0.0 110.414 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.622 HD12 ' HA ' ' A' ' 12' ' ' VAL . 8.7 mt -72.61 -61.89 1.64 Allowed 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 121.009 0.433 . . . . 0.0 110.656 179.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.711 HG13 ' C ' ' A' ' 21' ' ' GLY . 23.1 t -70.24 -30.92 45.36 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.242 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.437 ' CG ' ' O ' ' A' ' 13' ' ' SER . 0.4 OUTLIER -71.71 -19.09 62.1 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.724 -0.39 . . . . 0.0 111.132 -179.51 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.443 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 1.8 pt20 -155.63 50.4 0.55 Allowed 'General case' 0 CA--C 1.529 0.141 0 C-N-CA 120.645 -0.422 . . . . 0.0 111.697 178.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -178.75 -66.5 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.814 0.34 . . . . 0.0 111.885 179.511 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.462 ' HB2' ' HA ' ' A' ' 16' ' ' VAL . 1.8 m -77.27 -81.37 0.09 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.536 -178.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.711 ' C ' HG13 ' A' ' 16' ' ' VAL . . . 124.55 -45.25 1.19 Allowed Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 121.081 -0.581 . . . . 0.0 111.802 -179.591 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 179.94 32.08 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 121.101 0.477 . . . . 0.0 110.141 179.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.418 ' HB3' ' O ' ' A' ' 34' ' ' ASN . 21.4 m -80.36 -163.3 0.54 Allowed 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.202 -179.586 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.753 HG21 ' CD2' ' A' ' 39' ' ' PHE . 20.5 m -104.56 142.34 34.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.946 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -105.3 139.91 14.86 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.437 -0.887 . . . . 0.0 113.49 -178.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.919 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -110.59 135.38 51.32 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 179.193 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.58 HD23 ' N ' ' A' ' 28' ' ' ARG . 4.4 tt -104.89 160.58 14.9 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 -178.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.58 ' N ' HD23 ' A' ' 27' ' ' LEU . 0.0 OUTLIER 158.75 55.31 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.202 -179.947 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.431 ' O ' HD23 ' A' ' 3' ' ' LEU . . . 76.7 2.74 77.18 Favored Glycine 0 C--N 1.334 0.426 0 N-CA-C 110.632 -0.987 . . . . 0.0 110.632 -177.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.448 ' C ' ' ND2' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -166.18 165.47 17.58 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 -179.845 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.814 HG12 ' HG3' ' A' ' 11' ' ' GLN . 1.7 p -116.35 128.92 73.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-O 121.4 0.619 . . . . 0.0 111.205 178.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.919 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -115.56 165.68 12.75 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.076 -0.965 . . . . 0.0 110.416 179.759 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.591 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -104.0 137.99 41.19 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.199 0.524 . . . . 0.0 111.855 -179.327 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.526 HD21 HG23 ' A' ' 37' ' ' THR . 2.9 t30 -122.27 113.81 19.94 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.319 -179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.86 -23.53 10.52 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.258 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -50.92 -45.02 60.29 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.891 0.377 . . . . 0.0 110.742 179.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.579 HG21 ' CE1' ' A' ' 39' ' ' PHE . 10.2 t -128.2 -158.12 0.86 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.259 179.404 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 26.0 p -155.11 100.93 2.21 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.953 0.406 . . . . 0.0 111.036 -179.687 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.867 ' O ' HG23 ' A' ' 109' ' ' THR . 10.9 m-85 -86.26 131.85 34.13 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.682 0.754 . . . . 0.0 111.911 -179.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.654 ' H ' ' NE2' ' A' ' 107' ' ' GLN . 0.1 OUTLIER -160.03 81.88 0.71 Allowed 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 114.519 -1.218 . . . . 0.0 109.811 179.728 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.41 ' H ' ' CB ' ' A' ' 107' ' ' GLN . . . 69.32 101.34 0.04 OUTLIER Glycine 0 CA--C 1.525 0.662 0 CA-C-N 115.954 -0.566 . . . . 0.0 113.179 -179.705 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.743 ' HB2' ' NE2' ' A' ' 107' ' ' GLN . 0.0 OUTLIER -159.71 -144.34 0.11 Allowed 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 110.256 -0.275 . . . . 0.0 110.256 179.096 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.587 ' H ' HD12 ' A' ' 42' ' ' LEU . 0.2 OUTLIER -162.19 21.95 0.1 Allowed 'General case' 0 CA--C 1.529 0.145 0 O-C-N 121.832 -0.543 . . . . 0.0 112.088 -179.515 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.655 ' HA ' ' HB3' ' A' ' 48' ' ' ALA . 1.8 mp 66.44 4.45 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 N-CA-C 112.348 0.499 . . . . 0.0 112.348 179.512 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.62 -57.15 3.1 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.902 0.382 . . . . 0.0 111.184 -179.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.0 p -61.63 -59.6 4.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.989 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -179.78 76.81 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.814 -0.708 . . . . 0.0 112.327 -179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.677 ' HB1' ' OE2' ' A' ' 52' ' ' GLU . . . -138.4 -158.61 0.87 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.552 0.215 . . . . 0.0 111.151 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.415 ' O ' ' OE2' ' A' ' 52' ' ' GLU . 9.6 mtm180 -140.5 -174.54 3.99 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 120.874 0.369 . . . . 0.0 111.253 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.764 ' O ' HG23 ' A' ' 54' ' ' VAL . 21.7 tt0 -85.29 -30.83 23.44 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.979 0.418 . . . . 0.0 111.212 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.592 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 0.3 OUTLIER -59.14 -65.31 0.69 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.842 -179.999 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.677 ' OE2' ' HB1' ' A' ' 48' ' ' ALA . 0.1 OUTLIER -35.59 -65.38 0.25 Allowed 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.662 179.947 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.502 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -51.08 -52.31 44.75 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.522 179.822 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.764 HG23 ' O ' ' A' ' 50' ' ' GLU . 94.6 t -55.91 -35.35 40.18 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.139 0 CA-C-O 121.007 0.432 . . . . 0.0 109.941 179.104 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.675 ' O ' HG12 ' A' ' 59' ' ' VAL . 0.2 OUTLIER -70.86 -45.23 64.81 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.409 179.299 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.567 ' HB2' ' HB2' ' A' ' 108' ' ' MET . . . -61.77 -46.93 87.44 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.39 179.48 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 -62.82 -44.04 97.2 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.648 179.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.505 ' OG1' HD13 ' A' ' 27' ' ' LEU . 16.7 p -64.53 -56.54 13.38 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.033 -0.531 . . . . 0.0 110.933 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 1.082 HG23 HD12 ' A' ' 117' ' ' LEU . 12.3 p -60.4 -44.18 95.55 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 C-N-CA 120.695 -0.402 . . . . 0.0 110.59 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.808 HD13 HD23 ' A' ' 103' ' ' LEU . 4.7 tp -55.96 -42.77 76.75 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.903 0.383 . . . . 0.0 110.226 179.293 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 62.7 m -61.83 -58.77 6.68 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.832 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 10.8 m-70 -55.16 -32.74 62.38 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.136 0.493 . . . . 0.0 110.312 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 1.09 HG13 HG11 ' A' ' 66' ' ' VAL . 3.6 t -100.26 59.2 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.282 179.393 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.492 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . -83.4 34.67 0.48 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.61 -179.509 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.522 ' HA ' HG22 ' A' ' 99' ' ' VAL . 7.4 t-20 153.82 -61.78 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 122.855 0.462 . . . . 0.0 110.379 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 1.09 HG11 HG13 ' A' ' 63' ' ' VAL . 18.8 m 40.77 -163.72 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 N-CA-C 112.519 0.563 . . . . 0.0 112.519 179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 1.006 HG22 ' HB2' ' A' ' 123' ' ' GLN . 29.3 m -148.44 75.23 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.437 -1.112 0 CA-C-O 120.939 0.399 . . . . 0.0 111.131 -178.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.929 ' CD2' HD11 ' A' ' 76' ' ' LEU . 0.3 OUTLIER -65.0 98.73 0.31 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.874 -179.849 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.832 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 1.4 p -66.92 -172.3 0.18 Allowed 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.61 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.72 -34.62 12.41 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 120.97 0.414 . . . . 0.0 110.702 179.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.591 ' O ' ' HE2' ' A' ' 75' ' ' LYS . 0.1 OUTLIER -72.28 -65.72 0.74 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.41 179.776 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.866 ' O ' HD12 ' A' ' 76' ' ' LEU . 0.6 OUTLIER -52.84 -33.98 51.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.45 179.583 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.787 HG23 ' O ' ' A' ' 68' ' ' LEU . 11.7 p -62.55 -55.87 23.25 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 178.02 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.67 -24.39 61.15 Favored 'General case' 0 N--CA 1.455 -0.187 0 N-CA-C 108.609 -0.885 . . . . 0.0 108.609 177.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 1.087 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -62.52 -65.2 0.72 Allowed 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.733 -1.122 . . . . 0.0 109.981 178.716 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.929 HD11 ' CD2' ' A' ' 68' ' ' LEU . 4.3 mp -50.73 -39.94 53.09 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 178.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.816 ' O ' HG22 ' A' ' 81' ' ' VAL . 0.5 OUTLIER -54.86 -64.17 0.92 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.706 178.875 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.43 ' HA ' HG22 ' A' ' 81' ' ' VAL . 5.7 tt0 -58.52 -52.39 65.84 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.832 -179.438 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . 0.486 ' CB ' ' HG2' ' A' ' 111' ' ' GLN . 1.3 t -53.83 -27.65 30.96 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.485 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.578 HG22 ' HA ' ' A' ' 85' ' ' LEU . 89.0 m -93.45 -61.82 1.49 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.321 -179.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.816 HG22 ' O ' ' A' ' 77' ' ' LEU . 34.0 m -51.62 -23.83 3.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.829 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -44.57 -60.86 1.78 Allowed 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.723 0.297 . . . . 0.0 111.313 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -119.37 -78.41 0.59 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.879 179.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.2 t-20 -98.42 134.9 40.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.689 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.578 ' HA ' HG22 ' A' ' 80' ' ' THR . 0.6 OUTLIER -121.4 78.48 1.43 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.182 -179.786 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.2 p30 176.97 39.61 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.426 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . 0.515 ' HA ' ' HB2' ' A' ' 104' ' ' ARG . 0.1 OUTLIER -129.48 -44.41 1.24 Allowed 'General case' 0 C--N 1.332 -0.188 0 C-N-CA 120.986 -0.286 . . . . 0.0 111.187 179.636 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.511 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 5.0 m-85 -92.4 138.43 31.52 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 120.257 -0.577 . . . . 0.0 111.026 -179.623 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.788 ' CG ' HG13 ' A' ' 101' ' ' VAL . 1.2 t0 -120.23 148.01 44.22 Favored 'General case' 0 N--CA 1.436 -1.129 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -179.129 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.768 HD12 ' N ' ' A' ' 90' ' ' LEU . 0.0 OUTLIER -147.72 165.44 30.49 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 -177.966 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.594 ' O ' ' CB ' ' A' ' 98' ' ' SER . 10.9 ttm105 -137.4 158.72 43.8 Favored 'General case' 0 C--O 1.218 -0.569 0 CA-C-N 114.414 -1.266 . . . . 0.0 108.869 178.705 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.794 ' O ' HG13 ' A' ' 93' ' ' VAL . 56.8 p -104.42 159.35 15.8 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.714 0.769 . . . . 0.0 112.567 -179.013 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.794 HG13 ' O ' ' A' ' 92' ' ' SER . 0.0 OUTLIER 162.3 149.36 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.44 -0.948 0 CA-C-N 113.931 -1.486 . . . . 0.0 108.17 -179.057 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.427 ' HA3' ' OD1' ' A' ' 97' ' ' ASN . . . 100.38 27.25 7.76 Favored Glycine 0 C--N 1.296 -1.687 0 C-N-CA 120.01 -1.09 . . . . 0.0 113.311 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 15.1 t30 51.47 22.41 1.49 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.161 0.505 . . . . 0.0 109.646 -178.65 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.467 ' O ' ' HA ' ' A' ' 69' ' ' THR . . . 149.6 2.95 0.29 Allowed Glycine 0 N--CA 1.443 -0.861 0 CA-C-N 115.698 -0.683 . . . . 0.0 113.111 -179.357 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.832 ' HA ' ' HA ' ' A' ' 69' ' ' THR . 0.6 OUTLIER -104.61 166.94 10.06 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-N 118.16 0.98 . . . . 0.0 109.959 179.364 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.594 ' CB ' ' O ' ' A' ' 91' ' ' ARG . 0.2 OUTLIER -140.79 164.53 29.97 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-O 121.493 0.663 . . . . 0.0 110.878 179.663 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.522 HG22 ' HA ' ' A' ' 65' ' ' ASN . 0.5 OUTLIER -104.2 145.61 12.73 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.009 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 179.328 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.713 HD13 ' CD1' ' A' ' 116' ' ' LEU . 0.3 OUTLIER -103.55 104.88 15.0 Favored 'General case' 0 CA--C 1.507 -0.695 0 C-N-CA 119.431 -0.908 . . . . 0.0 112.557 -179.131 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.788 HG13 ' CG ' ' A' ' 89' ' ' ASP . 1.3 p -116.35 103.24 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.186 0 N-CA-C 103.256 -2.868 . . . . 0.0 103.256 173.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.638 ' O ' HD23 ' A' ' 103' ' ' LEU . 0.1 OUTLIER -144.85 163.6 33.59 Favored 'General case' 0 C--N 1.303 -1.452 0 C-N-CA 119.131 -1.028 . . . . 0.0 112.597 -174.613 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.808 HD23 HD13 ' A' ' 60' ' ' LEU . 0.1 OUTLIER 159.45 -82.3 0.0 OUTLIER 'General case' 0 N--CA 1.435 -1.197 0 CA-C-N 113.801 -1.545 . . . . 0.0 111.39 176.967 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.569 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 46.28 32.98 1.65 Allowed 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 109.575 -0.528 . . . . 0.0 109.575 179.999 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.659 ' HB3' ' N ' ' A' ' 42' ' ' LEU . 52.7 m 129.55 162.96 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.674 1.19 . . . . 0.0 108.104 -178.021 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.412 ' HB3' ' HB3' ' A' ' 53' ' ' LYS . 0.7 OUTLIER -104.84 102.11 11.67 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 119.838 -0.745 . . . . 0.0 112.394 -178.865 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.743 ' NE2' ' HB2' ' A' ' 42' ' ' LEU . 1.3 mt-30 -168.29 127.98 1.24 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.397 177.698 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.567 ' HB2' ' HB2' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -130.85 143.29 50.62 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.353 0.597 . . . . 0.0 112.324 -179.575 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.867 HG23 ' O ' ' A' ' 39' ' ' PHE . 0.3 OUTLIER -104.55 165.12 11.27 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.432 179.378 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.957 HD23 HG23 ' A' ' 12' ' ' VAL . 0.3 OUTLIER -53.75 -59.53 4.5 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.779 0.323 . . . . 0.0 110.673 179.983 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.867 ' O ' HG23 ' A' ' 115' ' ' VAL . 1.2 tp60 -49.26 -59.57 3.57 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 121.1 0.476 . . . . 0.0 110.986 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.878 ' O ' HD22 ' A' ' 116' ' ' LEU . 1.3 m-20 -50.68 -47.47 58.86 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 121.139 0.495 . . . . 0.0 110.59 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.599 ' HB1' ' CE1' ' A' ' 55' ' ' PHE . . . -49.94 -60.04 3.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.692 179.426 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.663 ' NZ ' HG22 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -66.13 -21.5 66.34 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.153 179.87 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 1.087 HG22 ' CG ' ' A' ' 75' ' ' LYS . 46.0 t -62.62 -61.64 1.55 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.82 0 CA-C-O 121.876 0.846 . . . . 0.0 109.839 179.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.9 ' CB ' HG21 ' A' ' 63' ' ' VAL . 0.0 OUTLIER -63.99 -39.8 94.94 Favored 'General case' 0 N--CA 1.443 -0.8 0 CA-C-N 114.8 -1.091 . . . . 0.0 109.879 179.837 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 1.082 HD12 HG23 ' A' ' 59' ' ' VAL . 0.2 OUTLIER -71.06 -18.63 62.55 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 116.311 -0.404 . . . . 0.0 110.946 179.86 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.563 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 2.7 tt0 -71.99 -54.09 10.98 Favored 'General case' 0 N--CA 1.441 -0.923 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 176.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -71.33 -22.56 61.91 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 114.679 -1.146 . . . . 0.0 111.028 177.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.783 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -76.01 -54.42 6.89 Favored 'General case' 0 CA--C 1.512 -0.513 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.214 179.754 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.598 HD22 ' CG ' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -63.71 -27.94 69.56 Favored 'General case' 0 N--CA 1.448 -0.572 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 178.83 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.563 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -73.18 -43.7 61.01 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.917 -0.583 . . . . 0.0 112.064 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 1.006 ' HB2' HG22 ' A' ' 67' ' ' VAL . 1.5 tt0 -95.11 -25.79 16.29 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 113.496 0.924 . . . . 0.0 113.496 -178.169 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . 0.402 ' CG ' ' O ' ' A' ' 120' ' ' ALA . 2.5 mm-40 -85.24 -66.41 0.9 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 113.024 0.75 . . . . 0.0 113.024 -177.551 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.415 ' CB ' ' HB2' ' A' ' 128' ' ' ARG . 4.7 p -96.08 -48.3 5.73 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.989 0.423 . . . . 0.0 112.079 -178.652 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 121' ' ' LEU . . . 92.73 70.6 1.15 Allowed Glycine 0 CA--C 1.501 -0.825 0 N-CA-C 110.796 -0.922 . . . . 0.0 110.796 -178.221 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.507 ' HA ' HD12 ' A' ' 121' ' ' LEU . . . 51.05 27.3 3.22 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 -177.333 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . 0.415 ' HB2' ' CB ' ' A' ' 125' ' ' SER . 0.0 OUTLIER -92.46 -73.88 0.54 Allowed 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.909 -1.042 . . . . 0.0 111.415 -178.347 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . 0.415 ' HA3' ' OG ' ' A' ' 6' ' ' SER . . . 77.33 19.03 77.33 Favored Glycine 0 C--N 1.332 0.31 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.648 -179.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 18.5 t . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.21 -0.9 . . . . 0.0 110.867 -179.996 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.134 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -99.97 118.33 36.14 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.822 0.344 . . . . 0.0 110.985 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -176.72 151.28 0.89 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.874 179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 204' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -45.82 -79.84 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.685 -179.45 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 206' ' ' ASP . . . . . . . . . . . . . 4.5 p30 -112.68 148.77 40.0 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 120.796 0.331 . . . . 0.0 111.281 -179.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . 0.459 ' CB ' ' NE2' ' A' ' 11' ' ' GLN . 1.9 Cg_endo -40.72 -74.6 0.04 OUTLIER 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 123.573 2.848 . . . . 0.0 113.123 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 208' ' ' PHE . . . . . 0.511 ' CE1' ' HA ' ' A' ' 11' ' ' GLN . 7.8 m-85 -49.8 97.29 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.803 0.335 . . . . 0.0 111.112 -179.67 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.362 0 CA-C-N 116.529 -0.305 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 ptp . . . . . 0 N--CA 1.488 1.446 0 CA-C-O 120.869 0.366 . . . . 0.0 111.153 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.408 ' HB3' ' CG2' ' A' ' 58' ' ' THR . 5.4 p-10 -145.46 -163.5 1.73 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.776 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 1.115 HD22 ' O ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER -138.57 103.11 4.78 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 121.221 0.534 . . . . 0.0 111.225 179.816 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.612 ' O ' ' O ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER 40.15 175.1 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.707 0.765 . . . . 0.0 112.853 179.679 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.739 HD22 ' HA ' ' A' ' 121' ' ' LEU . 0.3 OUTLIER -95.93 -65.84 0.95 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.718 179.308 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.418 ' HB2' HD13 ' A' ' 121' ' ' LEU . 1.0 OUTLIER -60.18 -33.05 71.67 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 114.677 -1.147 . . . . 0.0 111.706 -179.113 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -65.48 -50.49 65.13 Favored 'General case' 0 CA--C 1.517 -0.29 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 178.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.888 HD23 HD11 ' A' ' 117' ' ' LEU . 22.3 tp -55.32 -44.58 75.95 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.887 179.252 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.569 ' CD2' HD22 ' A' ' 121' ' ' LEU . 79.9 t60 -64.82 -41.32 95.86 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.557 0.694 . . . . 0.0 110.0 179.238 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.485 ' HB3' ' CE1' ' B' ' 208' ' ' PHE . 1.5 mtt180 -57.91 -50.13 74.38 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.745 -1.116 . . . . 0.0 110.996 -179.34 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.671 ' HG3' ' CG1' ' A' ' 31' ' ' VAL . 1.4 pt20 -66.63 -56.67 9.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.487 -179.581 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.969 ' HA ' HD12 ' A' ' 15' ' ' LEU . 10.8 p -53.74 -48.32 61.17 Favored 'Isoleucine or valine' 0 C--O 1.242 0.704 0 CA-C-O 121.322 0.582 . . . . 0.0 111.142 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.679 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 62.7 m -62.52 -40.46 96.84 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.256 -179.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.466 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 1.2 tpm_? -64.69 -30.89 71.92 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.979 0.418 . . . . 0.0 110.095 -179.797 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.969 HD12 ' HA ' ' A' ' 12' ' ' VAL . 4.6 mt -71.33 -65.08 0.8 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.844 -179.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.721 ' CG2' ' HB3' ' A' ' 110' ' ' LEU . 50.2 t -58.77 -45.95 91.02 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.403 0 C-N-CA 120.556 -0.458 . . . . 0.0 111.434 -179.003 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.45 ' CG ' ' O ' ' A' ' 13' ' ' SER . 6.1 mm-40 -62.7 -12.69 25.29 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.604 -178.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.466 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 3.6 pt20 -170.59 60.18 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.163 0 CA-C-O 120.786 0.326 . . . . 0.0 111.56 178.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.534 ' N ' ' O ' ' A' ' 15' ' ' LEU . 0.2 OUTLIER 177.79 -58.72 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 179.817 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.1 m -87.93 -79.63 0.29 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.853 0.359 . . . . 0.0 111.748 -178.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.414 ' O ' ' CB ' ' A' ' 22' ' ' ASP . . . 107.64 54.11 0.65 Allowed Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.726 -179.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.582 ' H ' HG13 ' A' ' 16' ' ' VAL . 0.0 OUTLIER 83.2 0.43 1.13 Allowed 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 179.338 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -60.73 -167.03 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 110.37 -0.233 . . . . 0.0 110.37 179.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.514 ' HA ' HG22 ' A' ' 109' ' ' THR . 12.7 m -104.47 138.31 41.05 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 109.84 -0.43 . . . . 0.0 109.84 179.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.528 ' CA ' ' HG ' ' A' ' 110' ' ' LEU . . . -114.57 156.24 15.79 Favored Glycine 0 N--CA 1.449 -0.487 0 C-N-CA 120.209 -0.996 . . . . 0.0 113.236 -179.067 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.905 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -114.73 151.04 34.35 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.35 -0.241 . . . . 0.0 110.35 179.407 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.769 HD23 ' O ' ' A' ' 27' ' ' LEU . 5.9 tt -130.18 106.93 8.93 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.141 0.496 . . . . 0.0 112.037 -179.588 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.612 ' HG2' ' HD2' ' A' ' 26' ' ' LYS . 0.2 OUTLIER -134.33 52.28 2.07 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.584 -0.734 . . . . 0.0 109.253 178.457 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.413 ' O ' ' HG ' ' A' ' 3' ' ' LEU . . . 83.79 4.22 88.94 Favored Glycine 0 C--N 1.332 0.358 0 N-CA-C 109.582 -1.407 . . . . 0.0 109.582 -176.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.463 ' C ' ' ND2' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -166.07 166.7 17.0 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 106.701 -1.592 . . . . 0.0 106.701 -179.512 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.847 HG13 HD11 ' A' ' 15' ' ' LEU . 11.3 p -113.54 137.96 44.83 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.601 0 C-N-CA 120.003 -0.679 . . . . 0.0 112.281 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.905 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -126.74 164.88 20.35 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.0 -1.0 . . . . 0.0 110.654 178.656 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -104.51 148.19 26.75 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.139 0.495 . . . . 0.0 111.623 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 42.2 t30 -135.97 117.52 14.85 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.301 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.14 3.33 9.27 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.4 -179.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -61.46 -53.08 61.14 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.951 0.405 . . . . 0.0 110.537 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.537 ' C ' HG22 ' A' ' 38' ' ' THR . 0.0 OUTLIER -128.04 -89.37 0.53 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.193 179.626 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.596 ' O ' ' HB3' ' A' ' 39' ' ' PHE . 0.1 OUTLIER 166.01 -105.45 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.3 0 N-CA-C 110.259 -0.275 . . . . 0.0 110.259 179.457 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.742 ' CZ ' HD13 ' A' ' 85' ' ' LEU . 0.1 OUTLIER 169.25 -164.46 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 110.03 -0.359 . . . . 0.0 110.03 179.63 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.565 ' HB3' ' O ' ' A' ' 39' ' ' PHE . 0.1 OUTLIER 150.86 55.44 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.371 0.669 . . . . 0.0 110.441 179.833 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.559 ' O ' ' HB2' ' A' ' 107' ' ' GLN . . . 67.1 -65.39 0.21 Allowed Glycine 0 CA--C 1.523 0.578 0 C-N-CA 120.995 -0.621 . . . . 0.0 112.616 -179.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.804 ' O ' ' HB3' ' A' ' 105' ' ' SER . 0.4 OUTLIER 24.28 -138.83 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 123.203 0.601 . . . . 0.0 112.58 179.444 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.521 HG23 ' O ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -172.64 22.43 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 O-C-N 121.849 -0.532 . . . . 0.0 112.065 -179.934 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.709 HD12 ' N ' ' A' ' 44' ' ' ILE . 1.3 mp 63.37 2.42 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.282 0 CA-C-O 120.822 0.344 . . . . 0.0 111.687 179.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.93 -22.15 25.83 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.839 0.352 . . . . 0.0 111.003 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.45 ' CB ' HD21 ' A' ' 42' ' ' LEU . 0.3 OUTLIER -101.8 -30.91 11.01 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.397 -179.705 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 177.94 -30.03 0.07 OUTLIER Glycine 0 CA--C 1.519 0.342 0 C-N-CA 120.169 -1.015 . . . . 0.0 113.556 -179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.57 ' HB2' ' OE1' ' A' ' 107' ' ' GLN . . . -48.32 173.46 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 117.1 0.45 . . . . 0.0 111.488 -179.584 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.438 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 23.0 mtp85 -121.89 173.24 7.63 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.284 -0.416 . . . . 0.0 111.527 -179.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.87 ' O ' HG22 ' A' ' 54' ' ' VAL . 0.8 OUTLIER -66.81 -29.97 70.05 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.115 0.483 . . . . 0.0 110.54 179.762 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.536 ' CB ' ' CB ' ' A' ' 26' ' ' LYS . 0.3 OUTLIER -49.75 -65.18 0.61 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.461 179.548 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.505 ' HB2' ' HG2' ' A' ' 107' ' ' GLN . 0.2 OUTLIER -52.56 -62.21 1.79 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.264 -179.15 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.593 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -46.68 -59.14 3.22 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 -178.563 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.87 HG22 ' O ' ' A' ' 50' ' ' GLU . 15.9 m -51.91 -47.36 41.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.46 0 CA-C-O 120.887 0.375 . . . . 0.0 110.732 -179.783 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.567 ' HE2' HG23 ' A' ' 31' ' ' VAL . 0.1 OUTLIER -57.29 -46.68 82.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.553 179.156 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.691 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -54.69 -50.99 66.94 Favored 'General case' 0 CA--C 1.521 -0.15 0 CA-C-O 120.85 0.357 . . . . 0.0 110.681 179.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -57.92 -40.24 79.95 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.4 179.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.47 HG22 ' CD2' ' A' ' 62' ' ' HIS . 0.9 OUTLIER -67.28 -63.98 0.95 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.978 179.791 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.919 ' O ' HG22 ' A' ' 63' ' ' VAL . 14.4 p -53.36 -40.88 42.01 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.18 0 CA-C-O 120.793 0.33 . . . . 0.0 110.342 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.852 HD13 ' CD2' ' A' ' 103' ' ' LEU . 0.5 OUTLIER -64.09 -38.8 92.37 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.758 179.464 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 61.3 m -72.69 -44.86 61.23 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.167 179.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . 0.47 ' CD2' HG22 ' A' ' 58' ' ' THR . 53.3 m-70 -51.72 -54.4 28.74 Favored 'General case' 0 CA--C 1.521 -0.163 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.126 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 1.041 HG12 HG11 ' A' ' 66' ' ' VAL . 0.0 OUTLIER -54.11 -78.8 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.806 179.266 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.61 ' H ' HG23 ' A' ' 63' ' ' VAL . . . 60.96 17.0 7.46 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.354 -179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.557 ' O ' HG22 ' A' ' 66' ' ' VAL . 0.6 OUTLIER 153.1 -68.22 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 122.765 0.426 . . . . 0.0 110.943 -179.831 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 1.041 HG11 HG12 ' A' ' 63' ' ' VAL . 23.1 m 49.01 -164.95 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.32 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.054 -179.473 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.813 ' HB ' ' HB3' ' A' ' 97' ' ' ASN . 15.8 m -152.26 50.26 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.169 0 CA-C-O 121.129 0.49 . . . . 0.0 110.842 -178.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.886 HD22 ' CD1' ' A' ' 76' ' ' LEU . 1.0 OUTLIER -43.33 103.93 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.343 -179.485 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.497 HG22 ' O ' ' A' ' 96' ' ' GLY . 15.7 p -71.67 -164.82 0.13 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.773 178.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.1 -34.91 68.8 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.912 0.386 . . . . 0.0 110.808 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -70.69 -50.07 40.37 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.076 0.465 . . . . 0.0 110.434 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.833 ' HB3' HD23 ' A' ' 68' ' ' LEU . 66.7 m-20 -66.71 -36.25 82.05 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.641 179.774 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 38.8 m -65.87 -40.78 91.94 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.05 0.452 . . . . 0.0 109.812 178.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -72.13 -27.11 62.41 Favored 'General case' 0 CA--C 1.514 -0.428 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 177.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 1.035 ' HG3' HG12 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -57.1 -59.72 4.67 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 114.044 -1.434 . . . . 0.0 109.642 178.228 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.907 HD21 HD21 ' A' ' 100' ' ' LEU . 3.2 mp -61.65 -49.89 74.71 Favored 'General case' 0 CA--C 1.519 -0.221 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 178.707 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.593 ' O ' HG12 ' A' ' 81' ' ' VAL . 0.1 OUTLIER -44.07 -58.45 2.82 Favored 'General case' 0 CA--C 1.523 -0.086 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.263 179.948 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.543 ' HA ' HG12 ' A' ' 81' ' ' VAL . 25.8 mt-30 -61.07 -44.42 97.4 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.401 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . 0.586 ' O ' HD11 ' A' ' 85' ' ' LEU . 1.0 OUTLIER -62.1 -22.44 65.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.96 179.649 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.589 HG22 ' O ' ' A' ' 85' ' ' LEU . 0.9 OUTLIER -94.54 -40.07 10.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.278 -179.66 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.593 HG12 ' O ' ' A' ' 77' ' ' LEU . 14.5 p -85.3 -6.02 10.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.936 -179.589 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.37 -72.82 0.08 Allowed 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 120.808 0.337 . . . . 0.0 111.235 -179.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 10.1 t-80 -118.98 39.96 3.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.179 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 5.7 m-20 57.65 106.07 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.026 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.742 HD13 ' CZ ' ' A' ' 39' ' ' PHE . 1.3 pp -177.08 97.07 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.787 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -97.45 30.89 2.7 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.894 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 22.1 p-10 -66.04 -17.11 64.48 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.302 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.429 ' OH ' ' HG3' ' A' ' 108' ' ' MET . 24.8 m-85 -98.43 139.45 34.15 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 120.841 0.353 . . . . 0.0 110.376 179.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.686 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.4 OUTLIER -112.87 144.74 41.91 Favored 'General case' 0 N--CA 1.437 -1.111 0 N-CA-C 107.326 -1.361 . . . . 0.0 107.326 179.301 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.73 HD21 HD22 ' A' ' 100' ' ' LEU . 14.7 mt -137.62 132.46 33.05 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 114.618 1.34 . . . . 0.0 114.618 -176.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.558 ' HB3' ' HB ' ' A' ' 99' ' ' VAL . 4.1 ttp180 -104.78 165.48 11.04 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 105.291 -2.114 . . . . 0.0 105.291 175.137 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.608 ' HA ' ' HA ' ' A' ' 98' ' ' SER . 9.7 p -134.33 164.15 28.05 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 116.235 1.939 . . . . 0.0 116.235 -177.258 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.676 ' C ' ' O ' ' A' ' 97' ' ' ASN . 1.5 t -140.04 22.4 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.429 0 CA-C-N 111.5 -2.591 . . . . 0.0 107.142 178.148 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.473 ' N ' ' O ' ' A' ' 97' ' ' ASN . . . 69.14 -170.58 41.09 Favored Glycine 0 N--CA 1.439 -1.149 0 CA-C-N 113.265 -1.789 . . . . 0.0 116.26 -178.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -48.6 -36.68 16.22 Favored 'General case' 0 CA--C 1.506 -0.739 0 CA-C-N 113.896 -1.152 . . . . 0.0 108.846 -179.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.497 ' O ' HG22 ' A' ' 69' ' ' THR . . . -62.62 -43.64 98.71 Favored Glycine 0 N--CA 1.431 -1.687 0 N-CA-C 109.867 -1.293 . . . . 0.0 109.867 177.772 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.813 ' HB3' ' HB ' ' A' ' 67' ' ' VAL . 0.0 OUTLIER -165.27 168.64 16.77 Favored 'General case' 0 N--CA 1.433 -1.325 0 CA-C-O 121.842 0.83 . . . . 0.0 113.019 179.675 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.624 ' CA ' HG23 ' A' ' 93' ' ' VAL . 1.6 m -152.92 149.91 28.72 Favored 'General case' 0 C--N 1.312 -1.06 0 CA-C-N 114.434 -1.257 . . . . 0.0 107.758 178.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.558 ' HB ' ' HB3' ' A' ' 91' ' ' ARG . 38.9 t -104.07 156.1 5.68 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 C-N-CA 120.634 -0.427 . . . . 0.0 111.787 -177.259 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.907 HD21 HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -109.2 128.14 54.8 Favored 'General case' 0 CA--C 1.515 -0.402 0 N-CA-C 114.328 1.233 . . . . 0.0 114.328 -177.899 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.686 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 17.7 t -141.3 104.31 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.929 0 N-CA-C 104.712 -2.329 . . . . 0.0 104.712 174.935 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.53 ' O ' HD23 ' A' ' 103' ' ' LEU . 0.1 OUTLIER -145.78 165.23 29.45 Favored 'General case' 0 C--N 1.311 -1.082 0 C-N-CA 118.495 -1.282 . . . . 0.0 113.788 -174.909 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.852 ' CD2' HD13 ' A' ' 60' ' ' LEU . 0.0 OUTLIER 154.51 -89.36 0.0 OUTLIER 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 113.456 -1.702 . . . . 0.0 111.358 176.896 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.533 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 59.07 21.33 9.26 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 -179.52 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.804 ' HB3' ' O ' ' A' ' 42' ' ' LEU . 5.4 m 140.92 173.26 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.418 0 C-N-CA 124.432 1.093 . . . . 0.0 108.612 -178.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -104.81 102.22 11.78 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 119.986 -0.685 . . . . 0.0 112.545 -178.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.691 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -168.15 165.06 13.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.295 -0.866 . . . . 0.0 109.4 177.621 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.744 ' CE ' ' HB2' ' A' ' 113' ' ' ALA . 2.1 ttp -165.75 147.45 7.2 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.062 0.458 . . . . 0.0 111.916 179.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.7 HG23 ' CD1' ' A' ' 39' ' ' PHE . 0.6 OUTLIER -114.7 161.38 18.22 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.733 -0.667 . . . . 0.0 109.794 178.867 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.721 ' HB3' ' CG2' ' A' ' 16' ' ' VAL . 18.2 mt -50.35 -59.22 4.2 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.89 0.376 . . . . 0.0 110.61 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.904 ' O ' HG13 ' A' ' 115' ' ' VAL . 14.6 tp60 -45.13 -64.63 0.67 Allowed 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.935 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.855 ' O ' HG22 ' A' ' 115' ' ' VAL . 0.4 OUTLIER -51.31 -38.14 51.4 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-O 121.526 0.679 . . . . 0.0 110.405 179.516 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.744 ' HB2' ' CE ' ' A' ' 108' ' ' MET . . . -55.05 -52.36 63.44 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.116 179.672 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.796 ' HZ2' HG22 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -79.63 -20.57 46.47 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.824 -178.866 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 1.035 HG12 ' HG3' ' A' ' 75' ' ' LYS . 9.0 m -65.17 -50.63 72.94 Favored 'Isoleucine or valine' 0 C--O 1.244 0.767 0 CA-C-O 122.129 0.966 . . . . 0.0 109.243 179.173 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.943 HD12 HG23 ' A' ' 115' ' ' VAL . 7.5 mp -69.31 -45.67 68.98 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 114.298 -1.319 . . . . 0.0 109.548 178.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.888 HD11 HD23 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -68.89 -15.2 63.43 Favored 'General case' 0 CA--C 1.515 -0.383 0 C-N-CA 120.42 -0.512 . . . . 0.0 110.805 179.328 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.648 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 8.6 tp10 -74.03 -51.74 14.91 Favored 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 106.295 -1.742 . . . . 0.0 106.295 177.101 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.497 ' HB2' ' OD2' ' A' ' 72' ' ' ASP . . . -72.34 -28.8 63.27 Favored 'General case' 0 N--CA 1.449 -0.475 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.572 177.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.778 ' HA ' HG12 ' A' ' 66' ' ' VAL . . . -69.27 -55.16 11.33 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.98 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.739 ' HA ' HD22 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -64.24 -48.93 73.92 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.262 -179.73 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.648 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -59.28 -39.88 84.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.394 -0.367 . . . . 0.0 111.906 -179.833 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.584 ' HG3' HG13 ' A' ' 67' ' ' VAL . 12.0 tm0? -84.84 -34.04 22.74 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -178.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 19.4 mm-40 -96.48 -68.4 0.8 Allowed 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -177.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -97.24 -66.4 0.9 Allowed 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -178.219 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . 0.602 ' N ' ' O ' ' A' ' 121' ' ' LEU . . . 96.7 -61.35 1.18 Allowed Glycine 0 N--CA 1.449 -0.438 0 CA-C-N 115.686 -0.688 . . . . 0.0 111.882 -179.009 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -112.51 38.63 2.69 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.389 0.614 . . . . 0.0 109.776 178.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . 0.404 ' NE ' ' HB3' ' A' ' 4' ' ' SER . 0.0 OUTLIER 71.05 111.35 0.06 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.778 -179.431 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 50.2 23.67 6.09 Favored Glycine 0 CA--C 1.517 0.213 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.793 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 11.2 p . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.258 -0.877 . . . . 0.0 110.933 -179.998 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.122 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 3.8 p30 -111.86 -43.05 3.67 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.85 0.357 . . . . 0.0 110.895 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 60.76 -174.09 0.12 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.019 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 204' ' ' PTR . . . . . 0.551 ' HE2' ' CE ' ' A' ' 26' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 21.3 p30 -135.32 49.76 2.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.843 0.354 . . . . 0.0 110.935 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 206' ' ' ASP . . . . . 0.431 ' O ' ' N ' ' B' ' 208' ' ' PHE . 2.5 m-20 58.37 163.98 0.08 OUTLIER Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.65 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . 0.47 ' HB3' HD23 ' A' ' 3' ' ' LEU . 34.8 Cg_endo -63.38 62.83 0.18 Allowed 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.777 2.318 . . . . 0.0 112.974 -179.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 208' ' ' PHE . . . . . 0.597 ' HB3' ' HB3' ' A' ' 11' ' ' GLN . 0.0 OUTLIER 44.23 18.17 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.393 0 CA-C-O 121.023 0.44 . . . . 0.0 111.904 179.37 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 209' ' ' NH2 . . . . . 0.421 ' N ' ' O ' ' B' ' 207' ' ' PRO . . . . . . . . 0 C--N 1.329 -0.32 0 O-C-N 122.289 -0.257 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.417 ' O ' ' N ' ' A' ' 3' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.416 0 CA-C-O 120.681 0.277 . . . . 0.0 111.228 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.554 ' ND2' HD22 ' A' ' 8' ' ' LEU . 0.7 OUTLIER 41.46 -90.67 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.832 -179.991 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.494 HD11 ' CA ' ' A' ' 8' ' ' LEU . 0.2 OUTLIER -159.69 -46.37 0.05 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.831 0.348 . . . . 0.0 110.983 -179.752 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 169.59 138.65 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.423 -179.855 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 1.07 HD21 ' HB1' ' A' ' 120' ' ' ALA . 0.0 OUTLIER -55.97 -65.46 0.6 Allowed 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 111.885 0.328 . . . . 0.0 111.885 -179.739 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p -49.98 -42.8 49.72 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.092 0.405 . . . . 0.0 112.092 -179.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . 0.422 ' O ' ' NE2' ' A' ' 11' ' ' GLN . 1.4 m-20 -73.42 -60.51 2.21 Favored 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 121.116 0.484 . . . . 0.0 110.009 179.724 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.932 HD23 HD11 ' A' ' 117' ' ' LEU . 12.4 tp -47.0 -44.18 20.03 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.394 179.157 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.734 ' CG ' HD22 ' A' ' 121' ' ' LEU . 38.4 t-80 -65.26 -44.84 86.8 Favored 'General case' 0 CA--C 1.515 -0.391 0 CA-C-O 121.644 0.735 . . . . 0.0 109.35 178.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.467 ' HB3' ' CZ ' ' B' ' 208' ' ' PHE . 12.8 mmt85 -54.78 -54.67 39.08 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 114.772 -1.104 . . . . 0.0 111.584 -179.383 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.627 ' HG3' HG22 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -65.95 -48.14 72.32 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 120.951 -0.3 . . . . 0.0 111.757 -179.274 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.035 HG23 HD23 ' A' ' 110' ' ' LEU . 9.6 p -63.52 -49.6 81.89 Favored 'Isoleucine or valine' 0 C--O 1.243 0.725 0 CA-C-O 121.056 0.455 . . . . 0.0 111.266 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.654 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 72.8 m -56.41 -57.88 10.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.38 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.456 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 30.8 ttm180 -59.69 -35.47 74.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.149 0.5 . . . . 0.0 110.628 -179.645 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.573 ' CD1' HG23 ' A' ' 31' ' ' VAL . 10.6 mt -56.92 -65.33 0.63 Allowed 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.866 -0.606 . . . . 0.0 112.155 -179.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.635 HG22 ' HB3' ' A' ' 20' ' ' SER . 1.4 t -70.93 -26.44 27.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 C-N-CA 120.276 -0.57 . . . . 0.0 110.724 -179.429 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.47 ' CG ' ' O ' ' A' ' 13' ' ' SER . 8.1 mm-40 -72.83 -21.87 60.89 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.367 179.596 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.456 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 11.7 pt20 -161.66 60.85 0.26 Allowed 'General case' 0 C--O 1.232 0.138 0 CA-C-O 120.767 0.317 . . . . 0.0 111.189 179.323 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 176.39 -61.62 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.778 179.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.652 ' OG ' ' HB1' ' A' ' 33' ' ' ALA . 0.4 OUTLIER -78.43 -81.28 0.1 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.78 0.324 . . . . 0.0 111.647 -179.229 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 106.06 60.32 0.61 Allowed Glycine 0 N--CA 1.45 -0.379 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.327 -179.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.8 t70 68.76 28.4 5.53 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.783 0.325 . . . . 0.0 111.142 -179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -91.02 -162.92 0.96 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.369 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.691 HG23 HG22 ' A' ' 109' ' ' THR . 0.0 OUTLIER -103.96 165.24 11.17 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 179.579 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.521 ' HA2' ' O ' ' A' ' 32' ' ' ALA . . . -133.67 153.02 20.67 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 120.013 -1.089 . . . . 0.0 113.276 -179.182 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.736 ' HG3' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -116.9 131.38 56.97 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 179.491 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.512 HD21 ' HA ' ' A' ' 2' ' ' ASN . 1.9 tt -105.93 146.75 29.6 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.168 0.509 . . . . 0.0 111.777 -179.526 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.584 ' NH2' HG11 ' A' ' 54' ' ' VAL . 0.0 OUTLIER 171.31 53.94 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.032 -179.935 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 86.27 -0.65 87.34 Favored Glycine 0 N--CA 1.448 -0.504 0 N-CA-C 110.261 -1.135 . . . . 0.0 110.261 -177.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.482 ' HA ' ' HA ' ' B' ' 207' ' ' PRO . 0.0 OUTLIER -165.95 165.49 18.05 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 179.683 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.627 HG22 ' HG3' ' A' ' 11' ' ' GLN . 0.9 OUTLIER -121.02 116.62 50.36 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.633 0 C-N-CA 120.151 -0.62 . . . . 0.0 111.351 179.794 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.736 ' HB3' ' HG3' ' A' ' 26' ' ' LYS . . . -104.74 166.99 10.01 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.462 -0.79 . . . . 0.0 110.596 -179.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.652 ' HB1' ' OG ' ' A' ' 20' ' ' SER . . . -102.8 138.42 39.71 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.345 0.593 . . . . 0.0 111.872 -178.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 17.5 t30 -118.98 118.08 30.52 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.487 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.74 -29.79 5.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.226 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -59.38 -44.33 92.78 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.924 0.392 . . . . 0.0 110.911 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 30.6 p -121.33 -174.86 2.94 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.711 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 45.3 p -124.0 -115.64 0.29 Allowed 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.14 179.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.56 ' C ' ' NE2' ' A' ' 107' ' ' GLN . 0.4 OUTLIER -171.47 -84.81 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 121.035 -0.266 . . . . 0.0 111.529 179.712 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.684 ' HB3' HD13 ' A' ' 85' ' ' LEU . 0.5 OUTLIER 80.74 32.26 0.15 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 122.726 0.41 . . . . 0.0 112.001 179.872 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.534 ' N ' HE21 ' A' ' 107' ' ' GLN . . . 71.55 -20.11 0.83 Allowed Glycine 0 CA--C 1.526 0.746 0 C-N-CA 121.286 -0.483 . . . . 0.0 113.447 -179.743 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.902 HD11 ' HB2' ' A' ' 46' ' ' SER . 7.0 tp -25.95 140.33 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.292 0.637 . . . . 0.0 112.635 179.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -99.15 30.47 3.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.392 -179.799 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.624 HD11 ' HD2' ' A' ' 53' ' ' LYS . 1.2 mp 67.5 3.24 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 179.79 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -86.71 -27.97 23.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.692 0.282 . . . . 0.0 111.475 -179.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.902 ' HB2' HD11 ' A' ' 42' ' ' LEU . 0.3 OUTLIER -91.32 -36.21 13.99 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.511 -179.632 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 156.13 48.49 0.01 OUTLIER Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.368 -0.92 . . . . 0.0 113.163 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.536 ' HB1' ' OE1' ' A' ' 107' ' ' GLN . . . -119.15 -172.46 2.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.851 0.358 . . . . 0.0 110.749 179.566 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -119.69 129.32 54.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.132 179.268 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.917 ' O ' HG22 ' A' ' 54' ' ' VAL . 2.6 mt-10 -43.42 -30.06 0.51 Allowed 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 120.96 0.41 . . . . 0.0 111.043 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.648 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 0.0 OUTLIER -51.32 -59.92 3.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.881 -0.599 . . . . 0.0 111.303 179.769 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.618 ' CB ' ' HG2' ' A' ' 107' ' ' GLN . 3.3 mm-40 -53.57 -40.07 65.31 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.348 0.594 . . . . 0.0 109.886 179.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.624 ' HD2' HD11 ' A' ' 44' ' ' ILE . 0.1 OUTLIER -62.79 -65.49 0.68 Allowed 'General case' 0 C--O 1.237 0.404 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.941 179.254 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.94 ' O ' HG23 ' A' ' 58' ' ' THR . 0.5 OUTLIER -51.37 -40.65 24.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.496 0 CA-C-O 120.862 0.363 . . . . 0.0 110.319 179.919 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.583 ' CZ ' ' HB1' ' A' ' 113' ' ' ALA . 0.8 OUTLIER -56.76 -44.86 82.2 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 178.586 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.716 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -56.61 -60.21 3.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.145 0.498 . . . . 0.0 109.794 178.56 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.452 ' O ' ' CB ' ' A' ' 61' ' ' SER . 2.0 mm-40 -46.95 -37.38 8.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.323 179.547 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.94 HG23 ' O ' ' A' ' 54' ' ' VAL . 26.3 p -66.87 -50.78 61.41 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.608 -179.423 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 1.007 ' CG1' HD12 ' A' ' 117' ' ' LEU . 0.1 OUTLIER -62.2 -46.33 96.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 C-N-CA 120.187 -0.605 . . . . 0.0 112.349 -179.065 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.664 HD11 HD21 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -73.86 -28.48 61.6 Favored 'General case' 0 CA--C 1.515 -0.404 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.412 -179.313 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.452 ' CB ' ' O ' ' A' ' 57' ' ' GLN . 7.0 t -65.26 -54.58 27.22 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 178.019 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . 0.49 ' HB3' ' CD2' ' A' ' 5' ' ' LEU . 0.1 OUTLIER -69.06 -20.86 64.11 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 177.894 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 1.07 HG22 ' HB2' ' A' ' 120' ' ' ALA . 94.3 t -110.73 60.19 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.039 178.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -80.77 21.94 0.63 Allowed 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.137 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER 164.95 -53.08 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.908 0.385 . . . . 0.0 110.387 -179.55 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.94 ' CG1' HG13 ' A' ' 63' ' ' VAL . 27.2 m 43.49 -134.87 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.895 179.727 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.526 ' O ' ' O ' ' A' ' 98' ' ' SER . 3.5 p -156.4 -31.74 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 C-N-CA 120.586 -0.446 . . . . 0.0 111.835 -179.836 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 1.077 HD22 HD11 ' A' ' 76' ' ' LEU . 1.1 mt 37.84 98.73 0.0 OUTLIER 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.434 -0.803 . . . . 0.0 113.052 178.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 33.9 p -73.46 -179.0 3.26 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.236 -0.654 . . . . 0.0 109.236 178.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.49 -34.09 3.04 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.998 0.428 . . . . 0.0 110.964 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -64.92 -63.06 1.2 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.826 -0.625 . . . . 0.0 110.929 179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.92 ' O ' HD12 ' A' ' 76' ' ' LEU . 0.6 OUTLIER -55.86 -39.3 71.28 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.761 -179.899 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -55.67 -59.84 4.29 Favored 'General case' 0 C--O 1.241 0.625 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.507 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . . . -56.9 -28.86 62.43 Favored 'General case' 0 N--CA 1.456 -0.15 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 177.579 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 1.083 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -60.91 -54.82 40.39 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 114.651 -1.159 . . . . 0.0 110.412 179.057 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 1.077 HD11 HD22 ' A' ' 68' ' ' LEU . 4.0 mp -60.71 -54.09 49.46 Favored 'General case' 0 C--O 1.232 0.183 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.674 179.651 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.72 ' O ' HG22 ' A' ' 81' ' ' VAL . 3.7 pp -57.88 -29.2 64.85 Favored 'General case' 0 C--N 1.333 -0.122 0 C-N-CA 120.462 -0.495 . . . . 0.0 110.583 -179.738 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.631 ' N ' HD12 ' A' ' 77' ' ' LEU . 44.4 tt0 -66.26 -59.41 3.76 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.985 0.421 . . . . 0.0 110.215 179.063 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 84.1 p -57.91 -28.25 64.06 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.799 179.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 4.3 m -80.95 -59.26 2.73 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.284 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.72 HG22 ' O ' ' A' ' 77' ' ' LEU . 25.0 m -55.6 -26.07 19.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.582 -179.684 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.31 -30.08 0.76 Allowed 'General case' 0 N--CA 1.464 0.231 0 CA-C-O 120.814 0.34 . . . . 0.0 111.237 179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -147.17 149.21 32.53 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.747 179.786 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 22.8 m-20 -62.46 83.69 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.915 -179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.684 HD13 ' HB3' ' A' ' 40' ' ' GLN . 1.6 tt -177.72 114.8 0.08 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.016 179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 35.4 t30 -105.04 107.86 19.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.636 179.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 30.6 p30 -115.71 -20.36 10.13 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.556 -179.646 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.515 ' CG ' ' HB3' ' A' ' 102' ' ' SER . 0.9 OUTLIER -99.06 141.75 31.42 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.226 -179.499 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.664 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.0 OUTLIER -113.42 139.55 48.82 Favored 'General case' 0 N--CA 1.436 -1.157 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 179.945 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.682 HD11 ' CB ' ' A' ' 76' ' ' LEU . 22.8 mt -137.37 147.18 45.31 Favored 'General case' 0 C--N 1.312 -1.062 0 N-CA-C 112.909 0.707 . . . . 0.0 112.909 -177.583 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.439 ' O ' ' CB ' ' A' ' 98' ' ' SER . 25.9 mtm180 -125.32 142.69 51.35 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 108.28 -1.007 . . . . 0.0 108.28 177.797 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.534 ' O ' HG13 ' A' ' 93' ' ' VAL . 4.0 p -105.3 139.13 40.41 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 113.49 0.922 . . . . 0.0 113.49 -178.567 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.534 HG13 ' O ' ' A' ' 92' ' ' SER . 20.5 m -161.59 -133.38 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.774 0 CA-C-N 113.674 -1.603 . . . . 0.0 107.641 178.548 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.483 ' O ' ' N ' ' A' ' 96' ' ' GLY . . . 34.41 34.86 0.04 OUTLIER Glycine 0 CA--C 1.518 0.23 0 C-N-CA 121.088 -0.577 . . . . 0.0 113.491 178.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.41 ' N ' ' O ' ' A' ' 93' ' ' VAL . 35.8 t30 66.67 -67.57 0.16 Allowed 'General case' 0 N--CA 1.461 0.117 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 -178.222 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.483 ' N ' ' O ' ' A' ' 94' ' ' GLY . . . -126.13 21.12 6.2 Favored Glycine 0 N--CA 1.446 -0.698 0 N-CA-C 110.873 -0.891 . . . . 0.0 110.873 177.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.453 ' OD1' ' HA3' ' A' ' 94' ' ' GLY . 0.2 OUTLIER -114.55 166.67 11.46 Favored 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 122.153 0.181 . . . . 0.0 110.545 -179.686 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.526 ' O ' ' O ' ' A' ' 67' ' ' VAL . 0.9 OUTLIER -135.78 165.43 25.62 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.523 0.678 . . . . 0.0 111.384 -179.895 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.415 ' N ' ' O ' ' A' ' 91' ' ' ARG . 0.6 OUTLIER -103.52 148.92 7.88 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.227 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.903 ' HB2' HD11 ' A' ' 68' ' ' LEU . 0.2 OUTLIER -103.72 108.34 19.59 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 114.053 1.131 . . . . 0.0 114.053 -177.699 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.664 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -127.04 106.18 15.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.784 0 N-CA-C 104.735 -2.32 . . . . 0.0 104.735 175.378 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.569 ' OG ' ' N ' ' A' ' 89' ' ' ASP . 37.2 m -151.49 164.66 36.3 Favored 'General case' 0 C--N 1.309 -1.184 0 C-N-CA 117.922 -1.511 . . . . 0.0 114.776 -174.57 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.664 HD21 HD11 ' A' ' 60' ' ' LEU . 0.0 OUTLIER 157.16 -90.92 0.0 OUTLIER 'General case' 0 N--CA 1.435 -1.2 0 CA-C-N 112.877 -1.965 . . . . 0.0 111.745 175.635 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.665 ' O ' ' HB2' ' A' ' 105' ' ' SER . 0.0 OUTLIER 60.74 12.36 3.69 Favored 'General case' 0 C--N 1.317 -0.81 0 C-N-CA 120.692 -0.403 . . . . 0.0 109.97 -179.218 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.665 ' HB2' ' O ' ' A' ' 104' ' ' ARG . 0.3 OUTLIER 157.94 162.25 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 -178.948 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.572 ' HB3' ' HG3' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -107.3 101.03 10.44 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 119.482 -0.887 . . . . 0.0 112.793 -179.08 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.716 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -169.12 164.33 11.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.429 -0.805 . . . . 0.0 109.714 177.033 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.496 ' HB2' ' HB2' ' A' ' 56' ' ' ALA . 0.7 OUTLIER -165.16 147.88 8.1 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.547 0.573 . . . . 0.0 112.547 179.68 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.691 HG22 HG23 ' A' ' 24' ' ' THR . 2.3 p -107.92 165.22 11.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.751 179.04 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 1.035 HD23 HG23 ' A' ' 12' ' ' VAL . 2.6 mt -56.21 -53.2 59.93 Favored 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.716 -0.393 . . . . 0.0 110.18 179.506 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.874 ' O ' HG23 ' A' ' 115' ' ' VAL . 1.1 tp60 -49.22 -65.57 0.54 Allowed 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.985 0.422 . . . . 0.0 110.089 179.431 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.889 ' O ' HD22 ' A' ' 116' ' ' LEU . 0.6 OUTLIER -48.71 -43.34 37.2 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.944 -0.571 . . . . 0.0 109.883 179.201 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.712 ' HB3' HG21 ' A' ' 12' ' ' VAL . . . -52.51 -62.7 1.47 Allowed 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.546 -0.752 . . . . 0.0 110.928 179.361 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.654 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -62.65 -26.98 68.91 Favored 'General case' 0 C--O 1.223 -0.338 0 C-N-CA 120.928 -0.309 . . . . 0.0 110.75 179.975 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 1.083 HG22 ' CG ' ' A' ' 75' ' ' LYS . 59.1 t -56.89 -65.3 0.41 Allowed 'Isoleucine or valine' 0 C--O 1.248 0.99 0 CA-C-O 122.252 1.025 . . . . 0.0 110.495 179.101 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.889 HD22 ' O ' ' A' ' 112' ' ' ASP . 0.0 OUTLIER -60.33 -41.43 93.53 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 114.554 -1.203 . . . . 0.0 109.349 -179.7 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 1.035 HD23 HD13 ' A' ' 5' ' ' LEU . 0.2 OUTLIER -67.41 -18.39 65.09 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.001 179.169 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.654 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 0.9 OUTLIER -73.23 -44.59 59.29 Favored 'General case' 0 CA--C 1.503 -0.845 0 N-CA-C 106.721 -1.585 . . . . 0.0 106.721 177.968 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.509 ' HB1' ' H ' ' A' ' 68' ' ' LEU . . . -78.04 -28.6 49.05 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 114.357 -1.292 . . . . 0.0 110.106 177.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 1.07 ' HB1' HD21 ' A' ' 5' ' ' LEU . . . -69.37 -53.99 16.75 Favored 'General case' 0 N--CA 1.442 -0.85 0 CA-C-N 115.144 -0.935 . . . . 0.0 110.46 179.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.771 HD12 ' H ' ' A' ' 127' ' ' ALA . 0.0 OUTLIER -65.08 -44.47 88.79 Favored 'General case' 0 N--CA 1.447 -0.595 0 CA-C-N 115.895 -0.593 . . . . 0.0 109.765 179.869 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.654 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.0 OUTLIER -56.62 -46.2 81.07 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.638 179.819 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.401 ' N ' ' HG2' ' A' ' 122' ' ' ARG . 19.9 mm100 -86.96 -28.94 22.41 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -177.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . 0.462 ' CG ' ' O ' ' A' ' 120' ' ' ALA . 0.5 OUTLIER -96.04 -67.03 0.87 Allowed 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 113.761 1.023 . . . . 0.0 113.761 -177.992 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.484 ' HA ' ' HA2' ' A' ' 129' ' ' GLY . 0.0 OUTLIER -96.24 -66.32 0.91 Allowed 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -177.275 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . 0.59 ' O ' ' HB3' ' A' ' 127' ' ' ALA . . . 80.7 77.55 0.98 Allowed Glycine 0 N--CA 1.448 -0.552 0 C-N-CA 120.943 -0.646 . . . . 0.0 111.597 -178.769 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.771 ' H ' HD12 ' A' ' 121' ' ' LEU . . . 87.31 -32.15 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 C-N-CA 122.942 0.497 . . . . 0.0 110.379 -178.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . 0.45 ' CB ' ' O ' ' A' ' 127' ' ' ALA . 0.7 OUTLIER 158.64 43.17 0.0 OUTLIER 'General case' 0 N--CA 1.462 0.149 0 CA-C-O 121.353 0.596 . . . . 0.0 110.523 178.972 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . 0.484 ' HA2' ' HA ' ' A' ' 125' ' ' SER . . . 62.14 16.72 54.04 Favored Glycine 0 C--N 1.316 -0.537 0 C-N-CA 120.72 -0.752 . . . . 0.0 111.868 -179.026 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.202 -0.904 . . . . 0.0 110.8 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.109 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -167.9 84.27 0.2 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.844 0.354 . . . . 0.0 110.926 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.6 -167.64 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.713 179.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 204' ' ' PTR . . . . . 0.406 ' CD1' ' HE3' ' A' ' 26' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -145.91 -94.77 0.09 Allowed 'General case' 0 C--N 1.331 -0.238 0 C-N-CA 121.093 -0.243 . . . . 0.0 111.56 -179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 206' ' ' ASP . . . . . 0.504 ' O ' ' N ' ' B' ' 208' ' ' PHE . 1.2 m-20 -145.96 157.69 50.04 Favored Pre-proline 0 C--N 1.334 -0.102 0 CA-C-O 120.551 0.215 . . . . 0.0 110.995 -179.698 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . 0.482 ' HA ' ' HA ' ' A' ' 30' ' ' ASN . 12.7 Cg_endo -55.15 71.44 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 123.371 2.714 . . . . 0.0 113.292 -179.621 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 208' ' ' PHE . . . . . 0.504 ' N ' ' O ' ' B' ' 206' ' ' ASP . 0.2 OUTLIER 163.97 -31.41 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.73 179.333 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.331 0 CA-C-N 116.458 -0.337 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 54.1 mtp . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.829 0.347 . . . . 0.0 111.179 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.428 ' CB ' HG21 ' A' ' 58' ' ' THR . 1.2 p-10 -97.62 -166.06 1.34 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.88 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 1.023 HD11 HD13 ' A' ' 8' ' ' LEU . 0.2 OUTLIER -106.91 -176.01 2.96 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.238 179.133 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -59.66 -176.91 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.905 0.384 . . . . 0.0 111.109 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 1.096 HD21 ' HB1' ' A' ' 120' ' ' ALA . 0.1 OUTLIER -90.72 -62.77 1.38 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.948 -0.569 . . . . 0.0 111.218 179.718 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.456 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 93.0 p -44.14 -38.51 3.72 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.773 -179.41 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.42 -47.61 32.72 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 120.878 0.37 . . . . 0.0 110.138 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 1.084 HD23 HD21 ' A' ' 117' ' ' LEU . 26.9 tp -60.4 -48.71 80.59 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.916 -0.583 . . . . 0.0 110.117 179.313 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.882 ' ND1' HD22 ' A' ' 121' ' ' LEU . 35.9 t-80 -61.99 -40.59 96.15 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 109.182 -0.673 . . . . 0.0 109.182 178.654 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.456 ' HB2' ' O ' ' A' ' 6' ' ' SER . 7.8 mtp180 -60.32 -55.13 37.35 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.34 179.815 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.67 ' HG3' ' CG1' ' A' ' 31' ' ' VAL . 2.6 pt20 -60.56 -55.42 33.55 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.643 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.793 ' O ' HG23 ' A' ' 16' ' ' VAL . 14.6 p -56.63 -51.71 62.79 Favored 'Isoleucine or valine' 0 C--O 1.235 0.301 0 CA-C-O 120.854 0.359 . . . . 0.0 111.371 179.774 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.624 ' HA ' ' HE2' ' A' ' 114' ' ' LYS . 44.1 t -65.05 -23.85 67.3 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.239 -0.437 . . . . 0.0 112.021 -179.669 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -77.54 -40.67 41.76 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 120.721 -0.392 . . . . 0.0 111.429 -179.014 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.884 HD13 HD21 ' A' ' 110' ' ' LEU . 0.0 OUTLIER -72.0 -46.84 55.73 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 119.472 -0.891 . . . . 0.0 109.224 179.343 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.933 HG22 ' HB3' ' A' ' 110' ' ' LEU . 42.0 t -57.84 -55.85 19.19 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.529 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.444 ' HG2' ' HE3' ' A' ' 114' ' ' LYS . 0.0 OUTLIER -70.5 -6.48 36.41 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.895 0.702 . . . . 0.0 112.895 -178.154 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.455 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 7.3 pt20 -171.87 64.47 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.586 -0.446 . . . . 0.0 111.883 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.455 ' HB2' ' O ' ' A' ' 18' ' ' GLN . 1.9 tt0 174.58 -59.62 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.112 179.467 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.72 ' CB ' HD13 ' A' ' 110' ' ' LEU . 58.5 m -102.06 -42.32 6.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.402 -179.348 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 94.15 -46.7 2.22 Favored Glycine 0 N--CA 1.449 -0.44 0 C-N-CA 120.643 -0.789 . . . . 0.0 111.766 -179.158 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.422 ' O ' ' O ' ' A' ' 23' ' ' CYS . 0.0 OUTLIER -176.71 12.5 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 111.636 0.236 . . . . 0.0 111.636 179.794 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.944 ' O ' HG22 ' A' ' 109' ' ' THR . 48.2 m -57.06 -154.08 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.55 -0.296 . . . . 0.0 110.935 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.746 HG21 ' CD2' ' A' ' 39' ' ' PHE . 0.0 OUTLIER -104.28 151.13 23.78 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 121.068 0.461 . . . . 0.0 111.061 -179.727 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -104.81 135.97 12.83 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 120.651 -0.785 . . . . 0.0 113.481 -178.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.986 ' HB3' ' HB3' ' A' ' 32' ' ' ALA . 2.5 tmtm? -104.7 120.65 41.84 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.098 -0.705 . . . . 0.0 109.098 179.078 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.562 HD13 ' HA ' ' A' ' 55' ' ' PHE . 0.4 OUTLIER -104.42 145.86 29.67 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.44 0.638 . . . . 0.0 112.578 -178.488 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 162.23 63.97 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.621 179.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.694 ' O ' HD23 ' A' ' 3' ' ' LEU . . . 76.03 -4.45 46.53 Favored Glycine 0 C--N 1.336 0.569 0 C-N-CA 120.595 -0.812 . . . . 0.0 111.098 -177.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.532 ' C ' ' ND2' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -166.36 166.23 16.72 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 -179.927 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.827 ' CG1' HD11 ' A' ' 15' ' ' LEU . 13.9 p -111.04 143.71 20.38 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-O 121.193 0.52 . . . . 0.0 111.592 178.667 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.986 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . . . -124.9 165.32 18.28 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.538 178.625 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -104.82 115.3 30.07 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -178.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.579 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 33.3 t30 -102.55 136.67 41.95 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.659 179.408 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.1 ptmt -154.43 36.32 0.42 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.044 179.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -115.4 -23.06 9.03 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.265 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.515 ' C ' HG23 ' A' ' 38' ' ' THR . 3.4 m -125.99 -47.72 1.64 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.997 0.427 . . . . 0.0 110.88 179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.515 HG23 ' C ' ' A' ' 37' ' ' THR . 2.5 p 82.83 86.46 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 122.046 0.927 . . . . 0.0 111.469 179.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.746 ' CD2' HG21 ' A' ' 24' ' ' THR . 2.0 m-85 -82.02 131.85 35.25 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 113.952 -1.477 . . . . 0.0 110.575 179.348 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 2.4 pm0 -115.74 -34.57 4.78 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.439 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.547 ' O ' ' HB2' ' A' ' 105' ' ' SER . . . 151.98 50.75 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.276 0 N-CA-C 111.372 -0.691 . . . . 0.0 111.372 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.797 HD11 ' H ' ' A' ' 46' ' ' SER . 0.0 OUTLIER -108.14 -173.8 2.37 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.962 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.661 ' H ' HD12 ' A' ' 42' ' ' LEU . 94.1 m -119.08 67.43 0.79 Allowed 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -178.016 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.798 ' HA ' ' HB3' ' A' ' 48' ' ' ALA . 1.0 OUTLIER 45.76 5.97 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 178.591 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.511 ' N ' ' O ' ' A' ' 43' ' ' THR . . . -72.0 -57.35 4.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.693 0.282 . . . . 0.0 111.584 -179.145 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.797 ' H ' HD11 ' A' ' 42' ' ' LEU . 0.2 OUTLIER -58.31 -61.31 2.67 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.867 0.365 . . . . 0.0 110.687 -179.773 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -179.69 31.06 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.728 -0.749 . . . . 0.0 112.672 179.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.798 ' HB3' ' HA ' ' A' ' 44' ' ' ILE . . . -80.58 -166.91 1.18 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 121.014 0.435 . . . . 0.0 111.216 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.537 ' N ' ' OE2' ' A' ' 52' ' ' GLU . 3.2 mmt180 -137.82 -159.15 0.93 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.165 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.918 ' O ' HG22 ' A' ' 54' ' ' VAL . 3.6 mp0 -95.17 -30.71 13.88 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.594 0.235 . . . . 0.0 111.606 -179.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.512 ' CB ' ' HG2' ' A' ' 26' ' ' LYS . 0.6 OUTLIER -62.04 -45.41 93.67 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.283 -0.417 . . . . 0.0 112.051 -179.228 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.537 ' OE2' ' N ' ' A' ' 49' ' ' ARG . 0.8 OUTLIER -59.28 -65.24 0.7 Allowed 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.029 0.443 . . . . 0.0 110.294 179.94 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.697 ' HE2' HD11 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -46.44 -59.44 2.96 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.604 179.648 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.918 HG22 ' O ' ' A' ' 50' ' ' GLU . 11.7 m -49.09 -44.12 16.08 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 CA-C-O 120.988 0.423 . . . . 0.0 110.308 179.561 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.588 ' HE2' HG23 ' A' ' 31' ' ' VAL . 0.4 OUTLIER -53.5 -53.14 55.78 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.805 178.768 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.735 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -55.07 -46.44 75.41 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.811 179.447 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -66.12 -42.25 89.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.221 0.534 . . . . 0.0 110.561 179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.428 HG21 ' CB ' ' A' ' 2' ' ' ASN . 93.0 m -60.01 -47.54 85.43 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.956 -179.858 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.813 ' CG2' HD12 ' A' ' 117' ' ' LEU . 11.1 p -69.96 -38.03 74.3 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 C-N-CA 120.725 -0.39 . . . . 0.0 110.853 -179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.624 HD13 ' O ' ' A' ' 102' ' ' SER . 4.0 tp -59.29 -37.59 78.06 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 121.146 0.498 . . . . 0.0 109.766 179.551 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 15.5 t -72.2 -52.96 14.08 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.032 179.526 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . 0.545 ' HB3' HD22 ' A' ' 5' ' ' LEU . 7.2 m-70 -55.49 -35.06 65.15 Favored 'General case' 0 C--O 1.232 0.149 0 CA-C-O 121.092 0.472 . . . . 0.0 110.322 179.573 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 1.031 HG13 ' CG1' ' A' ' 66' ' ' VAL . 57.0 t -83.7 -69.97 0.49 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.176 179.172 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.493 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 42.82 28.67 0.14 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.605 178.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.529 ' H ' HG12 ' A' ' 63' ' ' VAL . 0.7 OUTLIER 157.37 -75.97 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.782 0 CA-C-O 120.709 0.29 . . . . 0.0 111.647 179.853 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 1.031 ' CG1' HG13 ' A' ' 63' ' ' VAL . 35.4 m 46.52 -139.25 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.614 -179.475 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.506 ' O ' ' O ' ' A' ' 98' ' ' SER . 3.5 p -158.05 -20.84 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -179.199 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.659 HD23 ' HB3' ' A' ' 72' ' ' ASP . 2.0 mp 36.68 90.13 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 179.705 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 30.5 p -67.18 -173.69 0.29 Allowed 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 109.974 -0.38 . . . . 0.0 109.974 179.006 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.5 -30.49 8.43 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.954 0.406 . . . . 0.0 110.749 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.09 -65.04 0.72 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.691 179.661 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.659 ' HB3' HD23 ' A' ' 68' ' ' LEU . 0.9 OUTLIER -54.95 -35.06 63.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.978 -179.942 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 12.0 m -59.36 -61.69 2.44 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 109.125 -0.695 . . . . 0.0 109.125 178.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.529 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . . . -56.86 -26.24 58.24 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-O 121.501 0.667 . . . . 0.0 109.241 177.744 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 1.057 ' CG ' HG22 ' A' ' 115' ' ' VAL . 1.0 OUTLIER -62.18 -62.32 1.85 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 114.718 -1.128 . . . . 0.0 111.005 179.4 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 1.025 HD13 HD21 ' A' ' 90' ' ' LEU . 0.6 OUTLIER -59.33 -49.52 77.5 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.544 -0.298 . . . . 0.0 110.691 179.891 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.632 HD12 ' C ' ' A' ' 77' ' ' LEU . 1.5 pp -61.16 -29.43 69.78 Favored 'General case' 0 N--CA 1.457 -0.105 0 C-N-CA 120.517 -0.473 . . . . 0.0 110.222 179.653 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.1 -56.95 11.28 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 178.73 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . 0.456 ' O ' HD23 ' A' ' 85' ' ' LEU . 0.1 OUTLIER -59.13 -29.2 67.23 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 115.862 -0.608 . . . . 0.0 110.289 179.113 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.498 ' HA ' ' CB ' ' A' ' 85' ' ' LEU . 51.6 m -68.01 -65.1 0.74 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.181 179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.487 HG12 ' O ' ' A' ' 77' ' ' LEU . 10.9 p -60.05 -24.3 29.68 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.25 -179.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 2.5 mtpp -64.64 -66.58 0.52 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.831 -179.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . 0.439 ' O ' ' N ' ' A' ' 85' ' ' LEU . 36.1 m170 -131.19 106.76 8.54 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.227 0.455 . . . . 0.0 112.227 -179.004 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 36.53 -89.74 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.191 179.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.743 HD11 ' HD2' ' A' ' 88' ' ' TYR . 0.0 OUTLIER 75.31 -140.91 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.636 -0.256 . . . . 0.0 110.83 -179.992 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.505 ' CB ' ' O ' ' A' ' 85' ' ' LEU . 3.7 t-20 89.31 35.76 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.171 0.51 . . . . 0.0 110.172 -179.235 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . 0.536 ' HA ' ' HB2' ' A' ' 104' ' ' ARG . 0.6 OUTLIER -121.81 -27.0 4.74 Favored 'General case' 0 C--O 1.251 1.162 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.006 -179.704 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 1.315 ' HA ' ' OG ' ' A' ' 102' ' ' SER . 95.0 m-85 -99.13 125.42 44.66 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 115.608 -0.724 . . . . 0.0 112.179 -178.353 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.787 ' CG ' HG13 ' A' ' 101' ' ' VAL . 0.7 OUTLIER -104.64 136.54 43.98 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 107.881 -1.155 . . . . 0.0 107.881 -179.966 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 1.025 HD21 HD13 ' A' ' 76' ' ' LEU . 30.6 mt -129.48 155.08 46.3 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 -176.352 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.716 ' HB2' HG12 ' A' ' 99' ' ' VAL . 0.0 OUTLIER -132.31 161.71 32.86 Favored 'General case' 0 C--O 1.215 -0.746 0 CA-C-N 114.703 -1.135 . . . . 0.0 108.558 177.585 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.794 ' O ' HG13 ' A' ' 93' ' ' VAL . 22.9 p -103.64 158.64 16.23 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.882 0.849 . . . . 0.0 112.676 -178.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.794 HG13 ' O ' ' A' ' 92' ' ' SER . 0.0 OUTLIER 166.18 151.05 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.437 -1.117 0 CA-C-N 113.695 -1.593 . . . . 0.0 107.884 -179.141 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.492 ' HA3' ' OD1' ' A' ' 97' ' ' ASN . . . 91.51 19.89 39.76 Favored Glycine 0 C--N 1.291 -1.957 0 C-N-CA 119.899 -1.143 . . . . 0.0 112.901 -179.63 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER 74.02 -46.96 0.63 Allowed 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.825 -0.805 . . . . 0.0 108.825 -178.1 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.434 ' H ' ' C ' ' A' ' 94' ' ' GLY . . . -141.58 15.2 2.69 Favored Glycine 0 N--CA 1.441 -0.983 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.852 178.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.576 ' O ' ' O ' ' A' ' 93' ' ' VAL . 0.4 OUTLIER -105.46 166.64 10.29 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 117.252 0.526 . . . . 0.0 109.831 179.25 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.689 ' CB ' ' O ' ' A' ' 91' ' ' ARG . 0.2 OUTLIER -139.27 164.98 28.39 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-O 121.294 0.569 . . . . 0.0 110.784 179.772 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.716 HG12 ' HB2' ' A' ' 91' ' ' ARG . 0.5 OUTLIER -104.2 152.25 6.57 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.292 179.636 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.679 HD13 ' CD1' ' A' ' 116' ' ' LEU . 7.5 tp -103.19 105.24 15.48 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 121.638 0.732 . . . . 0.0 112.56 -178.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.787 HG13 ' CG ' ' A' ' 89' ' ' ASP . 1.6 p -123.68 110.04 24.8 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.96 0 N-CA-C 104.982 -2.229 . . . . 0.0 104.982 175.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 1.315 ' OG ' ' HA ' ' A' ' 88' ' ' TYR . 2.5 t -166.85 166.79 15.42 Favored 'General case' 0 CA--C 1.495 -1.171 0 N-CA-C 115.27 1.582 . . . . 0.0 115.27 -174.178 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.637 ' O ' ' C ' ' A' ' 104' ' ' ARG . 0.1 OUTLIER 168.99 -45.41 0.01 OUTLIER 'General case' 0 N--CA 1.435 -1.215 0 CA-C-N 113.721 -1.581 . . . . 0.0 112.09 174.032 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.637 ' C ' ' O ' ' A' ' 103' ' ' LEU . 0.0 OUTLIER 16.1 81.25 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.671 0 O-C-N 123.58 0.55 . . . . 0.0 110.044 178.457 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.636 ' O ' HD13 ' A' ' 103' ' ' LEU . 0.7 OUTLIER 86.02 -166.43 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 -176.28 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.615 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.1 OUTLIER -132.42 101.74 5.46 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 119.989 -0.684 . . . . 0.0 110.629 179.368 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.735 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 1.5 mt-30 -169.13 165.51 11.1 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.441 179.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.699 ' SD ' HG11 ' A' ' 59' ' ' VAL . 0.7 OUTLIER -159.87 143.09 14.03 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.488 0.661 . . . . 0.0 112.588 178.505 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.944 HG22 ' O ' ' A' ' 23' ' ' CYS . 0.2 OUTLIER -104.31 164.77 11.5 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.572 -1.195 . . . . 0.0 109.048 178.31 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.933 ' HB3' HG22 ' A' ' 16' ' ' VAL . 2.4 mt -57.32 -51.77 68.03 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 120.708 0.289 . . . . 0.0 111.044 -179.368 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.909 ' O ' HG23 ' A' ' 115' ' ' VAL . 0.1 OUTLIER -54.7 -61.45 2.3 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.584 -0.28 . . . . 0.0 110.576 179.364 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.833 ' O ' HD22 ' A' ' 116' ' ' LEU . 11.7 m-20 -44.07 -53.81 6.04 Favored 'General case' 0 C--O 1.24 0.586 0 CA-C-O 121.074 0.464 . . . . 0.0 111.295 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.602 ' HB3' HG21 ' A' ' 12' ' ' VAL . . . -49.92 -60.27 3.08 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.188 179.33 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.638 ' HD2' HG11 ' A' ' 16' ' ' VAL . 0.2 OUTLIER -54.02 -32.49 54.45 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.414 179.473 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 1.057 HG22 ' CG ' ' A' ' 75' ' ' LYS . 48.1 t -61.99 -65.36 0.51 Allowed 'Isoleucine or valine' 0 C--O 1.241 0.63 0 CA-C-O 121.737 0.78 . . . . 0.0 111.912 -178.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.833 HD22 ' O ' ' A' ' 112' ' ' ASP . 0.3 OUTLIER -63.32 -34.12 77.0 Favored 'General case' 0 N--CA 1.442 -0.87 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.298 -178.941 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 1.084 HD21 HD23 ' A' ' 8' ' ' LEU . 0.6 OUTLIER -73.15 -21.92 60.61 Favored 'General case' 0 CA--C 1.512 -0.498 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.549 178.898 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.567 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 6.5 tp10 -70.17 -46.89 63.7 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 106.267 -1.753 . . . . 0.0 106.267 177.134 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.545 ' HB2' ' OD2' ' A' ' 72' ' ' ASP . . . -74.36 -24.25 59.14 Favored 'General case' 0 N--CA 1.446 -0.651 0 CA-C-N 114.085 -1.416 . . . . 0.0 110.236 177.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 1.096 ' HB1' HD21 ' A' ' 5' ' ' LEU . . . -77.01 -50.72 12.49 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.471 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.882 HD22 ' ND1' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -62.68 -38.88 92.09 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 116.038 -0.528 . . . . 0.0 109.715 179.383 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.567 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.1 OUTLIER -73.7 -38.34 64.89 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.313 -179.558 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 29.6 mm100 -89.89 -24.88 21.24 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -178.033 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . 0.405 ' HG3' HD23 ' A' ' 5' ' ' LEU . 20.5 mm-40 -84.72 -66.97 0.83 Allowed 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.502 -0.479 . . . . 0.0 111.415 -179.245 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 9.5 t -96.94 -54.3 3.24 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.363 -179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 108.25 63.27 0.56 Allowed Glycine 0 CA--C 1.498 -1.012 0 N-CA-C 110.902 -0.879 . . . . 0.0 110.902 -178.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . 49.22 28.03 2.06 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 -177.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.74 -57.98 1.95 Allowed 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 114.789 -1.096 . . . . 0.0 111.59 -178.076 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . 0.408 ' HA2' ' CB ' ' A' ' 6' ' ' SER . . . 110.62 -21.77 23.03 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.961 -0.638 . . . . 0.0 112.462 -179.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 19.3 p . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.218 -0.896 . . . . 0.0 111.12 179.942 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.114 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 61.11 -81.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.726 0.298 . . . . 0.0 110.969 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -146.15 162.4 38.07 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.839 0.352 . . . . 0.0 110.723 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 204' ' ' PTR . . . . . 0.437 ' HB3' ' HB3' ' A' ' 30' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 37.0 m-20 44.62 -90.44 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.773 -0.649 . . . . 0.0 112.548 179.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 206' ' ' ASP . . . . . 0.432 ' CB ' ' HD2' ' B' ' 207' ' ' PRO . 1.9 m-20 -110.18 165.93 11.73 Favored Pre-proline 0 CA--C 1.528 0.125 0 CA-C-O 120.911 0.386 . . . . 0.0 111.682 -178.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . 0.515 ' HB3' ' NE2' ' A' ' 11' ' ' GLN . 11.0 Cg_endo -52.89 164.87 1.4 Allowed 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 123.216 2.61 . . . . 0.0 112.698 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 208' ' ' PHE . . . . . 0.512 ' CE2' ' HA ' ' A' ' 11' ' ' GLN . 95.0 m-85 64.87 -15.42 0.09 Allowed 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.435 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 116.736 -0.211 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.765 0.317 . . . . 0.0 111.277 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 6.5 p30 -158.34 -162.3 1.11 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.765 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.861 HD22 ' OE1' ' A' ' 11' ' ' GLN . 5.4 mp -85.49 -99.29 0.06 Allowed 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.735 179.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.418 ' O ' ' CB ' ' A' ' 8' ' ' LEU . 1.4 m -168.33 161.05 11.84 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.377 -0.601 . . . . 0.0 109.377 179.672 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.807 HD21 ' HB3' ' A' ' 62' ' ' HIS . 21.7 mt -56.82 -65.08 0.68 Allowed 'General case' 0 CA--C 1.507 -0.685 0 CA-C-O 121.37 0.605 . . . . 0.0 111.002 -179.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.8 t -46.71 -45.4 19.47 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-N 115.165 -0.925 . . . . 0.0 112.091 -178.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.23 -64.5 1.12 Allowed 'General case' 0 N--CA 1.463 0.19 0 CA-C-O 120.805 0.336 . . . . 0.0 110.65 -179.682 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.8 HD23 ' CD2' ' A' ' 117' ' ' LEU . 5.6 tp -44.27 -42.35 6.57 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.258 179.351 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.585 ' CD2' HD22 ' A' ' 121' ' ' LEU . 85.0 t60 -70.51 -44.19 68.13 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.325 178.364 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.473 ' HB3' ' CZ ' ' B' ' 208' ' ' PHE . 11.3 mmt180 -55.67 -53.66 53.8 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.768 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.861 ' OE1' HD22 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -63.46 -54.78 31.19 Favored 'General case' 0 C--O 1.234 0.24 0 C-N-CA 120.885 -0.326 . . . . 0.0 111.253 -179.88 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.941 ' HA ' HD12 ' A' ' 15' ' ' LEU . 13.2 p -54.19 -48.58 66.1 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 CA-C-O 121.189 0.519 . . . . 0.0 110.942 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.632 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 60.8 m -62.96 -33.78 76.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.484 -0.78 . . . . 0.0 112.101 -179.519 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.404 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -74.28 -29.0 61.46 Favored 'General case' 0 C--N 1.326 -0.428 0 C-N-CA 120.559 -0.456 . . . . 0.0 111.318 -179.295 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.941 HD12 ' HA ' ' A' ' 12' ' ' VAL . 0.5 OUTLIER -75.84 -50.77 14.16 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.362 -0.535 . . . . 0.0 110.517 179.628 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.873 ' CG2' ' HB3' ' A' ' 110' ' ' LEU . 69.6 t -66.71 -54.42 25.6 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.408 0 CA-C-O 121.202 0.525 . . . . 0.0 111.519 -179.757 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 13' ' ' SER . 0.3 OUTLIER -63.23 -8.59 8.61 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.767 -178.46 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -141.88 25.12 1.98 Allowed 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 120.996 -0.282 . . . . 0.0 111.594 179.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.453 ' N ' ' O ' ' A' ' 15' ' ' LEU . 3.8 tt0 179.73 -69.93 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.307 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.944 ' CB ' HD13 ' A' ' 110' ' ' LEU . 0.7 OUTLIER -83.44 68.83 9.89 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.992 0.425 . . . . 0.0 111.917 -178.161 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -36.41 -34.55 0.09 OUTLIER Glycine 0 CA--C 1.521 0.441 0 CA-C-N 115.73 -0.668 . . . . 0.0 114.009 -179.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -166.57 9.04 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.36 0 N-CA-C 112.391 0.515 . . . . 0.0 112.391 -179.508 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.55 ' HB2' ' HB3' ' A' ' 20' ' ' SER . 96.2 m -53.72 -171.26 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.708 0.289 . . . . 0.0 110.819 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.594 HG21 ' HB3' ' A' ' 39' ' ' PHE . 8.2 m -103.57 148.04 26.46 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 179.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.403 ' HA2' ' O ' ' A' ' 32' ' ' ALA . . . -104.51 144.23 15.8 Favored Glycine 0 N--CA 1.449 -0.484 0 C-N-CA 120.095 -1.05 . . . . 0.0 113.507 -178.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.938 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -112.35 126.45 55.29 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 179.17 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.846 HD12 ' HA ' ' A' ' 55' ' ' PHE . 0.4 OUTLIER -104.67 144.2 32.05 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 121.308 0.575 . . . . 0.0 111.893 -178.846 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.441 ' H ' HD23 ' A' ' 27' ' ' LEU . 0.0 OUTLIER 171.12 57.28 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.134 -0.939 . . . . 0.0 109.135 179.891 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.841 ' C ' HD11 ' A' ' 3' ' ' LEU . . . 84.52 -2.25 88.13 Favored Glycine 0 N--CA 1.451 -0.35 0 N-CA-C 111.129 -0.788 . . . . 0.0 111.129 -177.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.569 ' N ' HD11 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -166.45 165.5 16.97 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 107.558 -1.275 . . . . 0.0 107.558 179.731 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.708 HG22 ' HG3' ' A' ' 11' ' ' GLN . 1.3 m -119.78 117.8 54.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 C-N-CA 119.857 -0.737 . . . . 0.0 111.487 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.938 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -108.26 166.87 10.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.253 -0.885 . . . . 0.0 111.111 -179.296 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.736 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -103.33 132.24 49.75 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 121.221 0.534 . . . . 0.0 111.485 -179.305 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.403 ' O ' ' HB3' ' A' ' 23' ' ' CYS . 5.2 t30 -115.33 121.24 42.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.366 -0.834 . . . . 0.0 110.67 -179.52 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 13.5 tttt -113.69 -10.88 13.02 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.512 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -79.91 -66.78 0.83 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.781 0.324 . . . . 0.0 111.27 -179.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.6 168.93 17.6 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.332 -179.531 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 61.6 p -131.48 114.58 15.08 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.496 179.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.729 ' CZ ' HG22 ' A' ' 109' ' ' THR . 0.0 OUTLIER -79.59 -179.72 7.02 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.19 -179.586 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.502 ' N ' ' CG ' ' A' ' 39' ' ' PHE . 0.8 OUTLIER 165.63 36.28 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.512 179.716 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.496 ' C ' ' HB2' ' A' ' 107' ' ' GLN . . . 89.37 -34.83 3.86 Favored Glycine 0 CA--C 1.52 0.375 0 CA-C-N 115.76 -0.655 . . . . 0.0 112.367 -179.33 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.622 HD21 ' HB3' ' A' ' 46' ' ' SER . 0.4 OUTLIER -21.0 139.51 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.404 0.681 . . . . 0.0 112.785 179.579 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.9 27.41 1.82 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.504 -0.316 . . . . 0.0 111.599 -179.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.825 HG23 ' O ' ' A' ' 48' ' ' ALA . 8.7 mm 65.65 5.6 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 N-CA-C 111.865 0.32 . . . . 0.0 111.865 179.617 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -87.24 -29.12 21.92 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.777 0.322 . . . . 0.0 111.439 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.622 ' HB3' HD21 ' A' ' 42' ' ' LEU . 1.3 t -87.21 -32.52 19.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.081 -179.809 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.41 40.16 0.03 OUTLIER Glycine 0 CA--C 1.518 0.281 0 C-N-CA 120.462 -0.875 . . . . 0.0 113.197 179.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.825 ' O ' HG23 ' A' ' 44' ' ' ILE . . . -106.86 169.28 8.64 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.841 0.32 . . . . 0.0 110.846 179.5 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.453 ' C ' HD12 ' A' ' 44' ' ' ILE . 14.9 mtp180 -87.98 132.13 34.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.844 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.63 ' O ' HG23 ' A' ' 54' ' ' VAL . 7.9 tt0 -52.12 -30.46 26.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.056 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.51 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 19.5 p -61.31 -55.11 35.5 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.969 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.524 ' CB ' ' HG2' ' A' ' 107' ' ' GLN . 13.8 mt-10 -51.6 -44.36 62.81 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-O 121.082 0.468 . . . . 0.0 110.411 179.733 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.469 ' HG3' ' HB3' ' A' ' 106' ' ' ASP . 0.1 OUTLIER -56.57 -62.52 1.67 Allowed 'General case' 0 C--O 1.237 0.398 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.33 178.945 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.63 HG23 ' O ' ' A' ' 50' ' ' GLU . 33.5 t -49.81 -32.04 7.27 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 121.167 0.508 . . . . 0.0 110.33 179.262 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.846 ' HA ' HD12 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -64.98 -48.02 75.47 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.362 179.306 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.438 ' HB2' ' C ' ' A' ' 107' ' ' GLN . . . -59.27 -39.12 81.89 Favored 'General case' 0 CA--C 1.521 -0.158 0 CA-C-O 121.028 0.442 . . . . 0.0 110.061 179.118 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.1 mm-40 -69.21 -33.85 73.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.943 179.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.403 HG21 HD11 ' A' ' 27' ' ' LEU . 48.3 m -75.59 -50.97 13.94 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 120.911 0.386 . . . . 0.0 110.505 -179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.765 HG13 ' O ' ' A' ' 55' ' ' PHE . 3.0 m -62.75 -37.33 78.81 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.694 179.737 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.776 HD13 HD23 ' A' ' 103' ' ' LEU . 4.9 tp -70.14 -44.51 68.71 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.556 179.415 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 74.8 m -60.85 -62.23 2.01 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.612 -179.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . 0.807 ' HB3' HD21 ' A' ' 5' ' ' LEU . 1.9 m-70 -49.33 -43.27 43.52 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 121.08 0.467 . . . . 0.0 110.703 -179.768 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 1.011 HG11 HD23 ' A' ' 100' ' ' LEU . 67.7 t -74.2 -80.15 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.242 179.228 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.539 ' HB3' ' O ' ' A' ' 63' ' ' VAL . . . 75.21 -26.02 0.2 Allowed 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.358 -0.383 . . . . 0.0 112.005 179.389 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.442 ' O ' HG22 ' A' ' 66' ' ' VAL . 1.5 p30 -170.03 -51.99 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 121.065 0.46 . . . . 0.0 110.396 -179.197 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.993 ' CG1' HG13 ' A' ' 63' ' ' VAL . 35.9 m 46.56 -139.72 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.555 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.532 ' O ' ' O ' ' A' ' 98' ' ' SER . 3.4 p -153.47 -24.85 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 N-CA-C 113.367 0.876 . . . . 0.0 113.367 -179.259 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.843 HD23 ' HB3' ' A' ' 72' ' ' ASP . 1.5 mp 34.07 98.42 0.0 OUTLIER 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 112.659 0.615 . . . . 0.0 112.659 179.432 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.594 HG23 ' NH1' ' A' ' 122' ' ' ARG . 68.8 p -60.66 -122.94 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 110.015 -0.365 . . . . 0.0 110.015 179.081 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -95.35 -39.54 9.98 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 121.347 0.594 . . . . 0.0 109.869 179.139 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.501 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 2.1 tt0 -59.6 -64.92 0.77 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.268 -0.878 . . . . 0.0 111.215 -179.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.843 ' HB3' HD23 ' A' ' 68' ' ' LEU . 96.1 m-20 -52.44 -33.14 42.77 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.508 -0.314 . . . . 0.0 111.237 -179.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 97.8 m -61.62 -63.9 1.12 Allowed 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 178.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.66 -24.25 60.84 Favored 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 177.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 1.082 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.2 OUTLIER -59.23 -65.09 0.72 Allowed 'General case' 0 C--O 1.234 0.261 0 CA-C-N 114.857 -1.065 . . . . 0.0 110.428 179.017 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 1.097 HD13 HD21 ' A' ' 90' ' ' LEU . 0.4 OUTLIER -58.55 -38.92 78.84 Favored 'General case' 0 CA--C 1.52 -0.206 0 N-CA-C 109.425 -0.584 . . . . 0.0 109.425 178.981 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.791 ' O ' HG12 ' A' ' 81' ' ' VAL . 0.1 OUTLIER -50.75 -49.83 57.1 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.492 -0.777 . . . . 0.0 110.726 179.648 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -67.36 -53.04 33.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.878 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -59.33 -21.54 59.93 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.161 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.407 HG22 ' CB ' ' A' ' 85' ' ' LEU . 45.8 m -94.32 -49.07 5.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.145 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.791 HG12 ' O ' ' A' ' 77' ' ' LEU . 7.2 p -76.7 -6.11 8.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.74 -179.833 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 10.6 ptmm? -46.62 -33.19 3.99 Favored 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.899 0.381 . . . . 0.0 111.134 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -179.23 -57.54 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.785 179.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -101.08 75.88 1.7 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.734 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.632 HD23 HG23 ' A' ' 81' ' ' VAL . 0.2 OUTLIER -84.16 85.13 7.39 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.052 179.995 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -173.39 37.39 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.391 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 16.5 p-10 -125.77 -52.33 1.57 Allowed 'General case' 0 C--O 1.234 0.269 0 C-N-CA 121.08 -0.248 . . . . 0.0 111.457 179.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.81 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 1.3 m-85 -103.05 137.28 41.44 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 120.046 -0.662 . . . . 0.0 110.691 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.733 ' CG ' HG13 ' A' ' 101' ' ' VAL . 0.4 OUTLIER -105.1 140.84 37.67 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-O 121.958 0.885 . . . . 0.0 110.921 -177.597 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 1.097 HD21 HD13 ' A' ' 76' ' ' LEU . 11.3 mt -132.2 150.1 52.23 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.137 -0.938 . . . . 0.0 113.134 -178.027 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.453 ' O ' ' CB ' ' A' ' 98' ' ' SER . 0.0 OUTLIER -137.18 148.99 46.94 Favored 'General case' 0 C--O 1.219 -0.534 0 N-CA-C 107.67 -1.234 . . . . 0.0 107.67 177.551 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.621 ' O ' HG13 ' A' ' 93' ' ' VAL . 11.4 p -111.26 141.88 44.2 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 113.716 1.006 . . . . 0.0 113.716 -178.384 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.621 HG13 ' O ' ' A' ' 92' ' ' SER . 15.9 m -163.36 -130.57 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.448 -0.565 0 CA-C-N 113.848 -1.524 . . . . 0.0 108.283 178.617 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.536 ' O ' ' N ' ' A' ' 96' ' ' GLY . . . 32.94 35.87 0.03 OUTLIER Glycine 0 C--N 1.332 0.33 0 C-N-CA 121.321 -0.466 . . . . 0.0 113.662 178.691 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.418 ' N ' ' O ' ' A' ' 93' ' ' VAL . 8.4 t30 64.57 -70.13 0.08 Allowed 'General case' 0 N--CA 1.462 0.134 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 -178.297 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.536 ' N ' ' O ' ' A' ' 94' ' ' GLY . . . -122.47 23.69 7.08 Favored Glycine 0 N--CA 1.445 -0.723 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 177.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.418 ' ND2' ' HA3' ' A' ' 94' ' ' GLY . 0.0 OUTLIER -119.92 166.64 13.05 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 120.555 0.216 . . . . 0.0 110.616 -179.708 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.532 ' O ' ' O ' ' A' ' 67' ' ' VAL . 0.2 OUTLIER -133.1 165.57 24.45 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.518 0.675 . . . . 0.0 111.122 -179.981 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -103.93 140.04 23.19 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.902 0 N-CA-C 108.73 -0.841 . . . . 0.0 108.73 179.087 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 1.011 HD23 HG11 ' A' ' 63' ' ' VAL . 8.7 tp -104.29 106.37 16.84 Favored 'General case' 0 N--CA 1.445 -0.696 0 N-CA-C 112.984 0.735 . . . . 0.0 112.984 -178.2 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.733 HG13 ' CG ' ' A' ' 89' ' ' ASP . 0.5 OUTLIER -122.48 123.05 67.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 104.741 -2.318 . . . . 0.0 104.741 176.361 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.81 ' HB2' ' HA ' ' A' ' 88' ' ' TYR . 72.2 p -165.31 166.79 18.44 Favored 'General case' 0 C--N 1.312 -1.06 0 C-N-CA 116.876 -1.93 . . . . 0.0 116.161 -173.782 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.776 HD23 HD13 ' A' ' 60' ' ' LEU . 0.1 OUTLIER 161.5 -89.73 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 112.815 -1.993 . . . . 0.0 111.789 175.52 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.573 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 52.75 40.16 29.95 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 -179.729 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.573 ' CB ' ' O ' ' A' ' 104' ' ' ARG . 57.7 m 116.64 156.65 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.392 1.077 . . . . 0.0 108.298 -177.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.469 ' HB3' ' HG3' ' A' ' 53' ' ' LYS . 1.5 m-20 -104.92 102.55 12.07 Favored 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -178.27 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.652 ' OE1' ' HB1' ' A' ' 48' ' ' ALA . 0.7 OUTLIER -167.65 148.55 5.35 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.058 177.522 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.77 ' HE2' ' CZ ' ' A' ' 88' ' ' TYR . 0.0 OUTLIER -143.72 159.22 42.88 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 113.306 0.854 . . . . 0.0 113.306 -179.98 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.729 HG22 ' CZ ' ' A' ' 39' ' ' PHE . 1.2 t -117.5 160.82 20.59 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 114.405 -1.27 . . . . 0.0 109.409 179.133 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.944 HD13 ' CB ' ' A' ' 20' ' ' SER . 1.0 OUTLIER -50.24 -55.92 13.29 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 120.732 0.301 . . . . 0.0 111.284 -179.502 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.894 ' O ' HG23 ' A' ' 115' ' ' VAL . 0.2 OUTLIER -50.37 -65.36 0.57 Allowed 'General case' 0 C--N 1.333 -0.147 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.243 -179.853 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.88 ' O ' HD22 ' A' ' 116' ' ' LEU . 11.5 m-20 -47.64 -55.46 9.33 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.88 0.371 . . . . 0.0 110.986 -179.58 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.53 ' HB1' ' CE1' ' A' ' 55' ' ' PHE . . . -42.39 -59.04 1.98 Allowed 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.104 179.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.675 ' HE2' ' HB ' ' A' ' 16' ' ' VAL . 0.0 OUTLIER -63.26 -34.62 78.07 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.084 179.894 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 1.082 HG22 ' CG ' ' A' ' 75' ' ' LYS . 93.3 t -52.48 -65.37 0.3 Allowed 'Isoleucine or valine' 0 C--O 1.248 1.009 0 CA-C-O 122.127 0.965 . . . . 0.0 111.342 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 1.0 ' HB3' HG21 ' A' ' 63' ' ' VAL . 0.0 OUTLIER -61.35 -42.94 99.51 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 114.485 -1.234 . . . . 0.0 110.237 -178.876 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.8 ' CD2' HD23 ' A' ' 8' ' ' LEU . 0.2 OUTLIER -68.09 -16.1 63.87 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.245 179.952 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.593 ' O ' ' HG2' ' A' ' 122' ' ' ARG . 2.7 tm-20 -72.15 -56.58 5.33 Favored 'General case' 0 N--CA 1.438 -1.06 0 N-CA-C 105.453 -2.055 . . . . 0.0 105.453 176.53 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.663 ' HB2' ' OD2' ' A' ' 72' ' ' ASP . . . -64.24 -33.98 77.05 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 114.166 -1.379 . . . . 0.0 110.866 177.725 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.966 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -64.16 -57.88 8.25 Favored 'General case' 0 N--CA 1.446 -0.629 0 CA-C-N 115.272 -0.876 . . . . 0.0 111.035 -179.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.687 HD12 ' H ' ' A' ' 127' ' ' ALA . 0.1 OUTLIER -56.87 -45.81 82.24 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.997 -179.324 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.629 ' N ' ' HG ' ' A' ' 121' ' ' LEU . 0.0 OUTLIER -63.1 -65.7 0.65 Allowed 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 119.549 -0.861 . . . . 0.0 111.97 -179.823 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -53.65 -29.79 40.08 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.177 -0.92 . . . . 0.0 113.041 -178.302 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . 0.41 ' CG ' ' O ' ' A' ' 120' ' ' ALA . 4.6 mm-40 -95.11 -66.24 0.93 Allowed 'General case' 0 C--N 1.33 -0.255 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -178.685 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.458 ' CB ' ' N ' ' A' ' 129' ' ' GLY . 0.1 OUTLIER -96.03 -65.49 0.97 Allowed 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -178.529 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . 0.608 ' O ' ' HB3' ' A' ' 127' ' ' ALA . . . 98.57 74.39 1.15 Allowed Glycine 0 N--CA 1.448 -0.517 0 N-CA-C 110.795 -0.922 . . . . 0.0 110.795 -178.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.687 ' H ' HD12 ' A' ' 121' ' ' LEU . . . 92.87 -27.83 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 123.04 0.536 . . . . 0.0 109.867 -178.008 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . 0.478 ' HB2' ' O ' ' A' ' 127' ' ' ALA . 0.0 OUTLIER 153.49 120.75 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.184 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.39 178.696 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . 0.458 ' N ' ' CB ' ' A' ' 125' ' ' SER . . . -145.03 -50.47 0.03 OUTLIER Glycine 0 C--N 1.319 -0.414 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.518 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 41.0 p . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.232 -0.889 . . . . 0.0 110.913 -179.996 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.083 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 22.5 p30 -140.42 153.92 46.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.754 0.311 . . . . 0.0 110.896 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -152.47 76.16 1.14 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.901 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 204' ' ' PTR . . . . . 0.426 ' HE1' ' HE3' ' A' ' 26' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -118.93 -43.83 2.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.703 179.861 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 206' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -104.06 119.2 55.05 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.616 179.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . 0.511 ' HA ' ' HB2' ' A' ' 30' ' ' ASN . 19.1 Cg_endo -59.02 -75.21 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.402 2.068 . . . . 0.0 112.761 -179.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 208' ' ' PHE . . . . . 0.473 ' CZ ' ' HB3' ' A' ' 10' ' ' ARG . 1.4 p90 -140.72 -41.48 0.4 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.871 0.367 . . . . 0.0 111.016 -179.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 209' ' ' NH2 . . . . . 0.422 ' N ' ' CD1' ' B' ' 208' ' ' PHE . . . . . . . . 0 C--N 1.328 -0.363 0 CA-C-N 116.482 -0.326 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.3 mmm . . . . . 0 N--CA 1.485 1.304 0 CA-C-O 120.646 0.26 . . . . 0.0 111.144 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.566 ' ND2' HD22 ' A' ' 8' ' ' LEU . 8.6 p-10 36.97 -147.71 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.68 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.789 HD21 ' CA ' ' A' ' 30' ' ' ASN . 0.6 OUTLIER -99.9 16.37 24.04 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.457 0.17 . . . . 0.0 111.428 -179.342 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 1.1 m 72.79 -166.6 0.12 Allowed 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 -178.568 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.865 HD21 ' HB3' ' A' ' 62' ' ' HIS . 7.7 mt -95.51 -64.89 1.01 Allowed 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.234 0.54 . . . . 0.0 111.916 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.756 ' HA ' HD13 ' A' ' 121' ' ' LEU . 1.9 p -45.19 -47.07 12.51 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.297 -0.865 . . . . 0.0 112.367 -178.013 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . 0.43 ' O ' ' HB2' ' A' ' 10' ' ' ARG . 0.6 OUTLIER -73.4 -64.56 0.96 Allowed 'General case' 0 CA--C 1.517 -0.312 0 CA-C-O 120.857 0.361 . . . . 0.0 110.078 179.73 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.824 HD23 HD21 ' A' ' 117' ' ' LEU . 14.5 tp -41.39 -47.5 3.58 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.363 179.134 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.579 ' CG ' HD22 ' A' ' 121' ' ' LEU . 32.6 t-80 -64.97 -43.87 91.23 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.614 178.538 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.441 ' HB3' ' CZ ' ' B' ' 208' ' ' PHE . 3.4 mmt-85 -53.68 -54.08 42.98 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.995 -1.002 . . . . 0.0 111.586 -179.634 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.723 ' HG3' HG12 ' A' ' 31' ' ' VAL . 1.0 OUTLIER -67.72 -51.27 51.28 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 120.67 -0.412 . . . . 0.0 111.518 -179.505 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.855 HG23 HD23 ' A' ' 110' ' ' LEU . 11.0 p -57.69 -44.36 85.48 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 CA-C-O 121.137 0.494 . . . . 0.0 110.644 179.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.791 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 95.0 p -62.84 -51.63 66.26 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.727 179.417 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.495 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 1.0 OUTLIER -66.64 -17.6 64.93 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.934 179.977 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.488 HD13 HG22 ' A' ' 31' ' ' VAL . 4.9 mt -79.6 -59.62 2.68 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.709 -179.552 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.499 ' HB ' ' NZ ' ' A' ' 114' ' ' LYS . 1.0 OUTLIER -71.42 -27.66 29.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 C-N-CA 120.904 -0.319 . . . . 0.0 110.92 -179.798 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.406 ' HB2' ' O ' ' A' ' 13' ' ' SER . 5.6 mm-40 -74.98 -13.97 60.57 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.804 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.495 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 10.5 pt20 -170.48 62.53 0.04 OUTLIER 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.78 0.324 . . . . 0.0 111.167 179.498 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.6 mm-40 173.12 -60.11 0.01 OUTLIER 'General case' 0 C--O 1.232 0.16 0 CA-C-O 120.835 0.35 . . . . 0.0 111.37 179.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.716 ' OG ' ' HB2' ' A' ' 33' ' ' ALA . 15.0 m -85.2 -36.85 20.73 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.603 -179.237 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 55.95 71.83 0.67 Allowed Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 120.623 -0.799 . . . . 0.0 112.335 -179.594 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 53.77 97.05 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.967 0.413 . . . . 0.0 110.881 -179.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.689 ' O ' HG23 ' A' ' 109' ' ' THR . 0.2 OUTLIER -161.82 -161.25 0.76 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.021 -179.731 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.67 HG22 ' OE2' ' A' ' 52' ' ' GLU . 35.4 m -104.1 136.73 43.19 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 120.63 -0.428 . . . . 0.0 110.336 179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.465 ' CA ' ' HG ' ' A' ' 110' ' ' LEU . . . -104.8 140.83 15.15 Favored Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 120.407 -0.901 . . . . 0.0 113.554 -178.706 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.971 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -104.95 133.65 49.38 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 179.194 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.641 HD22 HG12 ' A' ' 54' ' ' VAL . 1.2 tt -104.72 148.87 26.11 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-O 121.327 0.584 . . . . 0.0 111.927 -179.252 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.548 HH21 HG21 ' A' ' 54' ' ' VAL . 0.0 OUTLIER 169.01 58.37 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 114.993 -1.003 . . . . 0.0 108.969 -179.821 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.633 ' CA ' HD11 ' A' ' 3' ' ' LEU . . . 72.3 6.07 64.38 Favored Glycine 0 CA--C 1.52 0.358 0 N-CA-C 110.424 -1.071 . . . . 0.0 110.424 -177.173 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.789 ' CA ' HD21 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -166.36 165.15 17.37 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 -179.74 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.723 HG12 ' HG3' ' A' ' 11' ' ' GLN . 0.8 OUTLIER -119.54 122.85 69.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 121.399 0.618 . . . . 0.0 111.234 179.021 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.971 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -111.91 166.04 11.56 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.313 179.528 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.719 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -103.73 142.68 33.92 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.318 0.58 . . . . 0.0 112.176 -178.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.472 HD22 ' HB ' ' A' ' 24' ' ' THR . 6.7 t30 -126.96 120.2 28.52 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.1 179.833 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.05 21.61 3.49 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.99 -179.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 13.6 tt0 -106.08 -23.98 12.49 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.192 -179.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 12.3 t -135.7 -176.54 4.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.095 0.474 . . . . 0.0 111.615 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.594 ' O ' ' NE2' ' A' ' 40' ' ' GLN . 41.5 p -120.66 126.53 50.46 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.24 -179.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.714 ' O ' ' HB2' ' A' ' 42' ' ' LEU . 3.2 p90 -81.87 -43.28 18.41 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.132 -179.559 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.594 ' NE2' ' O ' ' A' ' 38' ' ' THR . 0.8 OUTLIER 21.09 69.85 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.17 0.988 . . . . 0.0 113.164 -179.669 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.583 ' O ' ' HB2' ' A' ' 105' ' ' SER . . . 36.72 46.02 1.09 Allowed Glycine 0 C--O 1.226 -0.391 0 C-N-CA 120.907 -0.664 . . . . 0.0 112.313 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.72 ' HB3' ' OE1' ' A' ' 107' ' ' GLN . 1.3 tp -85.06 -156.93 0.27 Allowed 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.745 HG23 ' H ' ' A' ' 106' ' ' ASP . 0.2 OUTLIER -155.93 31.67 0.35 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.238 0.542 . . . . 0.0 111.197 179.81 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.904 HG23 ' O ' ' A' ' 48' ' ' ALA . 4.7 mp 54.23 5.17 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 CA-C-N 115.454 -0.794 . . . . 0.0 112.656 179.296 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.431 ' H ' ' C ' ' A' ' 43' ' ' THR . . . -87.8 -22.85 24.28 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.931 0.396 . . . . 0.0 110.672 179.556 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -108.34 -28.06 9.62 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.0 179.846 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 160.12 73.3 0.02 OUTLIER Glycine 0 C--N 1.333 0.398 0 C-N-CA 120.295 -0.955 . . . . 0.0 113.512 179.732 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.904 ' O ' HG23 ' A' ' 44' ' ' ILE . . . -152.53 174.33 14.05 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.836 0.35 . . . . 0.0 111.245 179.136 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -105.52 147.45 28.33 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.611 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.723 ' O ' HG23 ' A' ' 54' ' ' VAL . 33.1 tt0 -50.34 -39.99 47.81 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.265 0.555 . . . . 0.0 110.861 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.593 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 2.8 p -48.32 -55.17 11.34 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.659 -0.7 . . . . 0.0 111.189 179.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.67 ' OE2' HG22 ' A' ' 24' ' ' THR . 3.1 mp0 -40.52 -62.46 0.77 Allowed 'General case' 0 N--CA 1.461 0.118 0 CA-C-O 120.794 0.33 . . . . 0.0 111.04 179.725 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.66 ' HG2' ' N ' ' A' ' 54' ' ' VAL . 0.0 OUTLIER -54.02 -40.11 66.75 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.713 179.513 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.723 HG23 ' O ' ' A' ' 50' ' ' GLU . 40.7 t -63.33 -43.37 98.57 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.197 0 CA-C-O 121.192 0.52 . . . . 0.0 110.017 179.76 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.722 ' O ' HG12 ' A' ' 59' ' ' VAL . 0.1 OUTLIER -63.82 -32.91 74.57 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.446 -0.797 . . . . 0.0 110.334 179.386 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.438 ' HB2' ' HB2' ' A' ' 108' ' ' MET . . . -68.56 -59.18 3.33 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.038 -0.528 . . . . 0.0 111.035 179.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -56.48 -37.46 70.37 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.813 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.412 HG21 HD22 ' A' ' 27' ' ' LEU . 7.5 p -64.71 -60.58 2.94 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.74 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.953 HG23 HD12 ' A' ' 117' ' ' LEU . 10.1 p -62.29 -45.01 99.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.78 179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.796 HD13 HD23 ' A' ' 103' ' ' LEU . 6.3 tp -56.06 -39.23 71.75 Favored 'General case' 0 N--CA 1.455 -0.217 0 CA-C-O 120.972 0.415 . . . . 0.0 110.282 179.306 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 44.1 m -65.24 -59.08 4.46 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.926 -0.579 . . . . 0.0 111.131 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . 0.865 ' HB3' HD21 ' A' ' 5' ' ' LEU . 9.8 m170 -54.52 -42.81 71.27 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 121.186 0.517 . . . . 0.0 110.111 179.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 1.085 HG13 HG11 ' A' ' 66' ' ' VAL . 2.7 t -88.52 54.14 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.443 179.368 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.453 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . -84.16 36.94 0.59 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.292 -179.753 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.859 ' O ' HG22 ' A' ' 99' ' ' VAL . 0.8 OUTLIER 156.8 -62.99 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 122.744 0.417 . . . . 0.0 110.825 -179.757 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 1.085 HG11 HG13 ' A' ' 63' ' ' VAL . 33.3 m 40.73 -147.91 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-N 115.932 -0.577 . . . . 0.0 111.983 -179.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.527 ' O ' ' O ' ' A' ' 98' ' ' SER . 4.9 p -149.62 -25.88 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.254 0 N-CA-C 112.355 0.502 . . . . 0.0 112.355 -179.393 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.624 HD12 ' O ' ' A' ' 98' ' ' SER . 0.6 OUTLIER 32.75 88.94 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 112.616 0.598 . . . . 0.0 112.616 178.933 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.644 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 0.9 OUTLIER -75.13 -169.77 1.01 Allowed 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.694 -0.403 . . . . 0.0 110.729 179.508 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -40.28 -41.32 1.31 Allowed 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.2 -0.454 . . . . 0.0 112.162 -179.284 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.405 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 0.8 OUTLIER -60.78 -65.11 0.74 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.086 -179.743 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.96 ' O ' HD22 ' A' ' 76' ' ' LEU . 55.0 m-20 -58.47 -44.8 89.44 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.249 -179.613 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.592 ' HA ' HD23 ' A' ' 76' ' ' LEU . 0.6 OUTLIER -48.93 -57.98 5.6 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 121.547 0.689 . . . . 0.0 109.659 178.83 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.67 -27.22 68.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.059 -0.973 . . . . 0.0 108.87 177.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 1.039 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -63.76 -46.57 84.71 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 114.935 -1.029 . . . . 0.0 109.227 178.436 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 1.059 HD13 HG11 ' A' ' 115' ' ' VAL . 1.4 mm? -61.06 -59.84 4.71 Favored 'General case' 0 C--N 1.343 0.284 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 178.078 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.638 ' O ' HG12 ' A' ' 81' ' ' VAL . 5.9 mt -55.19 -30.87 60.8 Favored 'General case' 0 CA--C 1.522 -0.113 0 CA-C-N 115.008 -0.996 . . . . 0.0 110.906 -179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -64.13 -51.99 61.28 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.303 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . 0.46 ' CB ' ' HG2' ' A' ' 111' ' ' GLN . 0.3 OUTLIER -68.31 -26.43 65.63 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.257 179.851 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.632 HG22 ' HA ' ' A' ' 77' ' ' LEU . 0.6 OUTLIER -86.04 -30.34 22.73 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.734 0.302 . . . . 0.0 111.33 -179.519 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.638 HG12 ' O ' ' A' ' 77' ' ' LEU . 9.6 p -89.34 -20.05 7.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.529 -179.72 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 4.3 ptmt -45.24 -30.16 1.15 Allowed 'General case' 0 N--CA 1.463 0.18 0 CA-C-O 120.837 0.351 . . . . 0.0 111.304 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -174.53 55.4 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.913 179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 61.13 -168.7 0.17 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.697 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.9 HD13 ' N ' ' A' ' 86' ' ' ASN . 2.2 tm? 76.1 141.96 0.07 Allowed 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.197 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.9 ' N ' HD13 ' A' ' 85' ' ' LEU . 3.4 p30 -152.91 88.85 1.34 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.647 179.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . 0.405 ' CB ' ' HA3' ' A' ' 41' ' ' GLY . 12.4 p-10 -93.11 -13.7 28.18 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.634 -179.638 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.588 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 0.1 OUTLIER -106.38 153.87 21.61 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-O 121.24 0.543 . . . . 0.0 111.118 -179.877 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.744 ' CG ' HG13 ' A' ' 101' ' ' VAL . 0.4 OUTLIER -120.12 150.06 41.22 Favored 'General case' 0 N--CA 1.435 -1.177 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 -179.208 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.758 HD11 ' CB ' ' A' ' 76' ' ' LEU . 49.3 mt -142.21 161.64 37.49 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 113.664 0.987 . . . . 0.0 113.664 -177.547 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -134.4 133.65 40.78 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 114.334 -1.303 . . . . 0.0 107.9 177.716 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.873 ' O ' HG13 ' A' ' 93' ' ' VAL . 90.4 p -104.33 150.41 24.5 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 113.873 1.064 . . . . 0.0 113.873 -177.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.873 HG13 ' O ' ' A' ' 92' ' ' SER . 1.1 m -177.22 -120.03 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.555 0 CA-C-N 113.596 -1.638 . . . . 0.0 108.355 179.529 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.412 ' C ' ' O ' ' A' ' 93' ' ' VAL . . . 28.47 39.4 0.01 OUTLIER Glycine 0 C--N 1.339 0.748 0 N-CA-C 114.928 0.731 . . . . 0.0 114.928 178.262 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.422 ' N ' ' O ' ' A' ' 93' ' ' VAL . 2.5 p-10 38.61 34.11 0.08 Allowed 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 117.528 0.664 . . . . 0.0 111.018 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 135.74 10.35 1.41 Allowed Glycine 0 N--CA 1.449 -0.494 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.973 -179.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.644 ' HA ' ' HA ' ' A' ' 69' ' ' THR . 0.2 OUTLIER -121.7 166.06 14.85 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 120.651 0.263 . . . . 0.0 110.469 179.99 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.624 ' O ' HD12 ' A' ' 68' ' ' LEU . 4.1 t -139.97 161.19 38.19 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.294 0.569 . . . . 0.0 110.635 -179.849 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.859 HG22 ' O ' ' A' ' 65' ' ' ASN . 1.2 t -103.35 150.0 7.08 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.975 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 178.878 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.626 HD13 ' CD1' ' A' ' 116' ' ' LEU . 0.3 OUTLIER -103.68 114.13 28.16 Favored 'General case' 0 N--CA 1.446 -0.641 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -178.105 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.744 HG13 ' CG ' ' A' ' 89' ' ' ASP . 1.3 p -126.06 103.8 12.12 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.11 0 N-CA-C 103.198 -2.89 . . . . 0.0 103.198 174.108 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.66 ' O ' HD23 ' A' ' 103' ' ' LEU . 8.2 p -143.82 165.24 28.23 Favored 'General case' 0 C--N 1.309 -1.176 0 N-CA-C 113.879 1.066 . . . . 0.0 113.879 -174.016 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.947 HD13 ' O ' ' A' ' 105' ' ' SER . 0.1 OUTLIER 155.13 -88.13 0.0 OUTLIER 'General case' 0 N--CA 1.441 -0.899 0 CA-C-N 113.817 -1.538 . . . . 0.0 112.019 176.589 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.472 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 60.23 21.13 10.52 Favored 'General case' 0 C--N 1.317 -0.846 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 -178.54 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.947 ' O ' HD13 ' A' ' 103' ' ' LEU . 4.6 m 144.43 176.32 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 114.471 -1.24 . . . . 0.0 108.104 -179.082 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.745 ' H ' HG23 ' A' ' 43' ' ' THR . 0.3 OUTLIER -104.04 101.17 10.94 Favored 'General case' 0 C--N 1.323 -0.567 0 C-N-CA 120.315 -0.554 . . . . 0.0 111.037 -179.483 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.72 ' OE1' ' HB3' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -168.51 151.35 5.32 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.839 -0.619 . . . . 0.0 111.429 178.665 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.446 ' HB3' ' HB3' ' A' ' 55' ' ' PHE . 0.9 OUTLIER -153.64 147.91 25.87 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.144 0.497 . . . . 0.0 111.613 178.369 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.689 HG23 ' O ' ' A' ' 23' ' ' CYS . 0.3 OUTLIER -115.28 160.94 19.16 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.229 -179.916 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.855 HD23 HG23 ' A' ' 12' ' ' VAL . 0.4 OUTLIER -48.91 -60.46 2.74 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.683 0.278 . . . . 0.0 110.444 179.818 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.882 ' O ' HG23 ' A' ' 115' ' ' VAL . 3.3 tp60 -45.47 -65.18 0.57 Allowed 'General case' 0 N--CA 1.461 0.109 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.537 179.586 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.956 ' O ' HD22 ' A' ' 116' ' ' LEU . 29.6 m-20 -45.95 -53.13 10.48 Favored 'General case' 0 CA--C 1.52 -0.208 0 CA-C-O 121.113 0.482 . . . . 0.0 110.482 179.331 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.526 ' HB1' ' CE1' ' A' ' 55' ' ' PHE . . . -44.81 -63.16 0.97 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.514 -0.766 . . . . 0.0 111.202 179.732 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.791 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -64.41 -27.07 68.75 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.657 -179.756 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 1.059 HG11 HD13 ' A' ' 76' ' ' LEU . 92.6 t -58.72 -64.96 0.48 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.868 0 CA-C-O 122.148 0.975 . . . . 0.0 110.627 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.956 HD22 ' O ' ' A' ' 112' ' ' ASP . 0.1 OUTLIER -62.95 -40.08 96.57 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 114.512 -1.222 . . . . 0.0 110.04 -179.415 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.953 HD12 HG23 ' A' ' 59' ' ' VAL . 0.2 OUTLIER -67.78 -22.26 65.2 Favored 'General case' 0 CA--C 1.511 -0.536 0 O-C-N 123.235 0.335 . . . . 0.0 110.925 179.641 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.575 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 5.5 tp10 -69.03 -51.65 36.91 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 106.345 -1.724 . . . . 0.0 106.345 177.291 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.661 ' HB2' ' OD2' ' A' ' 72' ' ' ASP . . . -73.72 -19.15 60.89 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 114.464 -1.244 . . . . 0.0 110.877 177.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.915 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -77.59 -59.93 2.58 Favored 'General case' 0 CA--C 1.511 -0.539 0 CA-C-N 116.077 -0.51 . . . . 0.0 109.684 179.457 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.756 HD13 ' HA ' ' A' ' 6' ' ' SER . 0.1 OUTLIER -59.82 -30.14 68.72 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.739 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.575 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.9 OUTLIER -68.45 -54.82 14.52 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 115.508 -0.769 . . . . 0.0 112.33 -179.7 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.86 -30.07 26.74 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -177.142 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . 0.529 ' OE1' ' HB1' ' A' ' 120' ' ' ALA . 2.7 mt-10 -78.05 -66.57 0.83 Allowed 'General case' 0 C--N 1.329 -0.317 0 C-N-CA 120.222 -0.591 . . . . 0.0 112.366 -178.35 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.462 ' CB ' ' HB2' ' A' ' 128' ' ' ARG . 0.3 OUTLIER -96.49 -44.66 7.08 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.094 0.474 . . . . 0.0 111.747 -179.086 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 94.13 76.04 1.31 Allowed Glycine 0 CA--C 1.5 -0.845 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.342 -178.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.497 ' HA ' HD12 ' A' ' 121' ' ' LEU . . . 48.42 28.87 1.81 Allowed 'General case' 0 N--CA 1.452 -0.326 0 N-CA-C 108.455 -0.943 . . . . 0.0 108.455 -177.675 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . 0.462 ' HB2' ' CB ' ' A' ' 125' ' ' SER . 0.4 OUTLIER -101.65 -71.67 0.71 Allowed 'General case' 0 N--CA 1.444 -0.759 0 CA-C-N 115.026 -0.988 . . . . 0.0 112.013 -177.936 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . 0.482 ' CA ' ' HB3' ' A' ' 6' ' ' SER . . . 88.7 19.78 50.25 Favored Glycine 0 C--N 1.334 0.42 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.576 -179.541 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 45.5 m . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.884 -179.933 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.082 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 44.1 m-20 60.39 83.31 0.14 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.833 0.349 . . . . 0.0 110.86 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -137.08 174.84 10.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.926 179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 204' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -64.1 -71.03 0.19 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.881 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 206' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -97.58 154.09 38.07 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.911 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . 0.413 ' CB ' ' NE2' ' A' ' 11' ' ' GLN . 13.1 Cg_endo -55.61 -77.25 0.02 OUTLIER 'Trans proline' 0 C--N 1.344 0.327 0 C-N-CA 122.722 2.282 . . . . 0.0 112.423 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 208' ' ' PHE . . . . . 0.497 ' CD1' ' OE1' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -159.26 -17.07 0.06 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.769 0.318 . . . . 0.0 111.352 -179.987 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 209' ' ' NH2 . . . . . 0.454 ' N ' ' CD1' ' B' ' 208' ' ' PHE . . . . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.686 -0.234 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.3 mtm . . . . . 0 N--CA 1.487 1.385 0 CA-C-O 120.86 0.362 . . . . 0.0 111.169 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 12.8 p-10 -127.19 -154.04 0.61 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.716 179.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.79 HD21 ' HA ' ' A' ' 30' ' ' ASN . 5.5 mp -71.39 -79.69 0.07 Allowed 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 120.941 0.4 . . . . 0.0 110.8 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.49 ' O ' ' HB2' ' A' ' 8' ' ' LEU . 0.4 OUTLIER -165.54 -166.43 0.97 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.95 -0.568 . . . . 0.0 109.963 179.934 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.731 HD21 ' HB1' ' A' ' 120' ' ' ALA . 0.4 OUTLIER -95.68 -66.36 0.91 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 122.013 0.911 . . . . 0.0 111.6 -179.949 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.3 p -63.97 -38.36 90.8 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-N 114.46 -1.246 . . . . 0.0 112.337 -178.16 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -73.97 -34.12 64.13 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 120.517 -0.473 . . . . 0.0 109.919 179.324 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.929 HD23 HD11 ' A' ' 117' ' ' LEU . 13.5 tp -66.98 -49.7 64.58 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.947 179.24 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.678 ' CG ' HD22 ' A' ' 121' ' ' LEU . 56.5 t-80 -61.09 -46.11 91.98 Favored 'General case' 0 CA--C 1.518 -0.264 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.969 178.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.41 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 5.0 mtp180 -56.73 -42.36 79.12 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.857 179.367 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.793 ' HG3' HG22 ' A' ' 31' ' ' VAL . 5.4 tp-100 -67.13 -65.65 0.66 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.834 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.038 HG23 HD23 ' A' ' 110' ' ' LEU . 14.4 p -52.29 -46.93 46.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-O 121.071 0.462 . . . . 0.0 111.204 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.714 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 41.0 m -64.28 -37.88 89.05 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.802 -179.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.41 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 3.7 mmt180 -69.0 -30.7 69.15 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.636 -0.426 . . . . 0.0 110.513 -179.573 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.955 HD12 ' HA ' ' A' ' 12' ' ' VAL . 2.4 mt -72.67 -62.11 1.56 Allowed 'General case' 0 N--CA 1.449 -0.487 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.671 179.721 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.782 ' CG2' ' HB3' ' A' ' 110' ' ' LEU . 56.3 t -57.7 -53.61 42.44 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.471 0 CA-C-O 121.217 0.532 . . . . 0.0 111.425 -179.489 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 4.9 mm-40 -62.55 -7.35 4.52 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.461 -0.791 . . . . 0.0 111.539 -178.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -150.12 37.15 0.69 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 120.953 -0.299 . . . . 0.0 111.699 179.266 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.491 ' N ' ' O ' ' A' ' 15' ' ' LEU . 1.4 mt-10 168.33 -66.79 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 112.499 0.555 . . . . 0.0 112.499 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.903 ' CB ' HD13 ' A' ' 110' ' ' LEU . 0.8 OUTLIER -76.29 80.09 3.06 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.499 -0.773 . . . . 0.0 112.669 -177.669 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -66.64 73.5 0.16 Allowed Glycine 0 C--N 1.311 -0.843 0 CA-C-N 114.937 -1.029 . . . . 0.0 112.759 179.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 5.8 t70 75.94 22.09 1.49 Allowed 'General case' 0 N--CA 1.464 0.241 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 179.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.538 ' HB2' HD12 ' A' ' 110' ' ' LEU . 96.4 m -70.21 -165.79 0.11 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 179.329 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.552 ' HA ' ' HA ' ' A' ' 109' ' ' THR . 0.2 OUTLIER -104.39 163.42 12.45 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.818 0.342 . . . . 0.0 110.506 179.692 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -104.28 131.2 10.54 Favored Glycine 0 N--CA 1.446 -0.656 0 C-N-CA 120.131 -1.033 . . . . 0.0 113.344 -179.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.784 ' HB3' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -104.42 110.75 23.13 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 178.927 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 4.0 tt -104.0 139.47 39.08 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.474 0.654 . . . . 0.0 112.231 -178.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 165.08 51.71 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.109 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.51 ' C ' HD11 ' A' ' 3' ' ' LEU . . . 94.02 -5.53 72.22 Favored Glycine 0 CA--C 1.519 0.287 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.402 -178.259 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.79 ' HA ' HD21 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -165.55 151.98 9.86 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.818 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.793 HG22 ' HG3' ' A' ' 11' ' ' GLN . 1.5 m -104.81 123.91 59.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 C-N-CA 120.248 -0.581 . . . . 0.0 110.469 179.19 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.784 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . . . -114.02 166.34 11.7 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.618 -0.719 . . . . 0.0 111.211 -178.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.834 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -103.29 105.97 16.38 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.22 0.533 . . . . 0.0 111.25 -179.628 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.448 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 0.8 OUTLIER -85.11 124.57 31.93 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.485 -0.779 . . . . 0.0 110.559 -179.884 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -125.08 28.19 6.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.923 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -110.39 -39.35 4.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.795 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.475 HG21 ' O ' ' A' ' 47' ' ' GLY . 0.8 OUTLIER -104.96 -53.46 2.66 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.042 -0.527 . . . . 0.0 111.115 -179.963 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.6 p 60.58 96.13 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.351 0.596 . . . . 0.0 109.627 -179.269 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.597 ' HB3' ' NE2' ' A' ' 107' ' ' GLN . 18.7 m-85 -133.13 -177.52 4.55 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 113.745 1.017 . . . . 0.0 113.745 -177.793 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.426 ' N ' ' CD ' ' A' ' 40' ' ' GLN . 0.0 OUTLIER -149.75 -56.31 0.18 Allowed 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 114.838 -1.074 . . . . 0.0 110.703 179.837 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.523 ' HA3' ' CB ' ' A' ' 87' ' ' ASN . . . -150.66 101.27 0.21 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.495 -0.86 . . . . 0.0 112.911 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.719 HD23 ' NE2' ' A' ' 107' ' ' GLN . 0.1 OUTLIER -156.74 172.84 17.9 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.787 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.707 ' H ' HD12 ' A' ' 42' ' ' LEU . 0.2 OUTLIER -108.67 40.9 1.69 Allowed 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 113.286 0.847 . . . . 0.0 113.286 -176.946 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.66 ' HA ' ' HB3' ' A' ' 48' ' ' ALA . 3.3 mt 55.1 0.89 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 179.299 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.47 ' H ' ' C ' ' A' ' 43' ' ' THR . . . -68.83 -35.92 77.56 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 121.204 0.526 . . . . 0.0 109.974 179.541 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.541 ' H ' HD11 ' A' ' 42' ' ' LEU . 6.6 t -74.96 -59.77 2.59 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.436 -0.802 . . . . 0.0 110.393 179.257 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . 0.475 ' O ' HG21 ' A' ' 37' ' ' THR . . . 173.5 31.75 0.03 OUTLIER Glycine 0 CA--C 1.52 0.36 0 C-N-CA 120.638 -0.792 . . . . 0.0 113.246 179.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.66 ' HB3' ' HA ' ' A' ' 44' ' ' ILE . . . -67.67 -167.42 0.07 Allowed 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.268 0.556 . . . . 0.0 111.535 179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 17.0 mmm180 -145.67 143.4 29.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.937 179.327 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.666 ' O ' HG23 ' A' ' 54' ' ' VAL . 4.6 mp0 -45.06 -31.49 1.37 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.884 0.373 . . . . 0.0 111.381 -179.63 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.434 ' CB ' ' HG2' ' A' ' 26' ' ' LYS . 0.4 OUTLIER -60.49 -61.49 2.56 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.253 -179.936 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.419 ' HG2' ' CG2' ' A' ' 24' ' ' THR . 54.1 mt-10 -48.88 -65.35 0.58 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.122 0.487 . . . . 0.0 110.957 -179.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.627 ' HD2' HD11 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -45.01 -57.59 3.74 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.345 179.72 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.685 ' O ' HG23 ' A' ' 58' ' ' THR . 78.2 t -52.58 -35.25 20.45 Favored 'Isoleucine or valine' 0 C--O 1.232 0.133 0 CA-C-O 120.945 0.402 . . . . 0.0 110.534 179.96 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.586 ' HB3' ' HB3' ' A' ' 108' ' ' MET . 0.2 OUTLIER -65.35 -47.31 76.89 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.306 179.462 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.813 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -55.6 -49.2 73.43 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-O 120.982 0.42 . . . . 0.0 110.59 179.339 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -59.98 -45.57 92.26 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.816 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.685 HG23 ' O ' ' A' ' 54' ' ' VAL . 82.0 p -66.97 -52.83 37.96 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.804 -179.559 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.654 HG23 HD12 ' A' ' 117' ' ' LEU . 13.4 p -56.2 -46.49 81.29 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-O 120.828 0.347 . . . . 0.0 111.267 -179.189 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.463 ' N ' HG13 ' A' ' 59' ' ' VAL . 1.1 tp -67.62 -36.85 81.59 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.533 179.743 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 33.3 m -61.44 -65.23 0.72 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.123 -0.49 . . . . 0.0 112.036 -179.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . 0.856 ' NE2' HG23 ' A' ' 63' ' ' VAL . 9.7 p-80 -50.09 -44.99 52.2 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 121.019 0.438 . . . . 0.0 110.365 -179.726 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 1.009 HG21 ' HB3' ' A' ' 116' ' ' LEU . 16.8 t -63.79 -66.63 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.776 178.552 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.503 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 37.82 36.17 0.09 Allowed 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.541 178.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.549 ' H ' HG12 ' A' ' 63' ' ' VAL . 11.2 t-20 154.97 -80.44 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 122.479 0.311 . . . . 0.0 110.979 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.98 ' CG1' HG13 ' A' ' 63' ' ' VAL . 17.0 m 45.38 -154.41 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.546 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.845 HG13 ' O ' ' A' ' 67' ' ' VAL . 3.2 p -163.98 69.34 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.334 -0.084 0 CA-C-O 121.869 0.842 . . . . 0.0 111.4 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.842 HD23 ' HB3' ' A' ' 72' ' ' ASP . 1.0 OUTLIER -53.39 107.0 0.2 Allowed 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.12 -0.945 . . . . 0.0 112.32 -179.904 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.732 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 74.1 p -71.14 -176.83 1.52 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 0.0 109.778 178.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.416 ' HA ' ' OG1' ' A' ' 73' ' ' THR . 0.0 OUTLIER -46.08 -34.59 4.26 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 121.159 0.504 . . . . 0.0 111.115 -179.786 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.406 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 0.8 OUTLIER -68.83 -65.05 0.75 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.793 179.987 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.842 ' HB3' HD23 ' A' ' 68' ' ' LEU . 43.9 m-20 -55.21 -29.45 57.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.971 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.439 ' CG2' ' HB3' ' A' ' 98' ' ' SER . 1.5 p -65.65 -60.95 2.38 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 178.443 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.73 -25.97 55.92 Favored 'General case' 0 C--O 1.232 0.134 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 177.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 1.101 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.1 OUTLIER -57.71 -65.07 0.7 Allowed 'General case' 0 C--O 1.234 0.262 0 CA-C-N 114.608 -1.178 . . . . 0.0 110.564 178.922 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.848 HD21 HD11 ' A' ' 116' ' ' LEU . 0.4 OUTLIER -59.01 -38.96 80.44 Favored 'General case' 0 CA--C 1.519 -0.213 0 CA-C-O 121.2 0.524 . . . . 0.0 109.87 179.085 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.522 ' O ' HG23 ' A' ' 81' ' ' VAL . 0.1 OUTLIER -52.25 -44.37 64.85 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.617 179.766 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.422 ' O ' ' HB2' ' A' ' 82' ' ' LYS . 33.9 mt-30 -72.31 -58.24 3.56 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.92 -0.582 . . . . 0.0 110.887 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . 0.412 ' CB ' ' HG2' ' A' ' 111' ' ' GLN . 0.0 OUTLIER -56.53 -23.93 43.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.491 -179.822 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.644 HG23 ' OD1' ' A' ' 87' ' ' ASN . 51.1 m -95.12 -57.61 2.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.772 0.32 . . . . 0.0 111.63 -179.461 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.522 HG23 ' O ' ' A' ' 77' ' ' LEU . 48.9 t -64.51 -14.22 15.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.972 -179.379 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.422 ' HB2' ' O ' ' A' ' 78' ' ' GLN . 25.6 tttm -56.33 -40.47 74.48 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.617 0.246 . . . . 0.0 111.149 -179.877 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 68.2 t60 -80.32 -85.9 0.09 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.175 -179.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 44.5 t30 179.38 -73.69 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.119 0 CA-C-O 120.813 0.339 . . . . 0.0 110.992 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -55.77 -171.33 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.067 -179.778 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -117.11 139.66 50.46 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.057 -179.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . 0.644 ' OD1' HG23 ' A' ' 80' ' ' THR . 11.5 p-10 -133.37 -47.71 0.83 Allowed 'General case' 0 C--O 1.244 0.772 0 CA-C-O 121.585 0.707 . . . . 0.0 110.496 179.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.69 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 3.1 m-85 -108.83 138.35 45.29 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.53 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.649 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.1 OUTLIER -104.64 150.49 24.65 Favored 'General case' 0 N--CA 1.438 -1.064 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.444 -178.437 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.665 HD23 ' HA ' ' A' ' 100' ' ' LEU . 12.5 mt -138.53 144.65 40.03 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 112.893 0.701 . . . . 0.0 112.893 -178.013 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -132.88 114.53 14.17 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 108.14 -1.059 . . . . 0.0 108.14 178.178 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.512 ' HA ' ' CB ' ' A' ' 98' ' ' SER . 1.6 m -104.24 146.25 29.05 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 113.739 1.015 . . . . 0.0 113.739 -177.043 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.541 ' O ' ' O ' ' A' ' 94' ' ' GLY . 12.7 m -158.34 -130.83 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.594 0 CA-C-N 114.107 -1.406 . . . . 0.0 108.753 179.163 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.541 ' O ' ' O ' ' A' ' 93' ' ' VAL . . . 52.02 163.49 0.01 OUTLIER Glycine 0 N--CA 1.448 -0.562 0 C-N-CA 119.957 -1.116 . . . . 0.0 112.587 178.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -54.07 -25.65 22.83 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 177.194 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -173.29 43.76 0.16 Allowed Glycine 0 N--CA 1.441 -1.024 0 CA-C-N 114.102 -1.408 . . . . 0.0 109.948 178.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.762 ' HB2' HG22 ' A' ' 67' ' ' VAL . 0.0 OUTLIER -133.61 166.21 23.11 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-O 121.281 0.563 . . . . 0.0 111.422 -179.129 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.52 ' O ' ' N ' ' A' ' 68' ' ' LEU . 39.9 t -146.28 165.12 30.19 Favored 'General case' 0 N--CA 1.445 -0.711 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.472 -179.165 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.457 ' H ' ' HG ' ' A' ' 98' ' ' SER . 2.3 t -116.07 152.9 17.73 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.945 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.541 179.242 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.665 ' HA ' HD23 ' A' ' 90' ' ' LEU . 0.0 OUTLIER -104.69 126.39 51.73 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.7 0.762 . . . . 0.0 112.447 -179.586 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.649 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -130.71 110.67 18.9 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 N-CA-C 104.976 -2.231 . . . . 0.0 104.976 175.955 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.768 ' O ' ' HB2' ' A' ' 103' ' ' LEU . 17.8 p -153.14 165.33 35.97 Favored 'General case' 0 C--N 1.309 -1.169 0 C-N-CA 118.401 -1.32 . . . . 0.0 114.544 -174.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.768 ' HB2' ' O ' ' A' ' 102' ' ' SER . 0.8 OUTLIER 136.21 74.72 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 113.21 -1.814 . . . . 0.0 112.457 176.05 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.573 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -108.51 29.02 7.78 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 177.464 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.535 ' HB3' ' N ' ' A' ' 42' ' ' LEU . 2.8 m 153.35 163.49 0.01 OUTLIER 'General case' 0 C--O 1.231 0.117 0 CA-C-N 114.188 -1.369 . . . . 0.0 107.509 -178.489 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.457 ' O ' ' HG3' ' A' ' 107' ' ' GLN . 0.8 OUTLIER -104.79 100.98 10.61 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.977 -179.159 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.813 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 4.1 mt-30 -169.17 163.35 10.99 Favored 'General case' 0 CA--C 1.517 -0.313 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.708 177.656 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.586 ' HB3' ' HB3' ' A' ' 55' ' ' PHE . 1.0 OUTLIER -165.93 135.23 3.25 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.293 0.568 . . . . 0.0 112.126 178.293 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.552 ' HA ' ' HA ' ' A' ' 24' ' ' THR . 0.4 OUTLIER -103.13 160.93 14.21 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.004 178.608 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 1.038 HD23 HG23 ' A' ' 12' ' ' VAL . 4.0 mt -45.77 -54.71 7.53 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -178.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.843 ' O ' HG23 ' A' ' 115' ' ' VAL . 0.1 OUTLIER -48.31 -65.45 0.57 Allowed 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.747 0.308 . . . . 0.0 111.04 -179.928 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.502 ' O ' ' HB ' ' A' ' 115' ' ' VAL . 1.6 m-20 -47.2 -46.02 23.62 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.247 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.49 ' HB1' ' CE1' ' A' ' 55' ' ' PHE . . . -52.08 -60.54 3.08 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.648 179.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.842 ' NZ ' HG22 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -65.34 -22.53 66.83 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.993 179.745 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 1.101 HG22 ' CG ' ' A' ' 75' ' ' LYS . 53.0 t -61.51 -61.95 1.35 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.876 0 CA-C-O 121.894 0.854 . . . . 0.0 109.973 179.556 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 1.009 ' HB3' HG21 ' A' ' 63' ' ' VAL . 9.1 mp -61.83 -39.48 91.97 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 114.854 -1.066 . . . . 0.0 109.595 179.653 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.929 HD11 HD23 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -68.05 -23.17 64.93 Favored 'General case' 0 CA--C 1.507 -0.685 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.677 179.265 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.559 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 9.3 tp10 -66.62 -54.95 17.83 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 106.271 -1.751 . . . . 0.0 106.271 177.114 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.528 ' HB2' ' HA ' ' A' ' 68' ' ' LEU . . . -67.99 -20.13 64.99 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 114.923 -1.035 . . . . 0.0 110.497 177.226 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.915 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -77.04 -64.49 1.12 Allowed 'General case' 0 CA--C 1.509 -0.627 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.717 179.802 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.913 HD23 ' O ' ' A' ' 117' ' ' LEU . 0.2 OUTLIER -60.63 -21.76 63.06 Favored 'General case' 0 N--CA 1.444 -0.74 0 C-N-CA 120.186 -0.606 . . . . 0.0 109.63 179.416 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.559 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 14.6 ttm-85 -73.9 -57.35 4.04 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.904 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.773 ' HB2' HG12 ' A' ' 67' ' ' VAL . 0.8 OUTLIER -94.37 -21.18 19.12 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 -177.395 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -86.42 -66.58 0.89 Allowed 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -178.091 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -96.22 -60.35 1.64 Allowed 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.216 0.45 . . . . 0.0 112.216 -178.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . 0.484 ' N ' ' O ' ' A' ' 121' ' ' LEU . . . 93.47 73.49 1.22 Allowed Glycine 0 CA--C 1.5 -0.869 0 N-CA-C 110.783 -0.927 . . . . 0.0 110.783 -178.19 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . 51.48 26.6 3.29 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 -177.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.87 -70.76 0.7 Allowed 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 114.942 -1.026 . . . . 0.0 111.55 -178.231 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 106.6 24.93 6.48 Favored Glycine 0 C--N 1.332 0.343 0 C-N-CA 120.742 -0.742 . . . . 0.0 112.47 -179.687 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 16.8 t . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.887 179.981 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.088 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 202' ' ' ASP . . . . . 0.459 ' O ' ' HA3' ' A' ' 29' ' ' GLY . 0.3 OUTLIER 69.22 -79.32 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.732 0.301 . . . . 0.0 111.061 . . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 69.59 -65.87 0.29 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.835 0.35 . . . . 0.0 110.99 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 204' ' ' PTR . . . . . 0.406 ' N ' ' HD1' ' B' ' 204' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 42.53 -91.6 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.749 179.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 206' ' ' ASP . . . . . 0.409 ' CB ' ' HD2' ' B' ' 207' ' ' PRO . 0.9 OUTLIER -168.98 165.87 6.62 Favored Pre-proline 0 C--N 1.332 -0.165 0 CA-C-O 120.613 0.244 . . . . 0.0 110.808 -179.827 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . 0.433 ' O ' ' HB2' ' B' ' 208' ' ' PHE . 12.7 Cg_endo -56.18 139.38 85.67 Favored 'Trans proline' 0 C--N 1.346 0.395 0 C-N-CA 122.545 2.164 . . . . 0.0 112.336 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 208' ' ' PHE . . . . . 0.6 ' CZ ' ' HA ' ' A' ' 11' ' ' GLN . 46.2 m-85 67.2 106.82 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.681 -179.753 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.37 0 CA-C-N 116.544 -0.298 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.384 0 CA-C-O 120.993 0.425 . . . . 0.0 111.177 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.49 ' CB ' HG21 ' A' ' 58' ' ' THR . 3.7 p-10 -130.36 -157.66 0.84 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.712 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.781 HD11 ' C ' ' A' ' 29' ' ' GLY . 5.4 mp -84.95 -80.47 0.21 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.857 0.361 . . . . 0.0 111.054 179.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.431 ' O ' ' HB2' ' A' ' 8' ' ' LEU . 0.1 OUTLIER 171.3 154.33 0.07 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.101 -0.5 . . . . 0.0 109.884 -179.89 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.896 HD21 ' HB3' ' A' ' 62' ' ' HIS . 30.1 mt -49.17 -65.12 0.62 Allowed 'General case' 0 CA--C 1.511 -0.532 0 CA-C-O 121.205 0.526 . . . . 0.0 111.936 -179.392 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.2 t -42.4 -56.76 2.87 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.225 -0.898 . . . . 0.0 112.516 -178.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.86 -56.16 5.61 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.663 0.268 . . . . 0.0 111.055 -179.517 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.837 HD23 HD21 ' A' ' 117' ' ' LEU . 15.8 tp -45.52 -55.01 6.7 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.106 0.479 . . . . 0.0 110.218 179.317 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.631 ' CG ' HD22 ' A' ' 121' ' ' LEU . 51.5 t-80 -59.62 -47.76 84.33 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.532 178.564 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.48 ' HB3' ' CZ ' ' B' ' 208' ' ' PHE . 9.2 mmt-85 -49.99 -45.63 51.84 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.512 179.607 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.696 ' CG ' HG22 ' A' ' 31' ' ' VAL . 0.2 OUTLIER -64.68 -65.51 0.66 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.517 179.98 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.799 HG21 ' HB3' ' A' ' 113' ' ' ALA . 12.5 p -57.92 -48.17 84.62 Favored 'Isoleucine or valine' 0 C--O 1.236 0.344 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.768 -179.242 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.766 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 39.6 p -58.24 -53.55 57.03 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.098 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.455 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 8.9 ttm-85 -65.1 -23.81 67.25 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.831 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.446 ' CB ' HD11 ' A' ' 110' ' ' LEU . 7.5 mt -69.94 -61.73 1.66 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.806 0.336 . . . . 0.0 111.46 -179.727 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.734 HG23 HD12 ' A' ' 110' ' ' LEU . 1.2 t -71.41 -27.74 29.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.035 -179.609 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.413 ' CG ' ' O ' ' A' ' 13' ' ' SER . 9.5 mm-40 -72.57 -20.2 61.36 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.727 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.455 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 7.1 pt20 -162.42 57.43 0.23 Allowed 'General case' 0 CA--C 1.527 0.087 0 C-N-CA 120.972 -0.291 . . . . 0.0 111.539 179.516 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 178.64 -60.71 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.159 0 N-CA-C 111.86 0.319 . . . . 0.0 111.86 179.614 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.482 ' OG ' ' HB2' ' A' ' 33' ' ' ALA . 70.2 m -85.89 -78.86 0.26 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.878 0.371 . . . . 0.0 111.514 -179.069 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.591 ' H ' ' HA ' ' A' ' 16' ' ' VAL . . . 123.3 -28.47 5.55 Favored Glycine 0 N--CA 1.449 -0.465 0 C-N-CA 121.1 -0.571 . . . . 0.0 112.722 -179.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.491 ' HB3' ' O ' ' A' ' 21' ' ' GLY . 0.0 OUTLIER 167.43 6.08 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 116.801 0.301 . . . . 0.0 111.61 179.958 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.452 ' O ' ' O ' ' A' ' 22' ' ' ASP . 62.9 m -51.76 -164.75 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.083 0.468 . . . . 0.0 111.535 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.639 ' HA ' ' HA ' ' A' ' 109' ' ' THR . 12.5 m -103.61 155.53 18.48 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.697 -0.482 . . . . 0.0 109.697 179.835 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.673 ' HA2' HD23 ' A' ' 110' ' ' LEU . . . -106.02 129.05 9.6 Favored Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.249 -0.976 . . . . 0.0 113.878 -178.183 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.96 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -109.87 123.62 49.91 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.504 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.541 HD23 ' N ' ' A' ' 28' ' ' ARG . 9.9 tt -107.61 154.5 21.34 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.156 0.503 . . . . 0.0 111.739 -178.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.541 ' N ' HD23 ' A' ' 27' ' ' LEU . 2.7 mtt180 161.5 52.08 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.067 179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.781 ' C ' HD11 ' A' ' 3' ' ' LEU . . . 96.32 -9.44 67.23 Favored Glycine 0 N--CA 1.452 -0.286 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -178.024 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.466 ' N ' HD11 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -165.77 165.04 18.75 Favored 'General case' 0 N--CA 1.45 -0.431 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 179.665 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.696 HG22 ' CG ' ' A' ' 11' ' ' GLN . 1.5 m -112.69 138.24 42.66 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 C-N-CA 120.359 -0.536 . . . . 0.0 110.979 179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.96 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -130.42 165.85 21.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.544 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.482 ' HB2' ' OG ' ' A' ' 20' ' ' SER . . . -103.49 115.09 29.88 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.137 0.494 . . . . 0.0 111.574 -179.158 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.55 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 0.8 OUTLIER -90.93 119.56 31.22 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.184 179.786 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -112.27 -22.42 10.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.019 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.682 ' CG ' HG23 ' A' ' 37' ' ' THR . 2.2 pt-20 -55.37 -48.52 74.16 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.854 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.682 HG23 ' CG ' ' A' ' 36' ' ' GLU . 8.9 p -103.33 -161.24 0.82 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.411 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 58.7 p -132.83 -35.99 1.07 Allowed 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 -179.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.78 ' CD1' HG23 ' A' ' 109' ' ' THR . 0.0 OUTLIER 74.25 172.82 0.28 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 120.828 0.347 . . . . 0.0 110.236 -179.356 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.726 ' HA ' HD11 ' A' ' 85' ' ' LEU . 0.2 OUTLIER 169.36 37.52 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.122 179.708 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.669 ' C ' ' HB2' ' A' ' 107' ' ' GLN . . . 82.66 -22.05 6.93 Favored Glycine 0 CA--C 1.519 0.313 0 CA-C-N 115.897 -0.592 . . . . 0.0 112.15 -179.141 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.68 HD21 ' CB ' ' A' ' 46' ' ' SER . 12.6 tp -24.17 138.68 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.257 0.623 . . . . 0.0 112.186 179.195 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.509 HG22 ' O ' ' A' ' 43' ' ' THR . 12.8 m -91.58 26.56 2.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.795 -179.42 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.908 HD13 ' HB3' ' A' ' 48' ' ' ALA . 4.4 mm 71.69 3.18 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 179.537 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -74.05 -26.88 60.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.768 0.318 . . . . 0.0 111.113 179.942 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.68 ' CB ' HD21 ' A' ' 42' ' ' LEU . 0.5 OUTLIER -95.33 -40.52 9.49 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.074 -179.903 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.79 38.45 0.03 OUTLIER Glycine 0 CA--C 1.519 0.318 0 C-N-CA 120.394 -0.908 . . . . 0.0 113.353 179.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.908 ' HB3' HD13 ' A' ' 44' ' ' ILE . . . -81.98 159.19 23.62 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.936 0.368 . . . . 0.0 110.624 179.483 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.45 ' HB3' ' HG2' ' A' ' 52' ' ' GLU . 0.0 OUTLIER -80.2 130.61 35.34 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.695 179.902 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.715 ' O ' HG22 ' A' ' 54' ' ' VAL . 4.7 mp0 -52.76 -25.66 11.92 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.075 0.464 . . . . 0.0 110.868 179.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.568 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 92.8 p -69.55 -48.65 59.65 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.026 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.552 ' H ' ' HG2' ' A' ' 52' ' ' GLU . 0.0 OUTLIER -55.28 -56.99 13.69 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 179.15 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.684 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -52.06 -58.78 5.53 Favored 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.667 179.654 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.715 HG22 ' O ' ' A' ' 50' ' ' GLU . 16.0 m -52.73 -45.86 49.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.514 0 CA-C-O 121.17 0.509 . . . . 0.0 110.401 179.726 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.635 ' CZ ' ' HB1' ' A' ' 113' ' ' ALA . 0.9 OUTLIER -51.42 -46.86 63.06 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.363 179.237 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.735 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -59.05 -46.65 87.71 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.13 179.168 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 -57.93 -40.58 80.81 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.417 179.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.49 HG21 ' CB ' ' A' ' 2' ' ' ASN . 89.2 m -68.4 -58.57 4.15 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.212 179.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 1.025 HG23 HD12 ' A' ' 117' ' ' LEU . 7.2 p -55.92 -42.45 71.15 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.021 -179.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.854 HD22 ' HG ' ' A' ' 103' ' ' LEU . 4.9 tp -64.41 -45.2 88.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.553 179.725 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 72.3 m -57.08 -61.2 2.62 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.872 179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . 0.896 ' HB3' HD21 ' A' ' 5' ' ' LEU . 0.3 OUTLIER -49.85 -40.03 40.96 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 121.009 0.433 . . . . 0.0 110.211 179.572 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.951 HG21 ' HB3' ' A' ' 116' ' ' LEU . 56.1 t -71.47 -80.39 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.384 0 CA-C-N 115.671 -0.695 . . . . 0.0 109.648 178.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.419 ' O ' ' HB2' ' A' ' 65' ' ' ASN . . . 67.12 -6.11 0.62 Allowed 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 178.298 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.443 ' C ' HG22 ' A' ' 66' ' ' VAL . 2.6 t-20 175.35 -56.2 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.251 0 CA-C-O 120.806 0.336 . . . . 0.0 110.172 -179.587 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.914 ' CG1' HG13 ' A' ' 63' ' ' VAL . 27.7 m 42.94 -157.68 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.326 178.99 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.828 HG22 ' HB3' ' A' ' 97' ' ' ASN . 0.5 OUTLIER -161.53 89.66 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 CA-C-O 122.088 0.947 . . . . 0.0 108.708 179.531 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.611 ' HB3' ' CB ' ' A' ' 72' ' ' ASP . 0.0 OUTLIER -89.99 112.64 24.12 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.812 -1.085 . . . . 0.0 113.007 -177.34 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.511 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 9.2 p -62.63 174.95 0.88 Allowed 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.34 -0.845 . . . . 0.0 109.389 178.248 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -43.8 -30.34 0.65 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.869 0.366 . . . . 0.0 111.445 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.415 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 0.2 OUTLIER -63.04 -65.31 0.71 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.138 -179.909 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.634 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 60.1 m-20 -62.25 -28.95 70.06 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.42 -179.644 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.564 HG22 ' N ' ' A' ' 74' ' ' ALA . 0.8 OUTLIER -61.34 -60.32 3.91 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 108.723 -0.843 . . . . 0.0 108.723 179.047 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.595 ' HB1' ' OE1' ' A' ' 78' ' ' GLN . . . -58.87 -28.16 65.87 Favored 'General case' 0 N--CA 1.455 -0.186 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 177.487 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 1.055 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -56.08 -52.49 64.11 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.601 -1.181 . . . . 0.0 110.154 178.513 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 1.026 HD21 HD11 ' A' ' 116' ' ' LEU . 0.5 OUTLIER -67.01 -54.19 24.07 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.308 179.089 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.653 HD12 ' C ' ' A' ' 77' ' ' LEU . 0.4 OUTLIER -54.83 -24.76 24.47 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.4 -179.901 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.595 ' OE1' ' HB1' ' A' ' 74' ' ' ALA . 2.8 mt-30 -75.65 -63.66 1.25 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.257 -0.428 . . . . 0.0 110.399 179.096 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . 0.449 ' CB ' ' HG2' ' A' ' 111' ' ' GLN . 0.0 OUTLIER -56.54 -23.09 37.73 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.498 179.985 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 2.0 m -95.1 -59.45 1.9 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -179.185 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.499 HG23 ' O ' ' A' ' 77' ' ' LEU . 10.3 t -71.44 -7.05 8.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 112.336 0.495 . . . . 0.0 112.336 -179.055 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.07 -75.66 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.839 0.352 . . . . 0.0 111.031 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 8.4 m-70 -103.94 45.93 0.94 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.861 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 57.7 101.03 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.681 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.769 HD23 ' N ' ' A' ' 86' ' ' ASN . 1.6 tt -147.18 151.29 36.5 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.953 0.406 . . . . 0.0 111.054 -179.872 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.769 ' N ' HD23 ' A' ' 85' ' ' LEU . 2.5 m-20 -146.92 66.69 1.16 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.326 179.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . 0.441 ' HA ' ' HB2' ' A' ' 104' ' ' ARG . 8.5 t-20 -116.6 -33.83 4.74 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.907 -179.475 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.584 ' CE2' HD21 ' A' ' 116' ' ' LEU . 5.2 m-85 -107.37 140.56 40.1 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 120.62 -0.432 . . . . 0.0 111.438 -179.453 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.673 ' CG ' HG13 ' A' ' 101' ' ' VAL . 0.7 OUTLIER -108.92 145.36 35.53 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 108.86 -0.792 . . . . 0.0 108.86 -179.593 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.826 HD21 HD13 ' A' ' 76' ' ' LEU . 6.2 mt -132.67 148.39 52.35 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 114.075 1.139 . . . . 0.0 114.075 -177.254 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.451 ' O ' ' O ' ' A' ' 99' ' ' VAL . 5.1 ttp180 -146.36 105.04 3.84 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 105.715 -1.957 . . . . 0.0 105.715 177.363 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.687 ' HB2' ' HB3' ' A' ' 98' ' ' SER . 0.1 OUTLIER -103.37 165.4 11.05 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 116.22 1.933 . . . . 0.0 116.22 -174.041 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.573 ' HB ' HD22 ' A' ' 97' ' ' ASN . 0.2 OUTLIER -121.64 43.52 0.63 Allowed 'Isoleucine or valine' 0 C--O 1.242 0.705 0 CA-C-N 111.48 -2.6 . . . . 0.0 106.863 177.67 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -24.63 147.6 0.01 OUTLIER Glycine 0 N--CA 1.435 -1.431 0 CA-C-N 111.584 -2.553 . . . . 0.0 114.824 -177.101 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 74.94 30.99 0.89 Allowed 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 113.561 -1.319 . . . . 0.0 110.762 179.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 163.88 -38.85 0.32 Allowed Glycine 0 N--CA 1.444 -0.772 0 C-N-CA 120.117 -1.04 . . . . 0.0 113.604 179.735 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.828 ' HB3' HG22 ' A' ' 67' ' ' VAL . 0.0 OUTLIER -163.95 168.21 19.61 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 117.767 0.784 . . . . 0.0 111.877 -178.208 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.687 ' HB3' ' HB2' ' A' ' 92' ' ' SER . 3.7 m -153.96 141.33 19.66 Favored 'General case' 0 N--CA 1.436 -1.173 0 CA-C-N 114.987 -1.006 . . . . 0.0 109.633 178.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.451 ' O ' ' O ' ' A' ' 91' ' ' ARG . 76.4 t -104.99 123.04 58.84 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.143 0 CA-C-N 115.594 -0.73 . . . . 0.0 109.499 -179.516 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.834 HD22 HD12 ' A' ' 116' ' ' LEU . 0.0 OUTLIER -102.91 133.33 48.18 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 122.094 0.949 . . . . 0.0 112.821 -178.028 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.673 HG13 ' CG ' ' A' ' 89' ' ' ASP . 0.2 OUTLIER -127.26 117.22 46.63 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 N-CA-C 104.943 -2.243 . . . . 0.0 104.943 176.829 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.774 ' O ' ' HB2' ' A' ' 103' ' ' LEU . 0.1 OUTLIER -146.36 165.15 30.19 Favored 'General case' 0 C--N 1.307 -1.267 0 C-N-CA 118.589 -1.244 . . . . 0.0 114.205 -174.91 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.854 ' HG ' HD22 ' A' ' 60' ' ' LEU . 0.6 OUTLIER 126.13 72.41 0.0 OUTLIER 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 112.816 -1.993 . . . . 0.0 112.759 176.11 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.441 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -89.3 -5.28 57.69 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.714 -1.13 . . . . 0.0 108.171 176.889 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' A' ' 41' ' ' GLY . 70.1 m -175.79 172.94 2.42 Favored 'General case' 0 CA--C 1.529 0.163 0 CA-C-N 113.891 -1.504 . . . . 0.0 107.405 179.299 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.44 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.4 OUTLIER -104.77 102.4 11.97 Favored 'General case' 0 N--CA 1.465 0.32 0 C-N-CA 119.581 -0.848 . . . . 0.0 112.326 -178.982 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.735 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 2.2 mt-30 -168.49 165.22 12.57 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 115.637 -0.71 . . . . 0.0 110.394 178.393 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.658 ' HB2' ' HB2' ' A' ' 56' ' ' ALA . 4.1 tpt -162.04 149.87 14.54 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 179.333 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.78 HG23 ' CD1' ' A' ' 39' ' ' PHE . 0.7 OUTLIER -116.88 165.21 13.58 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.98 178.732 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.734 HD12 HG23 ' A' ' 16' ' ' VAL . 0.0 OUTLIER -51.73 -59.09 4.69 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 120.837 0.351 . . . . 0.0 110.323 179.513 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.938 ' O ' HG23 ' A' ' 115' ' ' VAL . 2.7 tp60 -48.59 -65.54 0.55 Allowed 'General case' 0 N--CA 1.462 0.142 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.726 179.743 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.677 ' O ' HD22 ' A' ' 116' ' ' LEU . 4.0 t0 -41.95 -54.1 3.6 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-O 121.317 0.579 . . . . 0.0 111.212 179.697 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.799 ' HB3' HG21 ' A' ' 12' ' ' VAL . . . -47.98 -64.17 0.87 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.219 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.766 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -60.71 -25.31 66.33 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 120.956 -0.297 . . . . 0.0 111.253 -179.673 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 1.055 HG22 ' CG ' ' A' ' 75' ' ' LYS . 89.7 t -60.57 -65.49 0.47 Allowed 'Isoleucine or valine' 0 C--O 1.245 0.819 0 CA-C-O 121.58 0.705 . . . . 0.0 110.996 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 1.026 HD11 HD21 ' A' ' 76' ' ' LEU . 0.1 OUTLIER -65.26 -37.41 87.13 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 115.624 -0.716 . . . . 0.0 110.368 -179.402 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 1.025 HD12 HG23 ' A' ' 59' ' ' VAL . 0.1 OUTLIER -67.59 -24.6 65.52 Favored 'General case' 0 CA--C 1.508 -0.669 0 C-N-CA 120.757 -0.377 . . . . 0.0 110.397 179.422 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.488 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 1.1 tp10 -67.65 -50.38 58.21 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 105.984 -1.858 . . . . 0.0 105.984 177.097 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.541 ' CB ' HD23 ' A' ' 68' ' ' LEU . . . -69.62 -24.21 63.62 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-N 114.507 -1.224 . . . . 0.0 110.376 177.242 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.899 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -75.69 -65.34 0.91 Allowed 'General case' 0 CA--C 1.51 -0.588 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.711 -179.692 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.737 HD12 ' H ' ' A' ' 127' ' ' ALA . 0.1 OUTLIER -56.16 -31.72 63.63 Favored 'General case' 0 N--CA 1.445 -0.68 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 179.115 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.488 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 2.3 ttt85 -66.95 -48.8 67.45 Favored 'General case' 0 CA--C 1.528 0.102 0 CA-C-N 115.437 -0.801 . . . . 0.0 111.597 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.61 ' HG3' HG12 ' A' ' 67' ' ' VAL . 0.0 OUTLIER -89.24 -19.1 25.8 Favored 'General case' 0 C--N 1.329 -0.303 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -177.658 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . 0.43 ' HB2' ' CD1' ' A' ' 5' ' ' LEU . 3.5 mm-40 -95.35 -66.51 0.91 Allowed 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 112.953 0.723 . . . . 0.0 112.953 -178.541 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.418 ' HB2' ' N ' ' A' ' 129' ' ' GLY . 0.3 OUTLIER -96.23 -65.46 0.97 Allowed 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -178.501 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . 0.606 ' O ' ' HB3' ' A' ' 127' ' ' ALA . . . 97.96 70.32 0.99 Allowed Glycine 0 N--CA 1.448 -0.521 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 -178.133 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.737 ' H ' HD12 ' A' ' 121' ' ' LEU . . . 92.72 -27.47 0.03 OUTLIER 'General case' 0 N--CA 1.462 0.134 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 -177.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . 0.488 ' HB2' ' O ' ' A' ' 127' ' ' ALA . 1.1 tmt_? 151.41 120.92 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.414 178.614 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . 0.418 ' N ' ' HB2' ' A' ' 125' ' ' SER . . . 163.59 48.18 0.02 OUTLIER Glycine 0 C--N 1.32 -0.354 0 CA-C-N 115.3 -0.864 . . . . 0.0 112.645 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.196 -0.907 . . . . 0.0 110.953 -179.964 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.131 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -128.11 147.7 50.55 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.769 0.318 . . . . 0.0 110.914 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -134.36 -174.95 3.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.737 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 204' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 1.3 t0 50.54 -170.02 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.535 179.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 206' ' ' ASP . . . . . 0.466 ' CB ' ' HD2' ' B' ' 207' ' ' PRO . 0.2 OUTLIER -80.05 168.81 23.16 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.825 -179.927 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . 0.678 ' HD3' HD23 ' A' ' 3' ' ' LEU . 4.7 Cg_endo -46.9 156.81 0.62 Allowed 'Trans proline' 0 C--N 1.349 0.555 0 C-N-CA 122.884 2.389 . . . . 0.0 112.522 -179.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 208' ' ' PHE . . . . . 0.48 ' CZ ' ' HB3' ' A' ' 10' ' ' ARG . 29.3 m-85 46.48 -92.88 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.359 -179.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.705 -0.225 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.471 0 CA-C-O 120.783 0.325 . . . . 0.0 110.988 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.458 ' HB3' ' CG2' ' A' ' 58' ' ' THR . 6.6 p30 44.87 -162.86 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.714 179.697 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.926 HD11 HD13 ' A' ' 8' ' ' LEU . 0.2 OUTLIER -88.51 -95.69 0.1 Allowed 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.187 -179.846 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.513 ' O ' ' HB2' ' A' ' 8' ' ' LEU . 0.0 OUTLIER -166.45 146.39 5.98 Favored 'General case' 0 CA--C 1.527 0.082 0 CA-C-O 120.608 0.242 . . . . 0.0 110.349 -179.893 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.728 HD21 ' HB3' ' A' ' 62' ' ' HIS . 19.5 mt -45.87 -65.06 0.6 Allowed 'General case' 0 CA--C 1.51 -0.57 0 CA-C-O 121.018 0.437 . . . . 0.0 111.913 -179.444 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -41.71 -62.05 0.97 Allowed 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.625 -178.327 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . 0.405 ' OD2' HD12 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -59.79 -47.06 87.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.842 179.822 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.926 HD13 HD11 ' A' ' 3' ' ' LEU . 0.1 OUTLIER -54.81 -65.82 0.51 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.997 -179.642 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.53 ' CG ' ' CD2' ' A' ' 121' ' ' LEU . 40.5 t-80 -51.73 -34.3 38.46 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-O 121.61 0.719 . . . . 0.0 109.72 179.166 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.409 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -60.38 -61.38 2.64 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 114.665 -1.152 . . . . 0.0 110.523 179.919 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.641 ' O ' ' HG ' ' A' ' 15' ' ' LEU . 7.1 pt20 -64.44 -53.22 51.83 Favored 'General case' 0 C--O 1.236 0.347 0 C-N-CA 120.774 -0.37 . . . . 0.0 111.743 -179.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.828 HG23 HD23 ' A' ' 110' ' ' LEU . 13.1 p -51.42 -48.45 34.27 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 121.078 0.466 . . . . 0.0 111.077 -179.67 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.642 ' HA ' ' NZ ' ' A' ' 114' ' ' LYS . 52.4 p -67.58 -31.41 71.44 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.417 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.409 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -72.71 -27.0 61.8 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -178.384 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.641 ' HG ' ' O ' ' A' ' 11' ' ' GLN . 0.0 OUTLIER -93.45 -37.99 11.66 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 119.308 -0.957 . . . . 0.0 110.579 179.565 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.886 HG13 ' O ' ' A' ' 20' ' ' SER . 59.5 t -68.67 -50.08 58.81 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-O 120.864 0.364 . . . . 0.0 111.239 179.688 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.401 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 2.6 mm100 -70.08 -5.66 28.38 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-N 116.028 -0.533 . . . . 0.0 111.392 -179.499 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.401 ' HG2' ' O ' ' A' ' 17' ' ' GLN . 9.0 mt-30 -145.14 32.22 1.11 Allowed 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 111.671 0.248 . . . . 0.0 111.671 179.539 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.449 ' N ' ' O ' ' A' ' 15' ' ' LEU . 0.4 OUTLIER 175.46 -71.95 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.439 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 179.847 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.952 ' CB ' HD13 ' A' ' 110' ' ' LEU . 0.7 OUTLIER -76.65 75.87 3.33 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.595 -178.629 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -62.83 74.72 0.03 OUTLIER Glycine 0 C--N 1.318 -0.445 0 CA-C-N 115.219 -0.9 . . . . 0.0 112.882 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.42 ' N ' ' O ' ' A' ' 20' ' ' SER . 16.3 t70 78.53 9.84 1.94 Allowed 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.228 0.455 . . . . 0.0 112.228 179.226 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.464 ' O ' ' OG1' ' A' ' 109' ' ' THR . 0.9 OUTLIER -61.78 -167.49 0.01 OUTLIER 'General case' 0 CA--C 1.52 -0.191 0 N-CA-C 109.803 -0.443 . . . . 0.0 109.803 179.132 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.502 ' CG2' ' HB3' ' A' ' 39' ' ' PHE . 94.6 m -103.56 142.34 34.45 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 179.629 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.614 ' CA ' ' HG ' ' A' ' 110' ' ' LEU . . . -104.76 149.45 16.89 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.049 -1.072 . . . . 0.0 114.157 -178.101 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.821 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -114.19 133.35 55.66 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.088 -0.708 . . . . 0.0 109.088 178.552 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.703 HD13 ' OG1' ' A' ' 58' ' ' THR . 7.8 tt -113.17 149.94 32.95 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.377 0.608 . . . . 0.0 111.966 -179.285 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.1 mtt180 165.42 64.23 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 114.919 -1.037 . . . . 0.0 109.183 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.608 ' C ' HD22 ' A' ' 3' ' ' LEU . . . 78.25 -4.87 57.38 Favored Glycine 0 C--N 1.334 0.417 0 C-N-CA 120.681 -0.771 . . . . 0.0 111.214 -177.89 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.497 ' C ' ' ND2' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -166.26 166.11 17.01 Favored 'General case' 0 N--CA 1.45 -0.465 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 -179.772 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.609 ' CG1' ' HG3' ' A' ' 11' ' ' GLN . 13.5 p -105.71 144.76 14.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-O 121.223 0.535 . . . . 0.0 111.765 179.361 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.821 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -129.68 159.76 35.45 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.25 178.385 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.78 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -104.17 120.78 41.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.21 0.529 . . . . 0.0 111.832 -179.246 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.459 ' ND2' ' HB ' ' A' ' 24' ' ' THR . 5.0 t30 -104.41 110.11 22.24 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.133 179.528 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -110.82 -32.29 6.9 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.518 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -63.67 -49.13 74.4 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.736 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -95.46 171.85 8.44 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.613 179.785 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.4 p -141.15 110.3 6.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.062 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.75 ' CZ ' HG22 ' A' ' 109' ' ' THR . 0.0 OUTLIER -62.64 -175.85 0.1 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.374 179.829 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.507 ' HB3' ' O ' ' A' ' 39' ' ' PHE . 1.1 pm0 160.94 44.56 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.094 179.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.405 ' HA2' ' HB2' ' A' ' 107' ' ' GLN . . . 48.8 88.61 0.01 OUTLIER Glycine 0 CA--C 1.52 0.346 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.006 -178.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.459 HD13 ' HA ' ' A' ' 42' ' ' LEU . 0.0 OUTLIER -125.9 -155.12 0.66 Allowed 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 -179.948 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -134.83 8.46 3.54 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 111.57 0.211 . . . . 0.0 111.57 179.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.77 HD13 ' HB3' ' A' ' 48' ' ' ALA . 3.6 mm 75.2 2.32 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.145 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 179.685 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -93.85 -24.28 17.8 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.814 0.34 . . . . 0.0 110.896 179.572 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.6 t -93.59 -66.64 0.91 Allowed 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.003 179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -163.13 32.76 0.29 Allowed Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.556 -0.83 . . . . 0.0 112.904 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.77 ' HB3' HD13 ' A' ' 44' ' ' ILE . . . -99.54 165.7 11.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.647 0.26 . . . . 0.0 110.925 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -109.74 149.39 29.85 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.876 0.37 . . . . 0.0 111.188 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.653 ' O ' ' HG3' ' A' ' 53' ' ' LYS . 1.0 OUTLIER -58.66 -26.83 64.19 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.849 179.719 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.513 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 20.6 p -70.34 -52.31 23.62 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.817 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.517 ' HB3' ' HG2' ' A' ' 107' ' ' GLN . 1.0 OUTLIER -53.03 -52.08 59.62 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.991 0.424 . . . . 0.0 110.535 179.434 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.653 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -57.9 -54.9 41.69 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.313 -179.967 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.626 HG22 ' O ' ' A' ' 50' ' ' GLU . 19.4 m -55.9 -46.56 80.27 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.534 0 CA-C-O 121.114 0.483 . . . . 0.0 110.165 179.6 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.828 ' O ' HG13 ' A' ' 59' ' ' VAL . 0.5 OUTLIER -50.78 -45.73 59.2 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.899 178.767 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.734 ' HB2' ' O ' ' A' ' 107' ' ' GLN . . . -60.36 -41.98 94.84 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.407 179.143 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 31.8 mm-40 -66.42 -36.91 84.01 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.371 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.703 ' OG1' HD13 ' A' ' 27' ' ' LEU . 59.5 p -73.9 -50.72 18.88 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-O 121.091 0.472 . . . . 0.0 110.045 179.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.828 HG13 ' O ' ' A' ' 55' ' ' PHE . 5.1 m -61.49 -46.81 95.82 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.696 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.988 179.829 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.728 HD22 ' CD2' ' A' ' 103' ' ' LEU . 14.3 tp -66.38 -47.09 74.46 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.636 -0.256 . . . . 0.0 111.547 -179.858 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 67.5 m -61.06 -63.88 1.15 Allowed 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.189 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . 0.728 ' HB3' HD21 ' A' ' 5' ' ' LEU . 0.0 OUTLIER -47.39 -30.36 3.24 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 121.101 0.477 . . . . 0.0 110.607 -179.737 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 1.009 HG21 ' HB3' ' A' ' 116' ' ' LEU . 25.1 t -80.32 -69.75 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.449 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.753 179.034 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.406 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 40.19 26.1 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 112.719 0.637 . . . . 0.0 112.719 178.678 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.498 ' H ' HG12 ' A' ' 63' ' ' VAL . 0.7 OUTLIER 163.78 -74.38 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.381 0 CA-C-O 120.775 0.321 . . . . 0.0 110.688 -179.764 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.916 ' CG1' HG13 ' A' ' 63' ' ' VAL . 25.0 m 44.02 -165.9 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.727 179.821 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.602 ' HB ' ' HB3' ' A' ' 97' ' ' ASN . 26.9 m -149.6 60.54 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.435 -1.206 0 CA-C-O 120.906 0.384 . . . . 0.0 111.511 -178.539 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.981 HD22 HD11 ' A' ' 76' ' ' LEU . 1.1 mp -49.21 101.4 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.619 -179.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 22.6 p -60.99 -166.78 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 178.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.92 -33.79 67.32 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.11 0.481 . . . . 0.0 110.862 179.871 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.443 ' O ' ' HE3' ' A' ' 75' ' ' LYS . 1.6 tm-20 -70.72 -65.45 0.73 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.205 -179.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.739 ' HB3' HD23 ' A' ' 68' ' ' LEU . 3.1 m-20 -51.03 -26.25 5.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.262 -0.427 . . . . 0.0 111.021 -179.655 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.446 ' CG2' ' OG ' ' A' ' 98' ' ' SER . 1.1 p -72.7 -54.62 8.49 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 177.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.561 ' HA ' HD21 ' A' ' 77' ' ' LEU . . . -54.45 -29.38 49.46 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 176.6 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 1.043 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.0 OUTLIER -58.75 -60.8 3.26 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 113.742 -1.572 . . . . 0.0 110.489 178.289 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 1.099 HD13 HD23 ' A' ' 90' ' ' LEU . 1.0 OUTLIER -52.83 -56.91 12.3 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-O 121.139 0.495 . . . . 0.0 110.483 179.41 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.561 HD21 ' HA ' ' A' ' 74' ' ' ALA . 3.3 pp -59.67 -31.13 69.27 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.119 -179.481 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.557 ' HA ' HG12 ' A' ' 81' ' ' VAL . 20.0 mm-40 -70.59 -58.62 3.49 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.945 0.402 . . . . 0.0 110.351 179.321 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . 0.415 ' CB ' ' HG2' ' A' ' 111' ' ' GLN . 1.2 t -50.46 -35.78 30.45 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.813 179.632 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.495 HG21 ' CE1' ' A' ' 88' ' ' TYR . 2.7 m -85.06 -59.28 2.38 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.037 -0.528 . . . . 0.0 111.986 -179.452 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.557 HG12 ' HA ' ' A' ' 78' ' ' GLN . 9.8 p -45.85 -30.92 1.1 Allowed 'Isoleucine or valine' 0 N--CA 1.463 0.179 0 CA-C-O 120.68 0.276 . . . . 0.0 111.592 -179.371 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.46 -50.12 53.27 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-O 120.9 0.381 . . . . 0.0 110.849 179.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER 169.6 81.44 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.794 179.744 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 49.3 t30 -158.67 156.37 29.84 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.004 -179.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -83.65 58.77 4.77 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.642 179.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.489 ' HA ' HG21 ' A' ' 80' ' ' THR . 2.9 m120 58.08 -92.31 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.645 -179.641 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . 0.436 ' O ' ' HB2' ' A' ' 104' ' ' ARG . 0.1 OUTLIER 74.07 -47.42 0.64 Allowed 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 111.823 0.305 . . . . 0.0 111.823 179.359 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.904 ' CE2' HD11 ' A' ' 90' ' ' LEU . 8.8 p90 -87.24 146.3 26.03 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-O 121.109 0.481 . . . . 0.0 111.702 -179.08 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.779 ' O ' ' O ' ' A' ' 101' ' ' VAL . 1.3 t0 -129.01 154.08 46.97 Favored 'General case' 0 N--CA 1.431 -1.404 0 N-CA-C 106.493 -1.669 . . . . 0.0 106.493 178.62 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 1.099 HD23 HD13 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -157.9 147.79 20.17 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 114.668 1.358 . . . . 0.0 114.668 -178.578 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.564 ' HB3' ' HB ' ' A' ' 99' ' ' VAL . 0.0 OUTLIER -107.71 165.2 11.61 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 105.127 -2.175 . . . . 0.0 105.127 174.876 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.6 ' HA ' ' HA ' ' A' ' 98' ' ' SER . 75.6 p -139.42 165.18 27.9 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 116.065 1.876 . . . . 0.0 116.065 -177.689 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.594 ' C ' ' O ' ' A' ' 97' ' ' ASN . 0.2 OUTLIER -136.0 21.3 0.95 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 111.448 -2.614 . . . . 0.0 107.502 178.583 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.416 ' O ' ' N ' ' A' ' 97' ' ' ASN . . . 60.31 -162.6 18.66 Favored Glycine 0 N--CA 1.441 -0.97 0 CA-C-N 113.176 -1.829 . . . . 0.0 115.939 -178.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -43.32 -38.39 2.64 Favored 'General case' 0 CA--C 1.51 -0.593 0 CA-C-N 114.221 -0.989 . . . . 0.0 110.043 -179.045 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -62.3 -47.65 88.11 Favored Glycine 0 N--CA 1.435 -1.387 0 C-N-CA 120.01 -1.09 . . . . 0.0 110.492 178.422 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.602 ' HB3' ' HB ' ' A' ' 67' ' ' VAL . 0.3 OUTLIER -165.91 168.54 15.7 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-O 121.535 0.683 . . . . 0.0 111.885 179.558 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.6 ' HA ' ' HA ' ' A' ' 92' ' ' SER . 2.1 m -149.94 145.02 26.24 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 179.052 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.564 ' HB ' ' HB3' ' A' ' 91' ' ' ARG . 73.7 t -103.48 152.69 6.05 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-O 120.887 0.375 . . . . 0.0 111.669 -177.033 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 1.078 HD21 HD21 ' A' ' 76' ' ' LEU . 0.0 OUTLIER -108.95 130.47 55.45 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 114.916 1.45 . . . . 0.0 114.916 -177.211 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.779 ' O ' ' O ' ' A' ' 89' ' ' ASP . 2.1 p -143.95 103.02 0.78 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 N-CA-C 104.581 -2.377 . . . . 0.0 104.581 174.315 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.583 ' O ' HD23 ' A' ' 103' ' ' LEU . 0.1 OUTLIER -146.42 164.49 32.29 Favored 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 119.065 -1.054 . . . . 0.0 113.17 -174.843 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.815 HD13 ' O ' ' A' ' 105' ' ' SER . 0.1 OUTLIER 156.17 -90.96 0.0 OUTLIER 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 113.505 -1.679 . . . . 0.0 111.372 176.722 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.436 ' HB2' ' O ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER 60.04 18.16 7.4 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 -179.407 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.815 ' O ' HD13 ' A' ' 103' ' ' LEU . 1.1 p 153.18 170.95 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -178.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.426 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.4 OUTLIER -110.73 100.02 8.85 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 119.25 -0.98 . . . . 0.0 111.452 179.264 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.734 ' O ' ' HB2' ' A' ' 56' ' ' ALA . 1.3 mt-30 -169.19 164.96 11.1 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 114.742 -1.117 . . . . 0.0 109.174 177.685 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.566 ' HB2' ' HB2' ' A' ' 56' ' ' ALA . 2.3 tpt -160.76 145.49 14.13 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.121 0.486 . . . . 0.0 111.495 178.668 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.75 HG22 ' CZ ' ' A' ' 39' ' ' PHE . 0.6 OUTLIER -107.62 156.06 19.46 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.053 179.513 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.952 HD13 ' CB ' ' A' ' 20' ' ' SER . 0.6 OUTLIER -46.77 -53.48 11.8 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.746 0.308 . . . . 0.0 111.151 -179.51 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.925 ' O ' HG23 ' A' ' 115' ' ' VAL . 0.2 OUTLIER -54.05 -61.95 1.97 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.212 179.324 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.504 ' HB2' HG23 ' A' ' 109' ' ' THR . 0.8 OUTLIER -46.54 -47.07 19.67 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.935 179.511 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.581 ' HB1' ' CZ ' ' A' ' 55' ' ' PHE . . . -53.01 -56.51 15.53 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.838 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.642 ' NZ ' ' HA ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -66.11 -28.77 69.06 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.827 179.94 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 1.043 HG22 ' CG ' ' A' ' 75' ' ' LYS . 94.1 t -57.15 -65.27 0.42 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.729 0 CA-C-O 122.029 0.919 . . . . 0.0 110.588 179.235 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 1.009 ' HB3' HG21 ' A' ' 63' ' ' VAL . 9.5 mp -63.5 -40.63 97.58 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 114.437 -1.256 . . . . 0.0 111.003 -179.131 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.809 HD22 ' HB3' ' A' ' 8' ' ' LEU . 0.6 OUTLIER -73.62 -15.92 61.25 Favored 'General case' 0 CA--C 1.512 -0.507 0 C-N-CA 120.325 -0.55 . . . . 0.0 111.341 -179.809 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.488 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 20.5 tt0 -73.57 -47.84 37.48 Favored 'General case' 0 CA--C 1.506 -0.749 0 N-CA-C 105.928 -1.878 . . . . 0.0 105.928 176.143 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.431 ' CB ' ' HG ' ' A' ' 68' ' ' LEU . . . -71.77 -29.02 64.03 Favored 'General case' 0 N--CA 1.451 -0.425 0 CA-C-N 114.693 -1.139 . . . . 0.0 109.868 177.073 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.968 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -68.27 -64.82 0.79 Allowed 'General case' 0 CA--C 1.504 -0.808 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.612 179.614 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.777 HD12 ' HA2' ' A' ' 126' ' ' GLY . 0.2 OUTLIER -57.52 -39.27 76.17 Favored 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 119.987 -0.685 . . . . 0.0 109.24 179.509 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.57 ' N ' ' HG ' ' A' ' 121' ' ' LEU . 19.8 ttm-85 -54.73 -45.16 74.05 Favored 'General case' 0 C--N 1.333 -0.121 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.94 179.153 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -86.21 -31.63 21.62 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -178.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -95.75 -66.52 0.9 Allowed 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 113.358 0.873 . . . . 0.0 113.358 -178.197 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.423 ' O ' ' HB2' ' A' ' 128' ' ' ARG . 47.8 t -95.59 -65.95 0.94 Allowed 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 -177.595 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . 0.777 ' HA2' HD12 ' A' ' 121' ' ' LEU . . . 60.82 45.15 97.05 Favored Glycine 0 CA--C 1.493 -1.333 0 C-N-CA 120.192 -1.004 . . . . 0.0 110.764 -178.35 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . 47.95 24.7 0.64 Allowed 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 -176.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . 0.468 ' N ' ' C ' ' A' ' 126' ' ' GLY . 0.0 OUTLIER -117.54 -52.84 2.45 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 114.565 -1.198 . . . . 0.0 111.286 -178.088 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . -55.35 -35.93 61.93 Favored Glycine 0 C--N 1.336 0.538 0 C-N-CA 120.718 -0.753 . . . . 0.0 112.77 -179.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 28.3 m . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.257 -0.878 . . . . 0.0 110.924 179.967 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.099 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -170.7 139.15 1.5 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.82 0.343 . . . . 0.0 110.899 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . 0.409 ' O ' ' C ' ' B' ' 204' ' ' PTR . 9.5 pt-20 -130.37 42.32 3.28 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.0 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 204' ' ' PTR . . . . . 0.458 ' CB ' ' HB3' ' A' ' 30' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -71.18 -14.57 62.31 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.69 -179.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 206' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -121.44 135.29 24.93 Favored Pre-proline 0 C--N 1.331 -0.196 0 CA-C-O 120.609 0.242 . . . . 0.0 111.314 -179.714 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -51.88 -74.39 0.03 OUTLIER 'Trans proline' 0 C--N 1.348 0.529 0 C-N-CA 122.864 2.376 . . . . 0.0 112.384 179.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 208' ' ' PHE . . . . . 0.424 ' CE2' ' HA ' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -176.26 -172.68 0.5 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.983 -179.898 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.516 -0.311 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.719 0.295 . . . . 0.0 111.17 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -125.07 -150.41 0.45 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.831 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 1.041 HD11 HD12 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -106.85 -81.83 0.55 Allowed 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.108 -179.632 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.521 ' O ' ' HB2' ' A' ' 8' ' ' LEU . 34.9 t -178.23 -162.27 0.06 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.643 -0.253 . . . . 0.0 110.719 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.709 HD21 ' HB3' ' A' ' 62' ' ' HIS . 4.3 mt -95.38 -65.2 0.99 Allowed 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 121.24 0.543 . . . . 0.0 111.283 179.726 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.733 ' HB3' ' HA ' ' A' ' 128' ' ' ARG . 1.7 t -44.56 -39.32 4.83 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.636 -178.76 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -78.98 -62.8 1.58 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.348 -0.387 . . . . 0.0 110.266 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 1.069 HD11 HD11 ' A' ' 27' ' ' LEU . 2.7 tp -46.57 -41.69 14.79 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.357 0.598 . . . . 0.0 109.97 179.043 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.61 ' CG ' HD22 ' A' ' 121' ' ' LEU . 33.7 t-80 -69.34 -45.66 68.93 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.521 178.667 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 16.9 mtt-85 -54.87 -44.28 73.89 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.735 -0.666 . . . . 0.0 110.193 179.236 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.658 ' CB ' HG13 ' A' ' 31' ' ' VAL . 4.4 mp0 -64.63 -65.17 0.71 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.733 179.432 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 1.0 HG23 HD23 ' A' ' 110' ' ' LEU . 9.6 p -54.8 -47.81 74.09 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 115.431 -0.804 . . . . 0.0 112.082 -179.382 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.65 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 7.8 t -60.74 -50.22 74.35 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.404 -179.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.407 ' HG3' ' NE2' ' A' ' 18' ' ' GLN . 1.3 tpm_? -68.05 -22.47 64.94 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.374 -179.465 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.603 HD11 ' O ' ' A' ' 31' ' ' VAL . 12.4 mt -74.31 -60.14 2.41 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.402 -179.7 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.638 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 0.9 OUTLIER -70.81 -28.57 34.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.204 -179.384 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.442 ' O ' ' HG2' ' A' ' 18' ' ' GLN . 5.7 mm-40 -85.46 -9.07 57.98 Favored 'General case' 0 C--N 1.322 -0.595 0 C-N-CA 120.73 -0.388 . . . . 0.0 111.312 -179.681 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.442 ' HG2' ' O ' ' A' ' 17' ' ' GLN . 7.0 mt-30 -152.92 42.38 0.61 Allowed 'General case' 0 CA--C 1.529 0.151 0 N-CA-C 111.773 0.286 . . . . 0.0 111.773 179.759 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 177.56 -69.54 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.216 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 179.667 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.638 ' HB2' ' HA ' ' A' ' 16' ' ' VAL . 20.0 m -70.62 -81.5 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.973 -0.558 . . . . 0.0 112.126 -178.315 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.637 ' H ' ' HA ' ' A' ' 16' ' ' VAL . . . 120.42 -33.43 4.5 Favored Glycine 0 N--CA 1.45 -0.376 0 N-CA-C 111.549 -0.62 . . . . 0.0 111.549 -179.22 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 169.64 28.18 0.0 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 120.764 0.316 . . . . 0.0 110.98 179.692 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.432 ' HB2' ' HB3' ' A' ' 20' ' ' SER . 0.8 OUTLIER -80.74 -156.34 0.13 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.467 -179.903 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.665 HG21 ' CD2' ' A' ' 39' ' ' PHE . 0.1 OUTLIER -104.02 163.05 12.64 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.813 0.339 . . . . 0.0 110.589 -179.944 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . 0.428 ' HA3' ' CE2' ' A' ' 55' ' ' PHE . . . -110.71 150.72 17.72 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.541 -0.837 . . . . 0.0 113.647 -178.922 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.73 ' HB3' ' HB3' ' A' ' 32' ' ' ALA . 0.3 OUTLIER -114.33 104.44 12.07 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 179.229 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 1.069 HD11 HD11 ' A' ' 8' ' ' LEU . 0.5 OUTLIER -107.31 152.66 23.84 Favored 'General case' 0 N--CA 1.463 0.223 0 N-CA-C 113.622 0.971 . . . . 0.0 113.622 -178.108 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.483 ' CB ' ' O ' ' A' ' 27' ' ' LEU . 5.7 ptp180 143.34 55.84 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 114.281 -1.327 . . . . 0.0 109.574 179.007 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.539 ' C ' HD22 ' A' ' 3' ' ' LEU . . . 105.83 -12.8 45.98 Favored Glycine 0 C--N 1.333 0.407 0 N-CA-C 111.388 -0.685 . . . . 0.0 111.388 -178.71 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.493 ' HB2' ' HA ' ' B' ' 207' ' ' PRO . 0.0 OUTLIER -166.38 165.23 17.28 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 179.849 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.677 ' HA ' ' O ' ' A' ' 26' ' ' LYS . 1.4 m -121.8 117.29 51.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-O 121.244 0.545 . . . . 0.0 110.975 179.228 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.73 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . . . -107.99 166.27 10.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.874 -179.615 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.525 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -103.36 119.73 39.44 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.094 0.473 . . . . 0.0 111.316 -179.503 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.485 ' ND2' ' CE2' ' A' ' 39' ' ' PHE . 7.0 t30 -98.56 122.09 41.32 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.594 -0.73 . . . . 0.0 110.931 -179.741 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 7.2 mtmm -118.68 -22.51 7.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.131 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -68.86 -16.21 63.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.486 -179.754 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -134.82 -175.14 3.8 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.985 0.421 . . . . 0.0 111.261 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 72.3 p -147.86 106.84 3.84 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.769 -0.651 . . . . 0.0 109.872 179.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.737 ' O ' HG22 ' A' ' 109' ' ' THR . 21.8 m-85 -116.21 138.12 51.56 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.484 0.659 . . . . 0.0 112.57 -178.839 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -126.17 -45.99 1.67 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.065 179.419 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.469 ' HA2' ' HB2' ' A' ' 107' ' ' GLN . . . 177.04 76.43 0.05 OUTLIER Glycine 0 N--CA 1.452 -0.278 0 CA-C-N 115.827 -0.624 . . . . 0.0 112.112 179.231 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.608 ' H ' ' HB2' ' A' ' 107' ' ' GLN . 0.1 OUTLIER -113.2 -159.53 0.69 Allowed 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 179.636 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.481 ' H ' HD12 ' A' ' 42' ' ' LEU . 0.2 OUTLIER -137.19 26.75 2.91 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.733 0.301 . . . . 0.0 111.793 179.963 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.831 ' HA ' ' HB3' ' A' ' 48' ' ' ALA . 1.1 mp 68.14 3.49 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 N-CA-C 112.141 0.422 . . . . 0.0 112.141 179.536 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -93.89 -33.51 13.48 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.865 0.364 . . . . 0.0 110.874 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 3.2 t -98.83 -29.47 12.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.833 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 159.4 83.47 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.412 0 C-N-CA 120.617 -0.801 . . . . 0.0 112.559 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.831 ' HB3' ' HA ' ' A' ' 44' ' ' ILE . . . -141.58 -177.48 5.19 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.044 0.45 . . . . 0.0 111.381 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.1 tpm_? -140.78 143.64 35.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.154 179.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.799 ' O ' HG23 ' A' ' 54' ' ' VAL . 2.5 mp0 -48.57 -35.16 12.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.216 0.532 . . . . 0.0 110.981 -179.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.461 ' CB ' ' HG2' ' A' ' 26' ' ' LYS . 0.7 OUTLIER -63.4 -60.61 3.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.374 -179.817 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.542 ' HG3' ' CD2' ' A' ' 39' ' ' PHE . 0.5 OUTLIER -44.41 -65.74 0.48 Allowed 'General case' 0 N--CA 1.47 0.544 0 CA-C-O 121.149 0.5 . . . . 0.0 110.568 -179.752 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.518 ' HG3' ' O ' ' A' ' 50' ' ' GLU . 0.0 OUTLIER -47.16 -50.03 21.32 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.796 179.366 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.799 HG23 ' O ' ' A' ' 50' ' ' GLU . 57.0 t -56.53 -39.19 60.56 Favored 'Isoleucine or valine' 0 C--O 1.231 0.112 0 CA-C-O 121.013 0.435 . . . . 0.0 109.906 179.085 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.935 ' CD1' HD13 ' A' ' 27' ' ' LEU . 0.1 OUTLIER -56.66 -51.05 70.25 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.01 179.23 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.632 ' HB2' ' HB2' ' A' ' 108' ' ' MET . . . -62.34 -32.79 73.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.509 179.187 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.2 tp-100 -71.26 -52.29 19.8 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.012 179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.443 ' OG1' HD23 ' A' ' 27' ' ' LEU . 2.2 m -60.15 -48.22 82.65 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.076 -179.594 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.663 ' CG2' HD12 ' A' ' 117' ' ' LEU . 9.7 p -66.36 -44.79 90.68 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 C-N-CA 120.585 -0.446 . . . . 0.0 111.314 -179.847 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.49 HD13 HD23 ' A' ' 103' ' ' LEU . 0.6 OUTLIER -54.21 -44.98 72.09 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 121.028 0.442 . . . . 0.0 110.208 179.774 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 42.3 m -63.11 -59.17 5.15 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.179 179.781 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . 0.709 ' HB3' HD21 ' A' ' 5' ' ' LEU . 0.1 OUTLIER -50.89 -49.45 59.36 Favored 'General case' 0 C--O 1.231 0.128 0 CA-C-O 120.861 0.362 . . . . 0.0 110.564 -179.951 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.961 HG22 ' HB2' ' A' ' 120' ' ' ALA . 73.5 t -58.13 -66.51 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.86 178.82 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.493 ' O ' ' CB ' ' A' ' 65' ' ' ASN . . . 36.78 32.21 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.859 178.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.554 ' O ' HG22 ' A' ' 66' ' ' VAL . 9.8 t-20 155.29 -79.47 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 122.466 0.307 . . . . 0.0 110.759 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.957 ' CG1' HG13 ' A' ' 63' ' ' VAL . 15.9 m 46.68 -155.9 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 116.121 -0.491 . . . . 0.0 112.001 179.683 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.759 HG13 ' O ' ' A' ' 67' ' ' VAL . 8.1 p -172.93 60.96 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.333 -0.112 0 CA-C-O 121.643 0.735 . . . . 0.0 111.017 -179.506 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.997 HD11 ' HB2' ' A' ' 100' ' ' LEU . 0.5 OUTLIER -42.62 99.05 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.101 -0.954 . . . . 0.0 112.465 -179.551 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.507 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 75.1 p -60.25 178.06 0.22 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.168 -0.469 . . . . 0.0 109.751 178.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.23 -31.96 1.72 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.996 0.427 . . . . 0.0 110.955 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.81 -64.34 0.88 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.502 179.667 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.641 ' HA ' ' HB2' ' A' ' 75' ' ' LYS . 69.0 m-20 -60.55 -27.85 67.98 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.363 179.611 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 20.3 m -62.62 -61.34 2.49 Favored 'General case' 0 CA--C 1.519 -0.233 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -58.0 -26.14 61.99 Favored 'General case' 0 C--N 1.332 -0.182 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 177.622 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 1.076 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.4 OUTLIER -57.24 -64.06 1.01 Allowed 'General case' 0 C--O 1.235 0.306 0 CA-C-N 114.777 -1.101 . . . . 0.0 110.134 178.783 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 1.019 HD13 HD21 ' A' ' 90' ' ' LEU . 0.4 OUTLIER -57.96 -39.22 77.58 Favored 'General case' 0 CA--C 1.519 -0.232 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.806 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.55 ' O ' HG23 ' A' ' 81' ' ' VAL . 0.1 OUTLIER -52.63 -43.73 65.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.798 179.823 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.46 -50.54 30.66 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.595 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . 0.452 ' HB3' ' CG ' ' A' ' 111' ' ' GLN . 35.6 p -62.24 -26.55 68.44 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.635 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.703 HG22 ' O ' ' A' ' 76' ' ' LEU . 13.1 t -95.25 -31.56 13.42 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 111.942 0.349 . . . . 0.0 111.942 -179.124 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.55 HG23 ' O ' ' A' ' 77' ' ' LEU . 80.1 t -91.53 -8.29 10.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 N-CA-C 111.879 0.326 . . . . 0.0 111.879 -179.568 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 8.9 pttt -55.49 -27.37 48.07 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.655 0.264 . . . . 0.0 111.172 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -161.19 94.22 0.99 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.826 0.346 . . . . 0.0 111.27 -179.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 48.94 -172.51 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.314 179.544 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 70.2 mt -64.34 105.34 0.9 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.488 179.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.408 ' HB2' ' HA ' ' A' ' 80' ' ' THR . 0.8 OUTLIER -66.31 -89.08 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.166 -179.576 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . 0.488 ' HB2' ' O ' ' A' ' 103' ' ' LEU . 29.4 p-10 -179.82 7.96 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 111.993 0.368 . . . . 0.0 111.993 -179.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.506 ' HA ' ' HB2' ' A' ' 102' ' ' SER . 3.3 m-85 -102.83 131.87 49.41 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 120.958 0.408 . . . . 0.0 111.208 -179.194 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.768 ' CG ' HG13 ' A' ' 101' ' ' VAL . 1.0 OUTLIER -109.22 144.28 37.54 Favored 'General case' 0 N--CA 1.435 -1.206 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 -179.445 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 1.019 HD21 HD13 ' A' ' 76' ' ' LEU . 39.7 mt -135.28 158.84 43.34 Favored 'General case' 0 C--N 1.318 -0.783 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -177.261 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.674 ' O ' ' CB ' ' A' ' 98' ' ' SER . 0.1 OUTLIER -134.16 161.32 35.22 Favored 'General case' 0 C--O 1.216 -0.659 0 CA-C-N 114.63 -1.168 . . . . 0.0 108.355 178.101 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.788 ' O ' HG13 ' A' ' 93' ' ' VAL . 17.9 p -103.96 157.93 16.76 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.82 0.819 . . . . 0.0 112.74 -178.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.788 HG13 ' O ' ' A' ' 92' ' ' SER . 0.0 OUTLIER 168.57 151.68 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.435 -1.197 0 CA-C-N 113.87 -1.514 . . . . 0.0 108.089 -179.171 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.419 ' HA3' ' ND2' ' A' ' 97' ' ' ASN . . . 88.74 21.39 43.47 Favored Glycine 0 C--N 1.289 -2.042 0 C-N-CA 119.931 -1.128 . . . . 0.0 112.873 -179.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 8.5 t30 72.62 -51.15 0.7 Allowed 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.912 -0.773 . . . . 0.0 108.912 -178.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -135.38 15.65 4.17 Favored Glycine 0 N--CA 1.441 -0.995 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.987 178.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.593 ' O ' ' O ' ' A' ' 93' ' ' VAL . 0.1 OUTLIER -106.88 166.76 10.36 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 117.304 0.552 . . . . 0.0 109.862 179.483 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.674 ' CB ' ' O ' ' A' ' 91' ' ' ARG . 0.1 OUTLIER -140.41 165.34 27.68 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-O 121.184 0.516 . . . . 0.0 110.908 179.847 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.499 HG12 ' HB2' ' A' ' 91' ' ' ARG . 0.5 OUTLIER -104.14 150.68 7.13 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.809 0 CA-C-N 115.361 -0.836 . . . . 0.0 108.869 179.562 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.997 ' HB2' HD11 ' A' ' 68' ' ' LEU . 3.2 tp -103.79 106.31 16.78 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 113.423 0.897 . . . . 0.0 113.423 -178.476 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.768 HG13 ' CG ' ' A' ' 89' ' ' ASP . 1.4 p -121.85 104.19 14.56 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.978 0 N-CA-C 104.007 -2.59 . . . . 0.0 104.007 174.623 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.581 ' O ' HD23 ' A' ' 103' ' ' LEU . 0.2 OUTLIER -149.87 161.31 42.53 Favored 'General case' 0 C--N 1.309 -1.194 0 C-N-CA 118.829 -1.148 . . . . 0.0 114.036 -173.841 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.581 HD23 ' O ' ' A' ' 102' ' ' SER . 0.1 OUTLIER 166.14 -69.48 0.0 OUTLIER 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 113.478 -1.692 . . . . 0.0 112.278 175.343 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.552 ' O ' ' CB ' ' A' ' 105' ' ' SER . 0.0 OUTLIER 35.14 56.18 0.79 Allowed 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.055 0.455 . . . . 0.0 110.228 179.6 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.552 ' CB ' ' O ' ' A' ' 104' ' ' ARG . 11.4 m 105.27 167.98 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 114.805 -1.089 . . . . 0.0 108.545 -177.579 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.426 ' HB3' ' CB ' ' A' ' 53' ' ' LYS . 0.5 OUTLIER -104.74 102.33 11.91 Favored 'General case' 0 C--N 1.331 -0.202 0 C-N-CA 120.092 -0.643 . . . . 0.0 112.665 -178.545 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.822 ' OE1' ' HB2' ' A' ' 48' ' ' ALA . 0.9 OUTLIER -168.72 165.1 12.09 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.338 -0.846 . . . . 0.0 109.841 177.989 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.686 ' HB3' ' HB3' ' A' ' 55' ' ' PHE . 18.6 ttm -165.59 143.4 5.84 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 121.346 0.593 . . . . 0.0 112.286 178.668 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.737 HG22 ' O ' ' A' ' 39' ' ' PHE . 0.1 OUTLIER -104.38 165.11 11.27 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.027 -0.988 . . . . 0.0 109.078 178.287 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 1.0 HD23 HG23 ' A' ' 12' ' ' VAL . 7.0 mt -56.03 -52.87 62.7 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.665 0.269 . . . . 0.0 111.395 -179.369 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.849 ' O ' HG23 ' A' ' 115' ' ' VAL . 1.8 tp60 -50.45 -65.19 0.6 Allowed 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 120.786 0.327 . . . . 0.0 110.642 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.893 ' O ' HD22 ' A' ' 116' ' ' LEU . 0.3 OUTLIER -47.71 -45.53 28.69 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.096 0.474 . . . . 0.0 110.895 179.898 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.845 ' HB1' ' CE1' ' A' ' 55' ' ' PHE . . . -49.42 -61.24 2.21 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.936 179.664 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.697 ' NZ ' HG22 ' A' ' 12' ' ' VAL . 0.0 OUTLIER -66.36 -25.52 66.84 Favored 'General case' 0 C--N 1.333 -0.135 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.239 -179.982 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 1.076 HG22 ' CG ' ' A' ' 75' ' ' LYS . 76.6 t -58.36 -65.11 0.46 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.808 0 CA-C-O 121.991 0.9 . . . . 0.0 110.305 179.37 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.893 HD22 ' O ' ' A' ' 112' ' ' ASP . 0.0 OUTLIER -62.95 -40.98 99.3 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.645 -179.476 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.874 ' CD1' HD23 ' A' ' 8' ' ' LEU . 0.1 OUTLIER -69.03 -22.41 64.05 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 120.792 0.33 . . . . 0.0 111.433 -179.763 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.594 ' O ' ' HB3' ' A' ' 122' ' ' ARG . 30.8 tt0 -69.75 -49.51 52.4 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 106.008 -1.849 . . . . 0.0 106.008 177.324 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.657 ' O ' ' HB2' ' A' ' 123' ' ' GLN . . . -70.18 -28.27 65.18 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-N 114.386 -1.279 . . . . 0.0 110.081 177.384 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 0.961 ' HB2' HG22 ' A' ' 63' ' ' VAL . . . -72.05 -63.58 1.11 Allowed 'General case' 0 CA--C 1.511 -0.537 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.397 -179.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.631 ' O ' ' N ' ' A' ' 126' ' ' GLY . 0.0 OUTLIER -55.99 -42.35 76.23 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.314 -179.746 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.594 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.4 OUTLIER -67.37 -39.14 85.65 Favored 'General case' 0 CA--C 1.53 0.186 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.904 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.657 ' HB2' ' O ' ' A' ' 119' ' ' ALA . 1.7 mp0 -77.15 -36.73 54.99 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.521 0.563 . . . . 0.0 112.521 -178.711 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -96.17 -69.74 0.74 Allowed 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 -177.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.506 ' OG ' ' N ' ' A' ' 129' ' ' GLY . 26.0 t -99.53 -66.84 0.88 Allowed 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 -178.774 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . 0.631 ' N ' ' O ' ' A' ' 121' ' ' LEU . . . 69.14 50.24 35.1 Favored Glycine 0 N--CA 1.445 -0.716 0 CA-C-N 114.939 -1.028 . . . . 0.0 111.779 -178.367 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -177.54 -54.2 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.96 -0.62 . . . . 0.0 109.615 179.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . 0.733 ' HA ' ' HB3' ' A' ' 6' ' ' SER . 0.0 OUTLIER 168.77 36.57 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.552 178.976 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . 0.506 ' N ' ' OG ' ' A' ' 125' ' ' SER . . . 93.05 -4.4 74.59 Favored Glycine 0 C--N 1.315 -0.596 0 CA-C-N 115.683 -0.69 . . . . 0.0 112.636 -179.765 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 29.0 t . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.273 -0.87 . . . . 0.0 110.957 -179.982 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.113 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 1.4 t70 60.89 95.28 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 120.815 0.341 . . . . 0.0 110.931 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -105.95 167.42 9.8 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.956 179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 204' ' ' PTR . . . . . 0.425 ' HD2' ' ND2' ' A' ' 30' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 205' ' ' ASP . . . . . 0.412 ' O ' ' O ' ' B' ' 206' ' ' ASP . 0.7 OUTLIER -93.66 91.66 7.14 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.77 -179.25 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 206' ' ' ASP . . . . . 0.486 ' HB2' ' HD2' ' B' ' 207' ' ' PRO . 0.6 OUTLIER 54.34 159.46 0.06 OUTLIER Pre-proline 0 CA--C 1.533 0.295 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.85 179.116 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . 0.493 ' HA ' ' HB2' ' A' ' 30' ' ' ASN . 19.1 Cg_endo -60.26 -165.45 0.04 OUTLIER 'Trans proline' 0 C--N 1.347 0.459 0 C-N-CA 122.697 2.265 . . . . 0.0 112.289 -179.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 208' ' ' PHE . . . . . 0.422 ' CD1' ' HG3' ' A' ' 11' ' ' GLN . 0.1 OUTLIER -66.08 -168.06 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.952 -179.807 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.512 -0.313 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 32.0 mmt . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.79 0.329 . . . . 0.0 111.149 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -88.42 -164.35 1.11 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.815 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.898 HD11 ' HA ' ' A' ' 30' ' ' ASN . 1.2 mt -68.87 -81.56 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.062 0.458 . . . . 0.0 110.368 179.469 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.414 ' CB ' ' OD1' ' A' ' 7' ' ' ASP . 0.6 OUTLIER -170.12 -156.11 0.13 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.749 -0.66 . . . . 0.0 109.616 179.732 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 1.089 HD21 ' HB1' ' A' ' 120' ' ' ALA . 0.3 OUTLIER -95.71 -66.31 0.92 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.712 0.768 . . . . 0.0 112.429 -179.33 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 1.2 p -65.08 -41.14 95.31 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.549 -1.205 . . . . 0.0 112.87 -177.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . 0.414 ' OD1' ' CB ' ' A' ' 4' ' ' SER . 0.1 OUTLIER -67.53 -48.21 67.67 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.23 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.887 HD23 HD21 ' A' ' 117' ' ' LEU . 18.2 tp -51.74 -46.58 64.09 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.927 178.738 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.571 ' CG ' ' CD2' ' A' ' 121' ' ' LEU . 46.1 t-80 -65.06 -39.92 93.98 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.538 178.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.407 ' HB2' ' O ' ' A' ' 7' ' ' ASP . 0.1 OUTLIER -52.06 -53.14 45.79 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.258 -179.691 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.979 ' HG3' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -69.64 -55.38 10.2 Favored 'General case' 0 C--O 1.238 0.465 0 C-N-CA 120.885 -0.326 . . . . 0.0 111.566 -179.706 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.687 HG23 HG21 ' A' ' 31' ' ' VAL . 2.4 p -55.82 -46.82 80.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.385 0 CA-C-O 120.973 0.416 . . . . 0.0 111.244 -179.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.805 ' HA ' ' HE3' ' A' ' 114' ' ' LYS . 56.0 p -60.96 -53.32 58.69 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.309 179.775 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.48 ' O ' ' HG3' ' A' ' 18' ' ' GLN . 0.6 OUTLIER -60.73 -21.09 62.59 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.823 0.344 . . . . 0.0 110.445 -179.916 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.61 HD12 ' O ' ' A' ' 11' ' ' GLN . 4.8 mt -78.11 -65.54 0.96 Allowed 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 112.74 0.645 . . . . 0.0 112.74 -179.247 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.655 HG23 HD13 ' A' ' 110' ' ' LEU . 0.9 OUTLIER -72.49 -26.75 24.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 C-N-CA 120.526 -0.47 . . . . 0.0 111.662 -178.863 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.457 ' HB2' ' O ' ' A' ' 13' ' ' SER . 3.5 mm100 -70.54 -21.86 62.67 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 120.461 -0.495 . . . . 0.0 110.326 179.639 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.48 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 2.1 pt20 -165.99 63.33 0.11 Allowed 'General case' 0 CA--C 1.528 0.113 0 CA-C-O 120.75 0.31 . . . . 0.0 111.318 179.376 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 175.53 -57.72 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.537 179.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.591 ' CB ' HD13 ' A' ' 110' ' ' LEU . 63.5 m -85.51 -39.63 17.24 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.647 -179.179 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 59.53 69.23 1.34 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.45 -0.881 . . . . 0.0 111.969 -179.447 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.42 ' N ' HG22 ' A' ' 16' ' ' VAL . 0.0 OUTLIER 58.77 88.7 0.06 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.977 0.418 . . . . 0.0 110.7 -179.635 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . 0.449 ' HB2' ' HB3' ' A' ' 20' ' ' SER . 97.1 m -149.79 -162.91 1.66 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.962 -179.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.774 ' CG2' HG22 ' A' ' 109' ' ' THR . 0.0 OUTLIER -104.46 147.96 26.99 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.734 -0.386 . . . . 0.0 110.713 -179.923 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -104.99 140.6 15.07 Favored Glycine 0 N--CA 1.443 -0.834 0 C-N-CA 120.282 -0.961 . . . . 0.0 113.386 -178.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.963 ' HB3' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -104.45 121.77 44.13 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 178.967 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.772 HD22 HG12 ' A' ' 54' ' ' VAL . 8.7 tt -104.6 149.04 25.86 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.327 0.584 . . . . 0.0 112.243 -178.762 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 162.33 55.76 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.167 0 CA-C-N 114.951 -1.022 . . . . 0.0 109.383 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.716 ' O ' HD21 ' A' ' 3' ' ' LEU . . . 90.61 -8.1 80.32 Favored Glycine 0 C--N 1.332 0.336 0 N-CA-C 111.355 -0.698 . . . . 0.0 111.355 -178.153 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.898 ' HA ' HD11 ' A' ' 3' ' ' LEU . 0.0 OUTLIER -165.92 162.97 18.54 Favored 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 108.61 -0.885 . . . . 0.0 108.61 179.815 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.979 HG12 ' HG3' ' A' ' 11' ' ' GLN . 7.4 p -104.7 133.58 48.45 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.426 0 CA-C-O 121.482 0.658 . . . . 0.0 110.784 178.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.963 ' HB3' ' HB3' ' A' ' 26' ' ' LYS . . . -113.22 166.38 11.51 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.657 -179.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.529 ' HA ' HD11 ' A' ' 110' ' ' LEU . . . -102.14 105.95 16.74 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.617 0.722 . . . . 0.0 110.573 -179.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.496 HD21 ' HE1' ' A' ' 39' ' ' PHE . 62.0 t30 -91.47 114.35 26.85 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 114.604 -1.18 . . . . 0.0 111.321 -179.015 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 2.1 ttpt -131.08 40.22 3.48 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.558 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -110.93 -38.89 4.97 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.589 -179.383 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.809 ' O ' HG23 ' A' ' 38' ' ' THR . 89.5 m -122.51 -106.44 0.36 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.655 -0.248 . . . . 0.0 110.511 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.809 HG23 ' O ' ' A' ' 37' ' ' THR . 0.7 OUTLIER -174.44 -49.1 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.233 0 N-CA-C 113.037 0.754 . . . . 0.0 113.037 179.933 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.639 ' O ' ' O ' ' A' ' 38' ' ' THR . 0.9 OUTLIER 45.1 122.38 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.879 0.847 . . . . 0.0 110.977 -177.72 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.631 HE22 HD12 ' A' ' 42' ' ' LEU . 1.1 pp0? -128.61 40.38 3.66 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.0 -178.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.622 ' C ' ' HB2' ' A' ' 107' ' ' GLN . . . 90.24 8.53 66.37 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 115.396 -0.82 . . . . 0.0 113.112 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.631 HD12 HE22 ' A' ' 40' ' ' GLN . 0.3 OUTLIER -49.41 -166.58 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 117.04 0.42 . . . . 0.0 111.364 179.311 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.674 ' C ' HD12 ' A' ' 44' ' ' ILE . 1.5 m -132.58 24.17 4.38 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 -179.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.809 ' HA ' ' HB3' ' A' ' 48' ' ' ALA . 1.3 mp 67.4 2.89 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 179.627 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.74 -32.51 60.03 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.847 0.356 . . . . 0.0 111.011 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.551 ' CB ' HD21 ' A' ' 42' ' ' LEU . 7.8 t -82.06 -62.64 1.57 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.095 -179.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -175.07 32.54 0.09 OUTLIER Glycine 0 C--N 1.331 0.281 0 C-N-CA 120.5 -0.857 . . . . 0.0 112.997 -179.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.809 ' HB3' ' HA ' ' A' ' 44' ' ' ILE . . . -83.7 -163.95 0.84 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.073 0.463 . . . . 0.0 111.64 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -130.79 -178.31 4.74 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.134 179.528 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.647 ' O ' HG23 ' A' ' 54' ' ' VAL . 2.4 mp0 -83.03 -27.88 30.03 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.91 0.386 . . . . 0.0 110.842 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.437 ' CB ' ' HG2' ' A' ' 26' ' ' LYS . 1.5 m -55.41 -65.14 0.64 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.743 -179.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.682 ' OE1' HG22 ' A' ' 24' ' ' THR . 31.2 mm-40 -49.39 -67.38 0.27 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.901 0.381 . . . . 0.0 111.641 -179.08 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.604 ' CB ' HD11 ' A' ' 44' ' ' ILE . 0.0 OUTLIER -40.54 -54.38 2.52 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.917 179.147 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.772 HG12 HD22 ' A' ' 27' ' ' LEU . 77.3 t -58.09 -44.83 88.14 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.806 179.178 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.621 ' HA ' HD13 ' A' ' 27' ' ' LEU . 0.5 OUTLIER -55.31 -33.49 63.34 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.488 178.995 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.537 ' HB1' HD11 ' A' ' 60' ' ' LEU . . . -64.17 -65.2 0.71 Allowed 'General case' 0 CA--C 1.509 -0.599 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 177.837 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . 0.437 ' HA ' HD12 ' A' ' 60' ' ' LEU . 3.7 mm-40 -37.46 -47.64 0.9 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.652 179.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.429 HG21 HD11 ' A' ' 27' ' ' LEU . 68.8 p -67.27 -46.56 73.29 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 -179.208 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.996 HG23 HD12 ' A' ' 117' ' ' LEU . 11.9 p -72.23 -28.21 28.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -178.183 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 1.025 HD13 HD21 ' A' ' 103' ' ' LEU . 0.0 OUTLIER -92.97 -21.38 19.81 Favored 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 120.201 -0.599 . . . . 0.0 110.525 179.486 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.407 ' CB ' ' O ' ' A' ' 57' ' ' GLN . 44.7 m -79.82 -42.9 23.42 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 109.966 -0.383 . . . . 0.0 109.966 178.259 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -61.96 -49.2 77.06 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.873 179.353 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.974 HG12 HG11 ' A' ' 66' ' ' VAL . 2.8 m -58.23 -60.64 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.24 0 CA-C-N 116.035 -0.529 . . . . 0.0 111.035 179.499 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.599 ' H ' HG23 ' A' ' 63' ' ' VAL . . . 40.36 28.66 0.05 OUTLIER 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 116.237 -0.438 . . . . 0.0 112.06 179.659 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.604 ' O ' HG22 ' A' ' 66' ' ' VAL . 0.9 OUTLIER 159.19 -80.26 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 CA-C-O 120.724 0.297 . . . . 0.0 111.697 -179.679 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.974 HG11 HG12 ' A' ' 63' ' ' VAL . 23.0 m 49.98 -158.85 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.328 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.95 -179.142 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.923 HG22 ' HB3' ' A' ' 97' ' ' ASN . 4.5 p -163.92 87.28 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 121.597 0.713 . . . . 0.0 109.777 -179.815 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.843 HD23 ' HB3' ' A' ' 72' ' ' ASP . 1.1 mp -80.87 112.73 18.52 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.423 -0.808 . . . . 0.0 112.66 -177.882 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.609 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 2.3 p -89.97 -177.18 5.13 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.52 179.033 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.449 ' HA ' ' OG1' ' A' ' 73' ' ' THR . 0.0 OUTLIER -34.67 -39.06 0.08 Allowed 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 116.161 -0.472 . . . . 0.0 112.018 -179.312 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -69.27 -65.35 0.72 Allowed 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.406 -179.435 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.843 ' HB3' HD23 ' A' ' 68' ' ' LEU . 0.7 OUTLIER -60.57 -30.91 70.09 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.685 -179.902 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.547 ' O ' ' HG ' ' A' ' 77' ' ' LEU . 1.5 p -61.86 -64.32 0.97 Allowed 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 108.59 -0.893 . . . . 0.0 108.59 178.247 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -53.23 -25.84 15.69 Favored 'General case' 0 N--CA 1.456 -0.163 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 177.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 1.077 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.1 OUTLIER -58.92 -56.33 23.66 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-N 115.164 -0.925 . . . . 0.0 110.187 178.765 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.871 HD13 HD11 ' A' ' 90' ' ' LEU . 1.3 mp -63.47 -47.91 79.85 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 178.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.676 ' O ' HG12 ' A' ' 81' ' ' VAL . 4.9 mt -58.61 -29.68 66.67 Favored 'General case' 0 N--CA 1.461 0.097 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.355 179.406 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.597 ' HA ' HG12 ' A' ' 81' ' ' VAL . 2.0 mt-30 -72.72 -47.66 45.2 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.533 179.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 22.0 p -59.06 -38.76 80.16 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.697 179.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.432 HG22 ' HA ' ' A' ' 77' ' ' LEU . 15.3 t -75.97 -45.17 36.21 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.281 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.676 HG12 ' O ' ' A' ' 77' ' ' LEU . 8.2 p -74.7 -12.43 15.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.645 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 9.4 mmmt -46.64 -64.09 0.85 Allowed 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.78 0.324 . . . . 0.0 111.291 -179.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -179.9 44.8 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.8 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 13.9 p30 -172.7 -177.2 1.64 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.987 -179.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 6.8 mp -111.03 116.23 30.82 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.709 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.409 ' HB2' ' CB ' ' A' ' 80' ' ' THR . 0.9 OUTLIER -88.26 157.33 18.8 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.969 0.414 . . . . 0.0 111.194 -179.672 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . 0.541 ' OD1' ' HA3' ' A' ' 41' ' ' GLY . 0.4 OUTLIER -116.69 35.07 4.74 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-O 121.703 0.763 . . . . 0.0 110.387 179.861 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.579 ' HA ' ' HB3' ' A' ' 102' ' ' SER . 4.7 m-85 -101.96 152.23 21.19 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.457 -179.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.721 ' CB ' ' O ' ' A' ' 101' ' ' VAL . 0.2 OUTLIER -124.34 143.93 50.3 Favored 'General case' 0 N--CA 1.443 -0.813 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 -179.353 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.871 HD11 HD13 ' A' ' 76' ' ' LEU . 11.8 mt -133.02 151.96 52.01 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -177.232 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.636 ' O ' ' CB ' ' A' ' 98' ' ' SER . 0.0 OUTLIER -134.19 159.43 40.94 Favored 'General case' 0 C--O 1.218 -0.575 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.048 178.291 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.788 ' O ' HG13 ' A' ' 93' ' ' VAL . 0.7 OUTLIER -103.98 160.95 14.39 Favored 'General case' 0 CA--C 1.516 -0.35 0 CA-C-O 121.738 0.78 . . . . 0.0 112.56 -178.882 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.788 HG13 ' O ' ' A' ' 92' ' ' SER . 0.0 OUTLIER 167.07 141.42 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.891 0 CA-C-N 113.992 -1.458 . . . . 0.0 108.5 -179.215 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.479 ' HA3' ' ND2' ' A' ' 97' ' ' ASN . . . 98.11 26.4 9.57 Favored Glycine 0 C--N 1.298 -1.576 0 C-N-CA 119.659 -1.258 . . . . 0.0 113.052 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 41.94 30.52 0.18 Allowed 'General case' 0 N--CA 1.453 -0.322 0 CA-C-O 121.443 0.64 . . . . 0.0 109.649 -178.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 157.18 -7.93 0.21 Allowed Glycine 0 N--CA 1.442 -0.924 0 CA-C-N 115.062 -0.972 . . . . 0.0 112.893 -179.064 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.923 ' HB3' HG22 ' A' ' 67' ' ' VAL . 0.0 OUTLIER -104.74 166.8 10.14 Favored 'General case' 0 C--N 1.346 0.428 0 CA-C-N 118.261 1.03 . . . . 0.0 109.823 179.389 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.636 ' CB ' ' O ' ' A' ' 91' ' ' ARG . 0.1 OUTLIER -141.85 163.95 31.52 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.278 0.561 . . . . 0.0 110.941 -179.811 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.57 HG12 ' HB2' ' A' ' 91' ' ' ARG . 0.4 OUTLIER -104.72 151.65 7.04 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.825 179.782 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.838 HD21 HD11 ' A' ' 116' ' ' LEU . 0.1 OUTLIER -104.13 105.85 16.16 Favored 'General case' 0 CA--C 1.509 -0.602 0 CA-C-O 121.68 0.752 . . . . 0.0 112.439 -179.684 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.721 ' O ' ' CB ' ' A' ' 89' ' ' ASP . 43.6 t -122.15 105.67 16.65 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.978 0 N-CA-C 105.348 -2.093 . . . . 0.0 105.348 175.761 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.745 ' O ' HD23 ' A' ' 103' ' ' LEU . 73.7 m -146.37 153.3 40.34 Favored 'General case' 0 C--N 1.309 -1.157 0 C-N-CA 119.256 -0.978 . . . . 0.0 113.051 -175.427 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 1.025 HD21 HD13 ' A' ' 60' ' ' LEU . 1.2 mm? 144.19 67.21 0.0 OUTLIER 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 114.612 -1.176 . . . . 0.0 112.643 176.7 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.526 ' CB ' ' HB2' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -101.85 21.31 14.82 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 114.686 -1.143 . . . . 0.0 108.012 177.023 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.581 ' CB ' ' O ' ' A' ' 41' ' ' GLY . 4.3 m 159.02 160.32 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 -179.003 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.436 ' C ' ' O ' ' A' ' 42' ' ' LEU . 0.4 OUTLIER -104.79 102.85 12.39 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 113.772 1.027 . . . . 0.0 113.772 -177.168 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.631 ' NE2' ' HB3' ' A' ' 39' ' ' PHE . 1.0 OUTLIER -168.39 162.66 12.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.183 -0.917 . . . . 0.0 109.289 177.278 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.876 ' SD ' HG11 ' A' ' 59' ' ' VAL . 0.0 OUTLIER -165.38 126.06 1.9 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.27 0.557 . . . . 0.0 112.067 179.95 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.774 HG22 ' CG2' ' A' ' 24' ' ' THR . 4.7 p -103.0 162.73 12.69 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.558 -179.638 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.655 HD13 HG23 ' A' ' 16' ' ' VAL . 1.0 OUTLIER -39.34 -64.85 0.43 Allowed 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.293 -179.576 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.872 ' O ' HG23 ' A' ' 115' ' ' VAL . 1.5 tp60 -43.69 -64.35 0.67 Allowed 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.435 -0.348 . . . . 0.0 111.278 179.653 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -44.19 -41.75 5.98 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 121.232 0.539 . . . . 0.0 110.597 179.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.802 ' HB2' ' HE1' ' A' ' 108' ' ' MET . . . -60.07 -65.09 0.74 Allowed 'General case' 0 N--CA 1.451 -0.422 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.494 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.805 ' HE3' ' HA ' ' A' ' 13' ' ' SER . 0.2 OUTLIER -55.88 -25.56 43.07 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.967 179.611 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 1.077 HG22 ' CG ' ' A' ' 75' ' ' LYS . 72.7 t -65.36 -64.62 0.68 Allowed 'Isoleucine or valine' 0 C--O 1.243 0.739 0 CA-C-O 121.657 0.741 . . . . 0.0 110.728 179.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.838 HD11 HD21 ' A' ' 100' ' ' LEU . 9.8 mp -63.86 -30.74 71.8 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.448 -179.591 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.996 HD12 HG23 ' A' ' 59' ' ' VAL . 2.1 mp -79.07 -26.4 43.04 Favored 'General case' 0 CA--C 1.511 -0.535 0 C-N-CA 120.759 -0.376 . . . . 0.0 111.256 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.554 ' HB2' ' O ' ' A' ' 114' ' ' LYS . 0.8 OUTLIER -66.38 -48.35 70.43 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 106.639 -1.615 . . . . 0.0 106.639 177.278 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.44 ' HB2' ' OD2' ' A' ' 72' ' ' ASP . . . -74.6 -25.35 59.19 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 114.992 -1.004 . . . . 0.0 109.695 177.1 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 1.089 ' HB1' HD21 ' A' ' 5' ' ' LEU . . . -68.73 -60.17 2.59 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.469 179.496 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.822 HD23 ' O ' ' A' ' 117' ' ' LEU . 1.0 OUTLIER -65.51 -33.77 76.71 Favored 'General case' 0 N--CA 1.444 -0.748 0 C-N-CA 120.202 -0.599 . . . . 0.0 109.695 179.638 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.549 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.1 OUTLIER -58.45 -46.47 86.5 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.828 179.494 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.619 ' HB2' HG12 ' A' ' 67' ' ' VAL . 2.4 tt0 -94.53 -29.82 14.71 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 113.769 1.025 . . . . 0.0 113.769 -177.769 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . 0.425 ' HB2' HD13 ' A' ' 5' ' ' LEU . 0.8 OUTLIER -96.42 -68.38 0.8 Allowed 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -177.399 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.47 ' OG ' ' N ' ' A' ' 126' ' ' GLY . 6.0 p -96.89 -66.0 0.93 Allowed 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 113.005 0.742 . . . . 0.0 113.005 -177.503 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . 0.608 ' O ' ' HB3' ' A' ' 127' ' ' ALA . . . 78.01 77.5 0.84 Allowed Glycine 0 N--CA 1.447 -0.628 0 N-CA-C 111.104 -0.798 . . . . 0.0 111.104 -178.374 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.608 ' HB3' ' O ' ' A' ' 126' ' ' GLY . . . 86.55 -39.2 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 -178.274 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . 0.4 ' CB ' ' O ' ' A' ' 127' ' ' ALA . 4.0 mtp180 165.12 45.58 0.0 OUTLIER 'General case' 0 C--O 1.232 0.164 0 CA-C-O 121.356 0.598 . . . . 0.0 111.064 178.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . 0.407 ' HA3' ' HA ' ' A' ' 125' ' ' SER . . . -59.37 -25.89 61.05 Favored Glycine 0 C--N 1.315 -0.627 0 CA-C-N 115.511 -0.768 . . . . 0.0 112.538 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 2.6 p . . . . . 0 C--O 1.248 1.003 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.896 179.927 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.146 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -72.76 128.99 37.17 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.821 0.343 . . . . 0.0 110.866 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -134.98 80.64 1.85 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.896 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 204' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.96 -65.65 0.65 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.15 -179.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 206' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -107.48 157.09 36.58 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.269 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . 0.449 ' HA ' ' HB2' ' A' ' 30' ' ' ASN . 7.6 Cg_endo -48.83 179.04 0.01 OUTLIER 'Trans proline' 0 C--N 1.345 0.368 0 C-N-CA 123.174 2.583 . . . . 0.0 112.691 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 208' ' ' PHE . . . . . 0.487 ' CE1' ' HA ' ' A' ' 11' ' ' GLN . 68.0 m-85 56.48 173.89 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.99 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 209' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 116.471 -0.332 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 120.777 0.323 . . . . 0.0 111.239 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . 0.547 ' HB2' HD21 ' A' ' 27' ' ' LEU . 0.2 OUTLIER -104.98 -162.98 0.92 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.899 -179.93 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.989 HD11 ' HB2' ' A' ' 8' ' ' LEU . 4.1 pp -68.89 -172.84 0.42 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.447 179.691 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . 0.488 ' O ' HD12 ' A' ' 3' ' ' LEU . 0.1 OUTLIER -63.97 130.72 45.21 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.135 0.493 . . . . 0.0 112.03 -179.035 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 1.049 HD21 ' HB1' ' A' ' 120' ' ' ALA . 0.1 OUTLIER -51.08 -65.74 0.5 Allowed 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.025 -179.939 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' SER . . . . . 0.426 ' OG ' ' N ' ' A' ' 128' ' ' ARG . 1.0 OUTLIER -48.96 -30.12 5.6 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.59 0.234 . . . . 0.0 111.418 -179.244 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . 0.536 ' O ' ' HB3' ' A' ' 11' ' ' GLN . 0.9 OUTLIER -73.39 -44.83 57.66 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.046 0.45 . . . . 0.0 109.973 179.385 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.989 ' HB2' HD11 ' A' ' 3' ' ' LEU . 1.5 tp -73.8 -30.57 62.8 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.964 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' HIS . . . . . 0.771 ' CG ' HD22 ' A' ' 121' ' ' LEU . 21.4 t60 -68.25 -54.3 18.59 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-O 121.677 0.751 . . . . 0.0 109.214 179.656 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.521 ' O ' ' HB2' ' A' ' 14' ' ' ARG . 0.6 OUTLIER -63.57 -36.89 85.29 Favored 'General case' 0 C--N 1.317 -0.804 0 CA-C-N 114.584 -1.189 . . . . 0.0 108.988 179.164 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.992 ' HG2' HG13 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -60.49 -65.47 0.68 Allowed 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.917 178.477 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.978 HG12 ' O ' ' A' ' 8' ' ' LEU . 5.7 p -56.69 -51.99 59.59 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.809 -179.984 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.515 ' O ' ' HB2' ' A' ' 17' ' ' GLN . 2.5 p -63.49 -27.3 69.18 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.224 -179.388 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.521 ' HB2' ' O ' ' A' ' 10' ' ' ARG . 0.0 OUTLIER -76.81 -41.03 45.94 Favored 'General case' 0 CA--C 1.514 -0.405 0 C-N-CA 120.281 -0.568 . . . . 0.0 111.344 -179.02 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.718 HD12 ' HA ' ' A' ' 12' ' ' VAL . 0.1 OUTLIER -68.67 -53.2 23.74 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 119.707 -0.797 . . . . 0.0 110.043 179.627 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.725 ' HA ' ' HB2' ' A' ' 20' ' ' SER . 10.4 p -65.47 -47.84 85.18 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 CA-C-N 115.691 -0.686 . . . . 0.0 112.75 -178.483 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 0.522 ' N ' HG13 ' A' ' 16' ' ' VAL . 1.0 OUTLIER -61.76 -18.65 60.64 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 120.169 -0.612 . . . . 0.0 110.964 -179.783 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.415 ' O ' ' HB2' ' A' ' 19' ' ' GLU . 1.5 pt20 -158.84 61.65 0.42 Allowed 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 120.73 -0.388 . . . . 0.0 111.869 179.557 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.476 ' N ' ' O ' ' A' ' 15' ' ' LEU . 0.0 OUTLIER 169.87 -44.59 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.331 179.339 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.773 ' CB ' HD13 ' A' ' 110' ' ' LEU . 14.7 m -105.69 -28.41 10.72 Favored 'General case' 0 C--N 1.332 -0.174 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.387 -179.39 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.405 ' O ' HG22 ' A' ' 16' ' ' VAL . . . 79.41 -59.7 4.35 Favored Glycine 0 N--CA 1.453 -0.224 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.245 -179.668 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -173.55 21.77 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 120.617 0.246 . . . . 0.0 111.227 179.712 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -61.09 -156.81 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.535 -0.302 . . . . 0.0 110.736 -179.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.74 HG21 ' CD2' ' A' ' 39' ' ' PHE . 0.3 OUTLIER -103.56 149.78 24.56 Favored 'General case' 0 C--N 1.333 -0.15 0 N-CA-C 110.117 -0.327 . . . . 0.0 110.117 179.854 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -105.0 128.54 9.48 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.448 -0.882 . . . . 0.0 113.224 -179.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.885 ' CG ' ' HB3' ' A' ' 32' ' ' ALA . 0.0 OUTLIER -104.6 129.19 52.73 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 109.236 -0.653 . . . . 0.0 109.236 178.884 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.638 HD12 ' CD2' ' A' ' 55' ' ' PHE . 0.3 OUTLIER -104.14 165.63 10.93 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.545 -179.024 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.564 ' HB2' ' O ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER 144.97 50.16 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 124.488 1.115 . . . . 0.0 109.949 179.891 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.583 ' C ' HD23 ' A' ' 3' ' ' LEU . . . 93.7 -9.61 73.38 Favored Glycine 0 C--N 1.332 0.341 0 C-N-CA 120.912 -0.661 . . . . 0.0 111.67 -179.1 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.466 ' C ' ' ND2' ' A' ' 30' ' ' ASN . 0.0 OUTLIER -165.58 156.17 13.44 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 179.713 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.992 HG13 ' HG2' ' A' ' 11' ' ' GLN . 0.6 OUTLIER -109.5 132.18 58.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 C-N-CA 119.785 -0.766 . . . . 0.0 111.237 179.727 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.885 ' HB3' ' CG ' ' A' ' 26' ' ' LYS . . . -117.41 166.96 11.71 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.869 -1.059 . . . . 0.0 110.859 -179.406 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.633 ' HB2' ' OG ' ' A' ' 20' ' ' SER . . . -103.28 119.49 38.97 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.16 0.505 . . . . 0.0 111.3 -179.393 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.636 ' HB3' ' HB ' ' A' ' 24' ' ' THR . 8.3 t30 -100.0 137.02 39.03 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.73 -179.728 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 1.7 ttmp? -121.9 9.9 10.1 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.51 179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -54.63 -61.02 2.58 Favored 'General case' 0 C--N 1.332 -0.152 0 CA-C-O 120.963 0.411 . . . . 0.0 110.428 179.709 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.543 HG23 ' CE1' ' A' ' 39' ' ' PHE . 0.1 OUTLIER -137.04 -78.94 0.39 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.264 179.339 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.774 ' O ' HG22 ' A' ' 109' ' ' THR . 9.3 t 176.03 -41.95 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.208 0 CA-C-O 121.059 0.457 . . . . 0.0 111.352 179.727 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.74 ' CD2' HG21 ' A' ' 24' ' ' THR . 9.0 m-85 59.52 135.68 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.798 0.809 . . . . 0.0 111.498 -178.966 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLN . . . . . 0.645 ' H ' ' NE2' ' A' ' 107' ' ' GLN . 0.3 OUTLIER -169.41 76.61 0.1 Allowed 'General case' 0 C--N 1.317 -0.806 0 CA-C-N 114.586 -1.188 . . . . 0.0 108.835 179.645 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.468 ' C ' ' HB2' ' A' ' 105' ' ' SER . . . 69.37 106.04 0.03 OUTLIER Glycine 0 N--CA 1.447 -0.615 0 CA-C-N 115.353 -0.839 . . . . 0.0 112.696 -178.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.688 ' HB2' ' NE2' ' A' ' 107' ' ' GLN . 5.3 tp -159.01 -141.77 0.09 Allowed 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 109.77 -0.455 . . . . 0.0 109.77 178.798 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -162.72 25.62 0.1 Allowed 'General case' 0 C--N 1.33 -0.241 0 O-C-N 122.204 -0.31 . . . . 0.0 111.693 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.887 HG23 ' O ' ' A' ' 48' ' ' ALA . 29.4 mt 63.36 5.04 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 179.576 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -87.18 -55.55 3.76 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.801 0.334 . . . . 0.0 111.474 -179.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -73.74 -28.34 61.64 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.152 -179.627 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . 152.14 80.19 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.813 -0.708 . . . . 0.0 112.196 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.887 ' O ' HG23 ' A' ' 44' ' ' ILE . . . -151.52 132.5 14.26 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.714 0.292 . . . . 0.0 111.21 -179.634 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.2 mtt-85 -68.14 -177.18 0.81 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.745 0.307 . . . . 0.0 110.398 179.232 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.886 ' O ' HG23 ' A' ' 54' ' ' VAL . 0.9 OUTLIER -87.8 -35.92 17.57 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.001 0.429 . . . . 0.0 110.766 179.821 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.607 ' CB ' ' HB2' ' A' ' 26' ' ' LYS . 18.2 p -56.05 -62.78 1.47 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.171 179.936 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.865 ' OE1' ' HB1' ' A' ' 48' ' ' ALA . 0.0 OUTLIER -34.72 -67.08 0.15 Allowed 'General case' 0 N--CA 1.475 0.822 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.882 -179.811 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.641 ' HD2' HD11 ' A' ' 44' ' ' ILE . 2.7 ptpt -56.87 -46.75 81.63 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.739 -0.664 . . . . 0.0 111.418 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.886 HG23 ' O ' ' A' ' 50' ' ' GLU . 97.8 t -54.7 -41.32 55.39 Favored 'Isoleucine or valine' 0 C--O 1.232 0.172 0 CA-C-O 121.046 0.45 . . . . 0.0 110.038 179.439 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.851 ' CZ ' ' HB1' ' A' ' 113' ' ' ALA . 1.9 t80 -61.63 -49.75 75.34 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.872 178.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.525 ' HB2' ' HB2' ' A' ' 108' ' ' MET . . . -50.44 -48.06 56.49 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.108 179.805 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -62.25 -47.02 86.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.639 179.581 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . 0.564 HG21 HD22 ' A' ' 27' ' ' LEU . 24.0 p -63.7 -49.5 72.87 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.378 -179.696 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . 0.96 ' O ' HG23 ' A' ' 63' ' ' VAL . 14.0 p -65.67 -48.89 80.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 C-N-CA 120.546 -0.461 . . . . 0.0 110.786 179.76 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.684 HD22 ' HG ' ' A' ' 103' ' ' LEU . 13.1 tp -50.25 -49.9 51.72 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.725 0.298 . . . . 0.0 110.774 179.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 2.6 m -63.93 -41.81 97.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.736 179.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' HIS . . . . . 0.587 ' HB3' HD22 ' A' ' 5' ' ' LEU . 0.1 OUTLIER -68.21 -20.86 64.87 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.961 179.756 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' VAL . . . . . 1.041 HG13 HG11 ' A' ' 66' ' ' VAL . 4.6 t -105.01 37.81 0.32 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 121.061 0.458 . . . . 0.0 111.121 -179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.484 ' O ' ' HB2' ' A' ' 65' ' ' ASN . . . -65.64 91.23 0.13 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.677 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.769 ' O ' HG22 ' A' ' 99' ' ' VAL . 10.0 m120 93.28 -61.11 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 115.679 -0.691 . . . . 0.0 112.22 179.514 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 1.041 HG11 HG13 ' A' ' 63' ' ' VAL . 33.7 m 39.03 -140.08 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.451 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 -179.387 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.851 HG22 ' CB ' ' A' ' 97' ' ' ASN . 4.6 p -175.62 67.42 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 CA-C-O 121.71 0.767 . . . . 0.0 111.215 179.63 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.791 HD23 ' HB3' ' A' ' 72' ' ' ASP . 2.4 mp -62.66 103.69 0.45 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.156 -0.929 . . . . 0.0 111.86 -179.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.872 ' HA ' ' HA ' ' A' ' 97' ' ' ASN . 0.6 OUTLIER -78.42 -177.88 5.48 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.642 179.278 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -37.34 -37.42 0.19 Allowed 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.3 -179.257 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.526 ' O ' ' HB2' ' A' ' 75' ' ' LYS . 2.5 tt0 -66.12 -65.43 0.68 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.987 -179.852 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.791 ' HB3' HD23 ' A' ' 68' ' ' LEU . 82.3 m-20 -60.3 -28.09 67.83 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.087 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 36.5 m -64.0 -64.06 0.99 Allowed 'General case' 0 C--O 1.239 0.516 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 178.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.499 ' HA ' ' CD2' ' A' ' 77' ' ' LEU . . . -56.68 -25.11 53.13 Favored 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 108.787 -0.819 . . . . 0.0 108.787 177.407 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 1.083 ' CG ' HG22 ' A' ' 115' ' ' VAL . 0.3 OUTLIER -59.35 -54.63 44.55 Favored 'General case' 0 N--CA 1.453 -0.289 0 CA-C-N 114.733 -1.121 . . . . 0.0 110.224 178.743 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.934 HD21 HD11 ' A' ' 116' ' ' LEU . 1.9 mt -64.49 -48.04 76.71 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 120.838 0.352 . . . . 0.0 110.181 179.272 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.641 HD12 ' C ' ' A' ' 77' ' ' LEU . 0.4 OUTLIER -63.83 -23.62 67.43 Favored 'General case' 0 CA--C 1.528 0.124 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.034 -179.765 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 29.0 mt-30 -78.37 -47.83 16.84 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.833 0.349 . . . . 0.0 110.883 179.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -64.6 -33.75 76.65 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.184 179.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' THR . . . . . 0.54 HG21 ' ND2' ' A' ' 86' ' ' ASN . 11.4 p -78.09 -62.8 1.56 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.943 179.918 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 77' ' ' LEU . 67.9 t -57.0 -24.36 20.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.128 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -47.14 -39.63 13.98 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 120.794 0.33 . . . . 0.0 110.936 179.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 175.36 163.58 0.29 Allowed 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.052 179.811 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.466 ' CB ' ' HG2' ' A' ' 40' ' ' GLN . 8.0 m-80 61.99 -173.84 0.14 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.221 179.675 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.512 HD22 ' N ' ' A' ' 85' ' ' LEU . 2.4 mm? -77.78 -175.66 4.04 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.396 -179.64 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.54 ' ND2' HG21 ' A' ' 80' ' ' THR . 58.9 t-20 -132.47 135.4 46.01 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.72 -179.706 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . 0.518 ' HA ' ' HB2' ' A' ' 104' ' ' ARG . 7.0 p30 -123.01 5.53 9.3 Favored 'General case' 0 C--O 1.243 0.738 0 CA-C-O 120.871 0.367 . . . . 0.0 111.968 -179.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.533 ' HA ' ' CB ' ' A' ' 102' ' ' SER . 1.3 m-85 -99.79 135.62 40.94 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 120.435 -0.506 . . . . 0.0 110.447 179.808 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.763 ' CG ' HG13 ' A' ' 101' ' ' VAL . 0.7 OUTLIER -107.47 142.44 37.33 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 108.473 -0.936 . . . . 0.0 108.473 -179.93 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.592 HD21 HD13 ' A' ' 76' ' ' LEU . 11.1 mt -132.23 147.24 52.4 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 113.337 0.865 . . . . 0.0 113.337 -176.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.47 127.81 34.09 Favored 'General case' 0 C--O 1.224 -0.261 0 N-CA-C 108.134 -1.061 . . . . 0.0 108.134 177.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . 0.715 ' O ' HG13 ' A' ' 93' ' ' VAL . 0.7 OUTLIER -104.39 145.95 29.53 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 113.955 1.094 . . . . 0.0 113.955 -177.428 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.715 HG13 ' O ' ' A' ' 92' ' ' SER . 4.9 m -166.62 -124.68 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 CA-C-N 113.691 -1.595 . . . . 0.0 108.558 179.09 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 36.85 34.33 0.1 OUTLIER Glycine 0 C--N 1.336 0.564 0 C-N-CA 121.143 -0.551 . . . . 0.0 114.202 178.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.407 ' O ' ' ND2' ' A' ' 95' ' ' ASN . 1.5 p-10 40.64 34.54 0.25 Allowed 'General case' 0 C--O 1.231 0.131 0 CA-C-O 121.325 0.583 . . . . 0.0 110.945 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 140.39 -3.82 2.46 Favored Glycine 0 N--CA 1.447 -0.568 0 CA-C-N 115.346 -0.843 . . . . 0.0 111.58 -179.026 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.872 ' HA ' ' HA ' ' A' ' 69' ' ' THR . 0.1 OUTLIER -112.8 166.36 11.44 Favored 'General case' 0 N--CA 1.448 -0.552 0 N-CA-C 109.864 -0.421 . . . . 0.0 109.864 179.702 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' SER . . . . . 0.531 ' O ' ' N ' ' A' ' 68' ' ' LEU . 3.1 t -140.19 163.02 33.85 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.482 0.658 . . . . 0.0 111.32 -179.517 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.769 HG22 ' O ' ' A' ' 65' ' ' ASN . 1.2 t -107.45 146.23 13.85 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 CA-C-N 115.04 -0.982 . . . . 0.0 108.74 178.912 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.567 ' HB3' HD11 ' A' ' 68' ' ' LEU . 0.1 OUTLIER -103.87 114.36 28.56 Favored 'General case' 0 CA--C 1.513 -0.454 0 C-N-CA 119.766 -0.774 . . . . 0.0 112.136 -179.662 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.763 HG13 ' CG ' ' A' ' 89' ' ' ASP . 0.9 OUTLIER -120.36 104.19 15.1 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.015 0 N-CA-C 104.288 -2.486 . . . . 0.0 104.288 175.453 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . 0.628 ' O ' HD23 ' A' ' 103' ' ' LEU . 0.9 OUTLIER -141.39 152.51 44.39 Favored 'General case' 0 C--N 1.307 -1.263 0 C-N-CA 119.807 -0.757 . . . . 0.0 112.713 -174.907 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.684 ' HG ' HD22 ' A' ' 60' ' ' LEU . 0.4 OUTLIER 147.7 59.66 0.0 OUTLIER 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 114.506 -1.224 . . . . 0.0 112.441 176.529 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.518 ' HB2' ' HA ' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -83.86 -6.38 59.41 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.308 -0.86 . . . . 0.0 108.739 177.434 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.643 ' HB3' ' N ' ' A' ' 42' ' ' LEU . 58.7 m -177.92 171.92 1.72 Allowed 'General case' 0 C--O 1.232 0.147 0 CA-C-N 114.553 -1.203 . . . . 0.0 108.105 179.258 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ASP . . . . . 0.555 ' O ' ' HB3' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -104.74 101.88 11.48 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 119.693 -0.803 . . . . 0.0 112.754 -178.492 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLN . . . . . 0.688 ' NE2' ' HB2' ' A' ' 42' ' ' LEU . 0.7 OUTLIER -169.76 162.99 9.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.273 177.534 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' MET . . . . . 0.603 ' HE2' ' HB3' ' A' ' 112' ' ' ASP . 0.3 OUTLIER -165.77 144.15 5.94 Favored 'General case' 0 C--N 1.327 -0.408 0 C-N-CA 120.426 -0.51 . . . . 0.0 112.142 179.005 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' THR . . . . . 0.774 HG22 ' O ' ' A' ' 38' ' ' THR . 30.2 p -110.11 165.29 11.86 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.719 179.362 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' LEU . . . . . 0.791 HD23 HG23 ' A' ' 12' ' ' VAL . 6.5 mt -52.46 -59.18 4.74 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.584 179.615 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' GLN . . . . . 0.835 ' O ' HG23 ' A' ' 115' ' ' VAL . 13.6 tp60 -47.67 -65.48 0.56 Allowed 'General case' 0 C--N 1.332 -0.183 0 CA-C-O 120.817 0.342 . . . . 0.0 110.634 179.577 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' ASP . . . . . 0.92 ' O ' HD22 ' A' ' 116' ' ' LEU . 16.5 m-20 -46.63 -45.98 19.49 Favored 'General case' 0 C--O 1.236 0.395 0 CA-C-O 121.477 0.656 . . . . 0.0 110.429 179.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.851 ' HB1' ' CZ ' ' A' ' 55' ' ' PHE . . . -51.65 -63.32 1.17 Allowed 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.35 179.256 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . 0.572 ' HE3' ' CG1' ' A' ' 16' ' ' VAL . 0.0 OUTLIER -62.04 -20.05 63.53 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.281 179.902 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 1.083 HG22 ' CG ' ' A' ' 75' ' ' LYS . 74.2 t -65.06 -65.11 0.59 Allowed 'Isoleucine or valine' 0 C--O 1.246 0.886 0 CA-C-O 122.013 0.911 . . . . 0.0 109.967 179.399 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.955 ' HB3' HG21 ' A' ' 63' ' ' VAL . 0.1 OUTLIER -61.62 -35.58 78.29 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.399 179.693 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' LEU . . . . . 0.916 HD21 HD23 ' A' ' 8' ' ' LEU . 0.3 OUTLIER -70.51 -24.24 62.8 Favored 'General case' 0 CA--C 1.512 -0.496 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.9 179.36 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' GLU . . . . . 0.524 ' HA ' ' CE1' ' A' ' 9' ' ' HIS . 1.7 tt0 -69.35 -46.85 66.02 Favored 'General case' 0 N--CA 1.443 -0.784 0 N-CA-C 106.741 -1.578 . . . . 0.0 106.741 177.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' ALA . . . . . 0.495 ' CB ' ' HG ' ' A' ' 68' ' ' LEU . . . -77.52 -22.18 51.57 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 114.695 -1.139 . . . . 0.0 110.236 177.651 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' ALA . . . . . 1.049 ' HB1' HD21 ' A' ' 5' ' ' LEU . . . -75.06 -56.71 4.46 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.78 179.471 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.771 HD22 ' CG ' ' A' ' 9' ' ' HIS . 0.0 OUTLIER -60.8 -37.43 81.93 Favored 'General case' 0 N--CA 1.447 -0.58 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 178.208 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' ARG . . . . . 0.5 ' HB3' ' O ' ' A' ' 118' ' ' GLU . 0.5 OUTLIER -60.99 -46.37 91.04 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.356 179.97 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.615 ' CG ' HG12 ' A' ' 67' ' ' VAL . 8.4 mm-40 -95.29 -19.5 19.93 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 113.806 1.039 . . . . 0.0 113.806 -177.762 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' GLU . . . . . 0.445 ' CG ' ' O ' ' A' ' 120' ' ' ALA . 2.9 mm-40 -95.32 -66.62 0.9 Allowed 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 112.867 0.691 . . . . 0.0 112.867 -178.393 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 1.2 p -96.07 -65.32 0.98 Allowed 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -178.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' GLY . . . . . 0.528 ' N ' ' O ' ' A' ' 121' ' ' LEU . . . 83.81 73.42 1.25 Allowed Glycine 0 N--CA 1.448 -0.544 0 N-CA-C 110.182 -1.167 . . . . 0.0 110.182 -177.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' ALA . . . . . 0.503 ' HB3' ' O ' ' A' ' 126' ' ' GLY . . . 74.55 32.44 0.91 Allowed 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 -177.418 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' ARG . . . . . 0.426 ' N ' ' OG ' ' A' ' 6' ' ' SER . 0.0 OUTLIER 77.68 112.92 0.07 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 114.823 -1.08 . . . . 0.0 110.931 -179.598 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . -92.55 19.62 49.58 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.784 -0.722 . . . . 0.0 112.572 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.0 m . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.261 -0.876 . . . . 0.0 110.893 179.983 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 201' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.088 . . . . . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 202' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -176.43 75.69 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.861 0.362 . . . . 0.0 110.889 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 58.85 -172.62 0.1 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.802 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 204' ' ' PTR . . . . . 0.411 ' O ' ' N ' ' B' ' 206' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . 27.8 m-20 -57.05 82.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.096 -0.502 . . . . 0.0 112.141 -178.833 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 206' ' ' ASP . . . . . 0.411 ' N ' ' O ' ' B' ' 204' ' ' PTR . 0.1 OUTLIER 49.87 175.63 0.02 OUTLIER Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.814 179.104 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 207' ' ' PRO . . . . . 0.586 ' HB3' HD22 ' A' ' 3' ' ' LEU . 77.7 Cg_endo -88.76 108.04 0.48 Allowed 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 122.925 2.417 . . . . 0.0 112.467 -179.845 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 208' ' ' PHE . . . . . 0.554 ' HB3' ' NE2' ' A' ' 11' ' ' GLN . 0.7 OUTLIER 35.95 -162.0 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.038 -0.528 . . . . 0.0 112.358 179.58 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 209' ' ' NH2 . . . . . 0.527 ' N ' ' CG ' ' B' ' 208' ' ' PHE . . . . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.649 -0.251 . . . . 0.0 . . . . . . . . . . 1 1 . 1 stop_ save_